A0A087YHW5_POEFO Loading...

HECT-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A087YHW5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 762 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	32.7	Very low	29.3	Very low	243 Å²	243	144.9 Å²	144.9	100%	1.197	87%	0.873	S	S	*	*				0	134.8	0	-97	178.2	151.3	0	0	107.3
2	D	30.9	Very low	29.1	Very low	163 Å²	163	148.5 Å²	148.5	87%	0.872	87%	0.874	S	S	*	*			trans	-63.2	153.5	-162.4	-57.8	-75.9	0	0	0	116.1
3	G	29.7	Very low	29.2	Very low	73 Å²	73	155.6 Å²	155.6	75%	0.753	88%	0.876	S	S	*	*			trans	90.3	107.4	136.1	0	0	0	0	0	118.3
4	E	28.6	Very low	29.2	Very low	204 Å²	204	158.3 Å²	158.3	95%	0.953	88%	0.878	S	S	*	*				-173.9	150.7	117.5	-102.4	-179.5	175.5	0	0	112.3
5	H	32.2	Very low	29.1	Very low	195 Å²	195	163.9 Å²	163.9	90%	0.903	88%	0.881	S	S	*	*			trans	-79.2	148.4	-163.4	-84.2	-90	0	0	0	116
6	S	28.1	Very low	29.2	Very low	111 Å²	111	165.9 Å²	165.9	78%	0.776	88%	0.883	S	S	*	*				153	125.1	115.7	-178.2	0	0	0	0	114.5
7	A	31.1	Very low	29.3	Very low	82 Å²	82	170.6 Å²	170.6	68%	0.678	89%	0.886	S	S	*	*			trans	49.8	114.9	146.4	0	0	0	0	0	121.4
8	L	29.4	Very low	29.1	Very low	171 Å²	171	170.5 Å²	170.5	90%	0.895	89%	0.885	S	S	*	*				175	142.7	120.9	-92.4	154.5	0	0	0	112.2
9	S	26.1	Very low	29.1	Very low	127 Å²	127	167.2 Å²	167.2	89%	0.888	88%	0.876	S	S	*	*			trans	88.2	130.9	156.9	81.3	0	0	0	0	120.6
10	G	26	Very low	29	Very low	77 Å²	77	164.4 Å²	164.4	79%	0.794	87%	0.868	S	S	*	*			trans	121.4	74.5	152.2	0	0	0	0	0	117.3
11	V	27.6	Very low	28.8	Very low	148 Å²	148	164 Å²	164	90%	0.897	87%	0.865	S	S	*	*			trans	-101.2	105.7	160.5	177.4	0	0	0	0	108.1
12	E	27.3	Very low	28.5	Very low	188 Å²	188	162.7 Å²	162.7	88%	0.879	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-78.2	136.2	168.8	-79	-172.1	143.6	0	0	110.7
13	R	29.5	Very low	28.1	Very low	241 Å²	241	161.1 Å²	161.1	91%	0.909	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-78.3	125	178.1	-76	175.8	173.6	172.9	-3	111
14	E	29.1	Very low	28	Very low	193 Å²	193	163 Å²	163	90%	0.902	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-63.9	131.6	163.6	-75.5	-175.7	136.4	0	0	111
15	R	28.9	Very low	27.7	Very low	243 Å²	243	158.5 Å²	158.5	92%	0.917	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-79.7	116.9	170.6	-79.6	180	176.4	-171.3	-0.6	109.6	R17	R15-R17 PolarHBondContact O-N 3Å
16	E	30.2	Very low	27.3	Very low	196 Å²	196	154.2 Å²	154.2	92%	0.916	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-61.3	124.5	169.1	-71.7	179.8	152.3	0	0	111.1
17	R	30.4	Very low	27.3	Very low	246 Å²	246	155.3 Å²	155.3	93%	0.928	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80.3	134.7	171.9	-72.4	179.2	-179	175.8	0.9	109.7	R15	R15-R17 PolarHBondContact O-N 3Å
18	L	26.4	Very low	27.1	Very low	168 Å²	168	157.2 Å²	157.2	88%	0.88	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-64.2	145.6	172.7	-71.5	162.9	0	0	0	111.6
19	P	29.2	Very low	27.1	Very low	108 Å²	108	157.4 Å²	157.4	70%	0.701	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-74.3	160.9	178.7	29.9	-33.5	0	0	0	112.8
20	P	27.4	Very low	27	Very low	111 Å²	111	155 Å²	155	72%	0.721	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-73.7	152.6	-167.6	29.8	-35.4	0	0	0	114.4
21	I	24.6	Very low	27.3	Very low	157 Å²	157	161.1 Å²	161.1	81%	0.805	83%	0.829	S	S	*	*			trans	-76.8	116	-178.4	-60.6	165.9	0	0	0	109.8	T23	I21-T23 HydrophobicContact CG2-CG2 4.12Å
22	Y	25.5	Very low	27.2	Very low	214 Å²	214	156.5 Å²	156.5	84%	0.839	81%	0.812	S	S	*	*			trans	-93	111.5	161.4	-79.9	-87	0	0	0	109.3	S24	Y22-S24 PolarHBondContact O-N 3.49Å
23	T	23.3	Very low	27.1	Very low	130 Å²	130	153.2 Å²	153.2	80%	0.798	81%	0.807	S	S	*	*			trans	-78.3	96.6	170.7	48.4	0	0	0	0	109.6	I21	I21-T23 HydrophobicContact CG2-CG2 4.12Å
24	S	26.6	Very low	27.4	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-87.2	119.6	163.6	60	0	0	0	0	109.5	Y22	Y22-S24 PolarHBondContact O-N 3.49Å
25	S	22.3	Very low	27.2	Very low	109 Å²	109	147 Å²	147	76%	0.762	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-54.5	149.5	171.7	-39.6	0	0	0	0	111.7
26	P	24.9	Very low	27.1	Very low	105 Å²	105	140.5 Å²	140.5	68%	0.682	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-72.6	139.9	-176.6	29.3	-32.3	0	0	0	111.2	V28	P26-V28 PolarHBondContact O-N 3.37Å
27	P	27	Very low	27.2	Very low	134 Å²	134	137.2 Å²	137.2	87%	0.87	76%	0.758	S	S	*	*			trans	-78.9	102.7	168	30.9	-27.6	0	0	0	108.3
28	V	27.1	Very low	27.1	Very low	121 Å²	121	130.9 Å²	130.9	73%	0.733	75%	0.749	S	S	*	*			trans	-91.3	111.5	166.3	177.2	0	0	0	0	108.3	P26	P26-V28 PolarHBondContact O-N 3.37Å
29	L	29.6	Very low	27.3	Very low	176 Å²	176	125.7 Å²	125.7	92%	0.921	73%	0.727	S	S	*	*	S	Bend	trans	30	110.5	151.6	-79.9	134.8	0	0	0	119.4
30	G	24.4	Very low	27.8	Very low	76 Å²	76	120.9 Å²	120.9	78%	0.784	70%	0.695	S	S	*	*			trans	169.6	41.3	162.9	0	0	0	0	0	111.8	G32	G30-G32 PolarHBondContact O-N 2.72Å
31	R	31.9	Very low	28.2	Very low	205 Å²	205	117.5 Å²	117.5	77%	0.774	68%	0.68	S	S	*	*			trans	-70.9	101.5	167.7	-77.6	-170.5	-175.8	-162.6	-0.2	106.5
32	G	25.5	Very low	28.8	Very low	51 Å²	51	112 Å²	112	53%	0.526	65%	0.654	S	S	.	*			trans	-52.9	158.9	160.7	0	0	0	0	0	109.7	G30 K34	G30-G32 PolarHBondContact O-N 2.72Å; G32-K34 PolarHBondContact O-N 3.27Å
33	P	25.6	Very low	29.4	Very low	120 Å²	120	103.3 Å²	103.3	78%	0.779	62%	0.621	S	S	*	*			trans	-55.5	118	179.6	23.9	-31.2	0	0	0	107.6	Q35	P33-Q35 PolarHBondContact O-N 2.9Å
34	K	36.3	Very low	30.2	Very low	134 Å²	134	98.7 Å²	98.7	58%	0.583	59%	0.591	S	S	*	*			trans	-59.2	97.5	163.7	-74.4	-175.8	176	-176.5	0	104.6	G32 D633	G32-K34 PolarHBondContact O-N 3.27Å; K34-D633 IonicContact NZ-OD2 3.17Å
35	Q	24.6	Very low	30.7	Very low	170 Å²	170	95.9 Å²	95.9	79%	0.794	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-59.7	129.7	168.4	-74.5	-167.3	-10.3	0	0	106.5	P33 F37	P33-Q35 PolarHBondContact O-N 2.9Å; Q35-F37 PolarHBondContact O-N 3.39Å; Q35-F37 VanDerWaalsContact O-N 3.16Å
36	P	26.3	Very low	31.1	Very low	106 Å²	106	93.1 Å²	93.1	69%	0.688	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-59.2	124.2	175.8	22.4	-29.5	0	0	0	108.2
37	F	32	Very low	31.3	Very low	126 Å²	126	89.2 Å²	89.2	55%	0.553	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-53.5	140.4	172.8	-101.6	-87.4	0	0	0	109.7	Q35 S39 T42 Y346	Q35-F37 PolarHBondContact O-N 3.39Å; Q35-F37 VanDerWaalsContact O-N 3.16Å; F37-S39 PolarHBondContact O-N 3.47Å; F37-T42 WeakPolarHBondContact O-CB 3.34Å; F37-T42 PolarHBondContact O-OG1 3.11Å; F37-Y346 HydrophobicContact CE2-CD1 4.36Å; F37-Y346 HydrophobicContact CE2-CE1 4.41Å; F37-Y346 HydrophobicContact CZ-CE1 4.48Å
38	P	28	Very low	31.7	Very low	113 Å²	113	86.4 Å²	86.4	73%	0.734	51%	0.506	S	S	*	.			trans	-75	76.7	161	32.2	-29.7	0	0	0	107.6
39	S	31.7	Very low	31.9	Very low	59 Å²	59	85.8 Å²	85.8	41%	0.413	50%	0.495	S	S	.	.	S	Bend	trans	-97.8	158.4	161.5	68.6	0	0	0	0	107.5	F37 G41 T42 F43	F37-S39 PolarHBondContact O-N 3.47Å; S39-G41 PolarHBondContact O-N 2.83Å; S39-T42 WeakPolarHBondContact O-CA 3.28Å; S39-T42 WeakPolarHBondContact O-CB 3.28Å; S39-T42 PolarHBondContact O-N 3.11Å; S39-F43 PolarHBondContact O-N 2.99Å
40	L	39.3	Very low	31.8	Very low	7 Å²	7	86.6 Å²	86.6	4%	0.037	49%	0.486	C	S	.	.	H	α-helix	trans	-52.2	-18.2	176	-151	93	0	0	0	113.2	F43 I44 H251 S307 L308	L40-F43 HydrophobicContact CD1-CD1 4.16Å; L40-F43 HydrophobicContact CG-CB 4.44Å; L40-F43 HydrophobicContact CG-CD1 4.03Å; L40-F43 CarbonylContact O-C 3.54Å; L40-F43 WeakPolarHBondContact O-CA 3.31Å; L40-F43 VanDerWaalsContact O-CB 3.32Å; L40-F43 WeakPolarHBondContact O-CB 3.4Å; L40-F43 PolarHBondContact O-N 2.86Å; L40-I44 WeakPolarHBondContact O-CG1 3.35Å; L40-I44 PolarHBondContact O-N 3.48Å; L40-H251 HydrophobicContact CD1-CB 3.81Å; L40-H251 WeakPolarHBondContact CD1-ND1 3.32Å; L40-S307 VanDerWaalsContact CD2-OG 3.24Å; L40-S307 WeakPolarHBondContact CD2-OG 3.29Å; L40-L308 HydrophobicContact CD1-CD2 4.28Å; L40-L308 HydrophobicContact CD2-CD2 3.53Å; L40-L308 HydrophobicContact CD2-CG 4.21Å
41	G	34.9	Very low	32.5	Very low	40 Å²	40	90.9 Å²	90.9	41%	0.412	48%	0.479	S	S	.	.	H	α-helix	trans	-67.7	-36.3	169	0	0	0	0	0	114.1	S39 F43 I44 S45	S39-G41 PolarHBondContact O-N 2.83Å; G41-F43 VanDerWaalsContact C-N 3.29Å; G41-I44 PolarHBondContact O-N 2.74Å; G41-S45 WeakPolarHBondContact O-CB 3.49Å; G41-S45 PolarHBondContact O-N 2.99Å
42	T	38.5	Very low	32.8	Very low	42 Å²	42	84.5 Å²	84.5	26%	0.258	46%	0.46	S	S	.	.	H	α-helix	trans	-70.1	-29.6	168.9	-50.3	0	0	0	0	110.5	F37 S39 T46	F37-T42 WeakPolarHBondContact O-CB 3.34Å; F37-T42 PolarHBondContact O-OG1 3.11Å; S39-T42 WeakPolarHBondContact O-CA 3.28Å; S39-T42 WeakPolarHBondContact O-CB 3.28Å; S39-T42 PolarHBondContact O-N 3.11Å; T42-T46 WeakPolarHBondContact O-CA 3.24Å; T42-T46 VanDerWaalsContact O-CB 3.25Å; T42-T46 WeakPolarHBondContact O-CB 3.36Å; T42-T46 WeakPolarHBondContact O-CG2 3.49Å; T42-T46 PolarHBondContact O-N 3.35Å; T42-T46 PolarHBondContact O-OG1 3.47Å
43	F	37.7	Very low	32.9	Very low	31 Å²	31	85.5 Å²	85.5	14%	0.136	46%	0.463	C	S	.	.	H	α-helix	trans	-69	-40.3	169.2	173.8	-100.5	0	0	0	112.9	S39 L40 G41 T46 L47 H252 V255	S39-F43 PolarHBondContact O-N 2.99Å; L40-F43 HydrophobicContact CD1-CD1 4.16Å; L40-F43 HydrophobicContact CG-CB 4.44Å; L40-F43 HydrophobicContact CG-CD1 4.03Å; L40-F43 CarbonylContact O-C 3.54Å; L40-F43 WeakPolarHBondContact O-CA 3.31Å; L40-F43 VanDerWaalsContact O-CB 3.32Å; L40-F43 WeakPolarHBondContact O-CB 3.4Å; L40-F43 PolarHBondContact O-N 2.86Å; G41-F43 VanDerWaalsContact C-N 3.29Å; F43-T46 VanDerWaalsContact CA-OG1 3.27Å; F43-T46 WeakPolarHBondContact CA-OG1 3.24Å; F43-T46 CarbonylContact O-C 3.05Å; F43-T46 PolarHBondContact O-N 3.42Å; F43-T46 PolarHBondContact O-OG1 3.33Å; F43-L47 HydrophobicContact CD1-CD1 3.73Å; F43-L47 HydrophobicContact CD1-CG 4.43Å; F43-L47 HydrophobicContact CD2-CD1 4.42Å; F43-L47 HydrophobicContact CD2-CG 4.38Å; F43-L47 HydrophobicContact CE1-CD1 3.24Å; F43-L47 HydrophobicContact CE1-CG 4.18Å; F43-L47 HydrophobicContact CE2-CD1 3.98Å; F43-L47 HydrophobicContact CE2-CD2 4.45Å; F43-L47 HydrophobicContact CE2-CG 4.1Å; F43-L47 HydrophobicContact CG-CD1 4.31Å; F43-L47 HydrophobicContact CZ-CD1 3.39Å; F43-L47 HydrophobicContact CZ-CD2 4.4Å; F43-L47 HydrophobicContact CZ-CG 4.01Å; F43-L47 VanDerWaalsContact O-CB 3.22Å; F43-L47 WeakPolarHBondContact O-CB 3.16Å; F43-L47 VanDerWaalsContact O-CG 3.25Å; F43-L47 WeakPolarHBondContact O-CG 3.48Å; F43-L47 PolarHBondContact O-N 2.87Å; F43-H252 HydrophobicContact CE2-CB 3.95Å; F43-H252 AromaticContact CE2-ND1 3.8Å; F43-H252 HydrophobicContact CZ-CB 3.54Å; F43-H252 AromaticContact CZ-CG 3.76Å; F43-H252 AromaticContact CZ-ND1 3.35Å; F43-H252 VanDerWaalsContact CZ-ND1 3.35Å; F43-H252 WeakPolarHBondContact CZ-ND1 3.49Å; F43-V255 HydrophobicContact CE1-CG2 4.41Å
44	I	39.4	Very low	33	Very low	34 Å²	34	83.5 Å²	83.5	17%	0.174	47%	0.465	C	S	.	.	H	α-helix	trans	-65.5	-43	171.8	-67.8	168.1	0	0	0	110.6	L40 G41 L47 S48 A311	L40-I44 WeakPolarHBondContact O-CG1 3.35Å; L40-I44 PolarHBondContact O-N 3.48Å; G41-I44 PolarHBondContact O-N 2.74Å; I44-L47 PolarHBondContact O-N 3.34Å; I44-S48 WeakPolarHBondContact O-CB 3.03Å; I44-S48 PolarHBondContact O-N 3.35Å; I44-A311 HydrophobicContact CD1-CB 3.84Å; I44-A311 HydrophobicContact CG1-CB 3.61Å
45	S	36.8	Very low	32.7	Very low	55 Å²	55	80.4 Å²	80.4	39%	0.385	47%	0.471	S	S	.	.	H	α-helix	trans	-65.4	-41.3	174.8	-172	0	0	0	0	112	G41 S48 Q49	G41-S45 WeakPolarHBondContact O-CB 3.49Å; G41-S45 PolarHBondContact O-N 2.99Å; S45-S48 WeakPolarHBondContact O-CB 3.35Å; S45-S48 PolarHBondContact O-N 3.4Å; S45-Q49 WeakPolarHBondContact O-CB 3.49Å; S45-Q49 WeakPolarHBondContact O-CG 3.41Å; S45-Q49 PolarHBondContact O-N 2.81Å
46	T	31	Very low	32.8	Very low	51 Å²	51	83.3 Å²	83.3	31%	0.313	48%	0.475	S	S	.	.	H	α-helix	trans	-76.9	-22.7	175.4	45.6	0	0	0	0	113.8	T42 F43 Q49 R50	T42-T46 WeakPolarHBondContact O-CA 3.24Å; T42-T46 VanDerWaalsContact O-CB 3.25Å; T42-T46 WeakPolarHBondContact O-CB 3.36Å; T42-T46 WeakPolarHBondContact O-CG2 3.49Å; T42-T46 PolarHBondContact O-N 3.35Å; T42-T46 PolarHBondContact O-OG1 3.47Å; F43-T46 VanDerWaalsContact CA-OG1 3.27Å; F43-T46 WeakPolarHBondContact CA-OG1 3.24Å; F43-T46 CarbonylContact O-C 3.05Å; F43-T46 PolarHBondContact O-N 3.42Å; F43-T46 PolarHBondContact O-OG1 3.33Å; T46-Q49 CarbonylContact O-C 3.44Å; T46-R50 WeakPolarHBondContact O-CA 3.37Å; T46-R50 WeakPolarHBondContact O-CB 3.12Å; T46-R50 VanDerWaalsContact O-CG 3.23Å; T46-R50 WeakPolarHBondContact O-CG 3.5Å; T46-R50 PolarHBondContact O-N 2.94Å
47	L	30.3	Very low	32.6	Very low	23 Å²	23	82 Å²	82	12%	0.12	48%	0.48	C	S	.	.	H	α-helix	trans	-73.3	-40.4	168	-82.3	173.7	0	0	0	111	F43 I44 Q49 R50 R51 V315	F43-L47 HydrophobicContact CD1-CD1 3.73Å; F43-L47 HydrophobicContact CD1-CG 4.43Å; F43-L47 HydrophobicContact CD2-CD1 4.42Å; F43-L47 HydrophobicContact CD2-CG 4.38Å; F43-L47 HydrophobicContact CE1-CD1 3.24Å; F43-L47 HydrophobicContact CE1-CG 4.18Å; F43-L47 HydrophobicContact CE2-CD1 3.98Å; F43-L47 HydrophobicContact CE2-CD2 4.45Å; F43-L47 HydrophobicContact CE2-CG 4.1Å; F43-L47 HydrophobicContact CG-CD1 4.31Å; F43-L47 HydrophobicContact CZ-CD1 3.39Å; F43-L47 HydrophobicContact CZ-CD2 4.4Å; F43-L47 HydrophobicContact CZ-CG 4.01Å; F43-L47 VanDerWaalsContact O-CB 3.22Å; F43-L47 WeakPolarHBondContact O-CB 3.16Å; F43-L47 VanDerWaalsContact O-CG 3.25Å; F43-L47 WeakPolarHBondContact O-CG 3.48Å; F43-L47 PolarHBondContact O-N 2.87Å; I44-L47 PolarHBondContact O-N 3.34Å; L47-Q49 VanDerWaalsContact C-N 3.33Å; L47-R50 PolarHBondContact O-N 2.89Å; L47-R51 PolarHBondContact O-N 3.41Å; L47-R51 VanDerWaalsContact O-N 3.09Å; L47-V315 HydrophobicContact CB-CG1 4.34Å; L47-V315 HydrophobicContact CD1-CG1 4.19Å
48	S	33.9	Very low	32.3	Very low	74 Å²	74	84.9 Å²	84.9	52%	0.517	49%	0.493	S	S	.	.	H	α-helix	trans	-57.9	-47.6	167.7	-164.4	0	0	0	0	110.1	I44 S45 R51 D52	I44-S48 WeakPolarHBondContact O-CB 3.03Å; I44-S48 PolarHBondContact O-N 3.35Å; S45-S48 WeakPolarHBondContact O-CB 3.35Å; S45-S48 PolarHBondContact O-N 3.4Å; S48-R51 WeakPolarHBondContact O-CB 3.5Å; S48-R51 PolarHBondContact O-N 2.94Å; S48-D52 VanDerWaalsContact O-OD2 3.06Å
49	Q	31.6	Very low	32	Very low	108 Å²	108	84.3 Å²	84.3	51%	0.505	50%	0.497	S	S	.	.	H	α-helix	trans	-73.1	-22.6	177.4	-66.8	170.4	1.8	0	0	115	S45 T46 L47 D52 A53	S45-Q49 WeakPolarHBondContact O-CB 3.49Å; S45-Q49 WeakPolarHBondContact O-CG 3.41Å; S45-Q49 PolarHBondContact O-N 2.81Å; T46-Q49 CarbonylContact O-C 3.44Å; L47-Q49 VanDerWaalsContact C-N 3.33Å; Q49-D52 WeakPolarHBondContact CA-OD2 3.37Å; Q49-D52 CarbonylContact O-C 3.56Å; Q49-D52 VanDerWaalsContact O-CA 3.31Å; Q49-D52 WeakPolarHBondContact O-CA 3.22Å; Q49-D52 WeakPolarHBondContact O-CB 3.5Å; Q49-D52 PolarHBondContact O-N 3.4Å; Q49-A53 PolarHBondContact O-N 3.25Å
50	R	28.8	Very low	31.7	Very low	193 Å²	193	88.8 Å²	88.8	73%	0.728	52%	0.515	S	S	*	.	H	α-helix	trans	-81.9	-25.8	175.7	-85.2	-174.1	-176.5	-167.1	3.4	112.2	T46 L47 D52 A53 G54	T46-R50 WeakPolarHBondContact O-CA 3.37Å; T46-R50 WeakPolarHBondContact O-CB 3.12Å; T46-R50 VanDerWaalsContact O-CG 3.23Å; T46-R50 WeakPolarHBondContact O-CG 3.5Å; T46-R50 PolarHBondContact O-N 2.94Å; L47-R50 PolarHBondContact O-N 2.89Å; R50-D52 PolarHBondContact O-N 2.9Å; R50-A53 PolarHBondContact O-N 2.88Å; R50-G54 PolarHBondContact O-N 3.46Å
51	R	39.1	Very low	31	Very low	166 Å²	166	92 Å²	92	63%	0.626	55%	0.55	S	S	*	*	H	α-helix	trans	-56.9	-32.1	157.8	-169.8	-178.2	179.5	178.8	-0.3	110.3	L47 S48	L47-R51 PolarHBondContact O-N 3.41Å; L47-R51 VanDerWaalsContact O-N 3.09Å; S48-R51 WeakPolarHBondContact O-CB 3.5Å; S48-R51 PolarHBondContact O-N 2.94Å
52	D	36.8	Very low	30.4	Very low	72 Å²	72	98.5 Å²	98.5	39%	0.385	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-8.1	-177.6	-50.8	-35	0	0	0	115.1	S48 Q49 R50 T535	S48-D52 VanDerWaalsContact O-OD2 3.06Å; Q49-D52 WeakPolarHBondContact CA-OD2 3.37Å; Q49-D52 CarbonylContact O-C 3.56Å; Q49-D52 VanDerWaalsContact O-CA 3.31Å; Q49-D52 WeakPolarHBondContact O-CA 3.22Å; Q49-D52 WeakPolarHBondContact O-CB 3.5Å; Q49-D52 PolarHBondContact O-N 3.4Å; R50-D52 PolarHBondContact O-N 2.9Å; D52-T535 WeakPolarHBondContact CB-OG1 3.48Å; D52-T535 WeakPolarHBondContact OD1-CB 3.41Å; D52-T535 VanDerWaalsContact OD1-CG2 3.32Å; D52-T535 WeakPolarHBondContact OD1-CG2 3.25Å; D52-T535 PolarHBondContact OD1-OG1 3.22Å; D52-T535 PolarHBondContact OD2-OG1 3.17Å
53	A	28.7	Very low	29.6	Very low	71 Å²	71	100 Å²	100	59%	0.587	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	-1.8	-177	0	0	0	0	0	115	Q49 R50 G55	Q49-A53 PolarHBondContact O-N 3.25Å; R50-A53 PolarHBondContact O-N 2.88Å; A53-G55 PolarHBondContact O-N 3.05Å
54	G	27.6	Very low	28.9	Very low	79 Å²	79	102 Å²	102	81%	0.814	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	61.7	177.5	0	0	0	0	0	113.3	R50	R50-G54 PolarHBondContact O-N 3.46Å
55	G	29.8	Very low	28.4	Very low	69 Å²	69	105.9 Å²	105.9	71%	0.711	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175.3	28.6	-178.6	0	0	0	0	0	114.7	A53	A53-G55 PolarHBondContact O-N 3.05Å
56	R	26.5	Very low	27.8	Very low	231 Å²	231	110.6 Å²	110.6	87%	0.872	67%	0.674	S	S	*	*			trans	-144.4	93.6	170.8	-64.7	-172.3	-157.9	-169.8	7.4	111.1
57	G	22.1	Very low	27.5	Very low	78 Å²	78	115.1 Å²	115.1	80%	0.804	70%	0.702	S	S	*	*			trans	-97.7	106.5	156.6	0	0	0	0	0	108.2
58	F	25.1	Very low	27	Very low	187 Å²	187	117.5 Å²	117.5	82%	0.82	73%	0.732	S	S	*	*			trans	-125.3	107.6	164.3	-86.5	-77.1	0	0	0	109
59	A	23.1	Very low	27	Very low	100 Å²	100	119.4 Å²	119.4	83%	0.826	74%	0.743	S	S	*	*			trans	-71	132	161	0	0	0	0	0	108.5
60	I	25.1	Very low	26.6	Very low	153 Å²	153	122.2 Å²	122.2	79%	0.785	76%	0.76	S	S	*	*			trans	-126.1	103	165.1	-62.1	-179.1	0	0	0	107.2
61	G	24.3	Very low	26.3	Very low	75 Å²	75	116 Å²	116	77%	0.773	76%	0.756	S	S	*	*			trans	-75.5	139.5	164.8	0	0	0	0	0	110.2
62	I	22.9	Very low	25.6	Very low	177 Å²	177	115 Å²	115	91%	0.908	76%	0.762	S	S	*	*			trans	-87.3	129.4	-180	-64.2	173.1	0	0	0	109.1
63	G	22	Very low	25	Very low	74 Å²	74	121.6 Å²	121.6	76%	0.763	78%	0.781	S	S	*	*			trans	-154.2	114.8	162.4	0	0	0	0	0	109.7
64	G	21.6	Very low	24.8	Very low	72 Å²	72	126 Å²	126	74%	0.742	79%	0.79	S	S	*	*			trans	-74.2	-167.6	170.1	0	0	0	0	0	112.3
65	P	30.3	Very low	24.6	Very low	115 Å²	115	128.7 Å²	128.7	75%	0.747	79%	0.79	S	S	*	*			cis	-146.6	167.8	34.2	31.6	-6.8	0	0	0	118.7
66	L	23.3	Very low	24.3	Very low	155 Å²	155	131 Å²	131	81%	0.812	79%	0.79	S	S	*	*			trans	59.4	122	140.2	-65.1	162.3	0	0	0	122.4
67	T	24.4	Very low	24.2	Very low	145 Å²	145	132 Å²	132	89%	0.89	79%	0.794	S	S	*	*				173.6	132.2	109.4	33.8	0	0	0	0	111.2
68	G	20	Very low	24.2	Very low	73 Å²	73	135.8 Å²	135.8	75%	0.753	79%	0.791	S	S	*	*			trans	-92.5	-155.1	169.3	0	0	0	0	0	111.7
69	P	33.5	Very low	24	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	79%	0.788	S	S	*	*			cis	-144.3	-168.8	2.4	34.3	-9.6	0	0	0	116
70	L	23.6	Very low	24.2	Very low	166 Å²	166	134.6 Å²	134.6	87%	0.869	79%	0.785	S	S	*	*			trans	92.5	127.8	157.6	-56.3	153.7	0	0	0	117.7
71	G	23	Very low	24.3	Very low	62 Å²	62	132.9 Å²	132.9	64%	0.639	78%	0.783	S	S	*	*			cis	171.1	152.2	-5.5	0	0	0	0	0	113.1
72	I	24.9	Very low	24.4	Very low	147 Å²	147	137.8 Å²	137.8	75%	0.754	79%	0.79	S	S	*	*			trans	74	129.7	135.3	-60.8	175.3	0	0	0	117.2
73	R	23.2	Very low	24.5	Very low	210 Å²	210	135.1 Å²	135.1	79%	0.792	79%	0.786	S	S	*	*			cis	-169.8	148.8	19.9	-112.9	169.9	-175.5	-175.7	1.2	113.5
74	H	25.3	Very low	24.5	Very low	164 Å²	164	135.9 Å²	135.9	76%	0.759	78%	0.78	S	S	*	*			trans	39.5	146.2	139.3	-68.9	-51	0	0	0	122.7
75	T	23.1	Very low	24.6	Very low	134 Å²	134	139.6 Å²	139.6	82%	0.822	78%	0.782	S	S	*	*			cis	-166.1	163.3	31	-6.9	0	0	0	0	113
76	V	23.5	Very low	24.5	Very low	119 Å²	119	140.2 Å²	140.2	72%	0.721	78%	0.784	S	S	*	*			trans	-94.9	160.6	-169.1	168.5	0	0	0	0	113.7	E78	V76-E78 HydrophobicContact CG1-CG 3.96Å
77	R	23.1	Very low	24.6	Very low	251 Å²	251	144 Å²	144	95%	0.947	79%	0.787	S	S	*	*			trans	-143.8	125	146.1	-145.5	175	-172.1	-178	1.7	112
78	E	21.8	Very low	24.6	Very low	158 Å²	158	145.4 Å²	145.4	74%	0.738	78%	0.784	S	S	*	*			trans	-84	168.1	-174.7	-64.2	176.7	144.5	0	0	113.9	V76	V76-E78 HydrophobicContact CG1-CG 3.96Å
79	L	22.9	Very low	24.9	Very low	146 Å²	146	150.4 Å²	150.4	76%	0.764	79%	0.785	S	S	*	*				174.7	176.8	74.2	-90.1	167	0	0	0	109.1
80	P	26.9	Very low	24.6	Very low	116 Å²	116	152.9 Å²	152.9	75%	0.753	79%	0.786	S	S	*	*			cis	-132.6	-177.7	-2	31.1	-6.7	0	0	0	115.5
81	P	26.7	Very low	24.8	Very low	117 Å²	117	156.6 Å²	156.6	76%	0.76	79%	0.789	S	S	*	*			trans	-107.4	165.6	-159.7	40	-30.8	0	0	0	115.5
82	I	27.1	Very low	25	Very low	177 Å²	177	161.6 Å²	161.6	91%	0.908	80%	0.8	S	S	*	*			trans	-122.1	139.8	163.2	-62.8	177.7	0	0	0	109.4
83	C	23.5	Very low	24.9	Very low	121 Å²	121	159.7 Å²	159.7	82%	0.818	80%	0.8	S	S	*	*			trans	-57.2	154	-162	-128.9	0	0	0	0	118.2
84	S	23.5	Very low	25.7	Very low	91 Å²	91	157.1 Å²	157.1	64%	0.636	80%	0.8	S	S	*	*			trans	-72.4	147.8	170.1	47.4	0	0	0	0	113.7
85	D	23.5	Very low	26	Very low	150 Å²	150	156 Å²	156	80%	0.802	80%	0.8	S	S	*	*				-161.3	113.8	120.7	-94.3	-24.1	0	0	0	114
86	V	26.7	Very low	26.3	Very low	128 Å²	128	156.3 Å²	156.3	78%	0.776	80%	0.802	S	S	*	*			trans	64.8	99	140.1	-163.7	0	0	0	0	120.7
87	R	26.7	Very low	26.6	Very low	235 Å²	235	158.5 Å²	158.5	89%	0.887	81%	0.809	S	S	*	*			trans	-78.1	138.9	144.1	-95.2	-179.8	170.8	-178.9	-1.1	109.9
88	Q	24.6	Very low	27	Very low	174 Å²	174	151.4 Å²	151.4	81%	0.813	80%	0.795	S	S	*	*				160	125.9	118.7	-91.9	-178.3	-6.7	0	0	111.1
89	K	26.4	Very low	27.7	Very low	177 Å²	177	153.4 Å²	153.4	77%	0.77	80%	0.804	S	S	*	*				-177.2	129.2	105.6	-98.7	178.9	-179.5	-179.4	0	113.3
90	Q	26.7	Very low	28.2	Very low	168 Å²	168	154.7 Å²	154.7	79%	0.785	81%	0.806	S	S	*	*			trans	66.2	110.2	138.8	-72.4	171.4	-42.5	0	0	121.8
91	R	28.2	Very low	28.7	Very low	243 Å²	243	155.9 Å²	155.9	92%	0.917	81%	0.811	S	S	*	*			trans	-78.7	141	141.4	-86.3	-177	178.9	-170	-0.6	109.9
92	L	25.9	Very low	28.9	Very low	167 Å²	167	159.2 Å²	159.2	87%	0.874	81%	0.814	S	S	*	*			trans	167.2	138.7	149.9	-87.7	160.4	0	0	0	103.8
93	S	24.7	Very low	29	Very low	108 Å²	108	154.6 Å²	154.6	76%	0.755	80%	0.802	S	S	*	*			cis	-164.4	160.6	12.9	43.3	0	0	0	0	108.2	D95	S93-D95 PolarHBondContact O-N 3.2Å
94	I	39.3	Very low	29.4	Very low	156 Å²	156	154.5 Å²	154.5	80%	0.8	80%	0.8	S	S	*	*			trans	-68.3	119.1	170.7	-70.3	158.4	0	0	0	109.2
95	D	30.6	Very low	29.9	Very low	141 Å²	141	158.6 Å²	158.6	75%	0.754	81%	0.806	S	S	*	*			trans	160.8	144	136.7	-91.1	-30.7	0	0	0	110.8	S93	S93-D95 PolarHBondContact O-N 3.2Å
96	T	31.1	Very low	30.5	Very low	140 Å²	140	157.2 Å²	157.2	86%	0.859	81%	0.805	S	S	*	*			trans	81	86.4	-179.2	61.1	0	0	0	0	117.6
97	L	29.4	Very low	31.1	Very low	165 Å²	165	157 Å²	157	86%	0.864	81%	0.808	S	S	*	*			trans	-74.5	133.2	159.5	-80.5	157.1	0	0	0	110.2
98	P	30.5	Very low	32.3	Very low	102 Å²	102	151.7 Å²	151.7	66%	0.662	80%	0.798	S	S	*	*			trans	-76	145	156.4	20.3	-9.9	0	0	0	109.9	E100	P98-E100 PolarHBondContact O-N 3.33Å
99	Q	36.4	Very low	33.8	Very low	199 Å²	199	146.9 Å²	146.9	93%	0.93	78%	0.781	S	S	*	*			trans	-60.9	95.1	173.4	-86.6	179.1	-21.8	0	0	110.3	V101	Q99-V101 PolarHBondContact O-N 3.08Å
100	E	34.8	Very low	35.6	Very low	174 Å²	174	144.2 Å²	144.2	81%	0.813	78%	0.78	S	S	*	*			trans	-73.3	123.7	164.2	-77.1	-179.5	167.3	0	0	109.1	P98 K102	P98-E100 PolarHBondContact O-N 3.33Å; E100-K102 PolarHBondContact O-N 3.41Å
101	V	36.1	Very low	37.6	Very low	141 Å²	141	136.6 Å²	136.6	86%	0.855	74%	0.744	S	S	*	*			trans	-51.1	110	170.7	177.1	0	0	0	0	108.3	Q99 A103	Q99-V101 PolarHBondContact O-N 3.08Å; V101-A103 PolarHBondContact O-N 2.92Å
102	K	30.3	Very low	39.7	Very low	187 Å²	187	127.3 Å²	127.3	81%	0.813	72%	0.715	S	S	*	*			trans	-52.5	105.1	166.9	-82.5	177.8	174.8	176.6	0	107.9	E100	E100-K102 PolarHBondContact O-N 3.41Å
103	A	30.9	Very low	41.7	Very low	79 Å²	79	126.4 Å²	126.4	65%	0.653	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-54.5	129.4	156.6	0	0	0	0	0	106.7	V101 F105	V101-A103 PolarHBondContact O-N 2.92Å; A103-F105 PolarHBondContact O-N 3.04Å; A103-F105 VanDerWaalsContact O-N 3.17Å
104	P	31.5	Very low	43.9	Very low	119 Å²	119	124.7 Å²	124.7	77%	0.773	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-57.9	126.5	177.2	-18.2	29	0	0	0	108.2
105	F	33.3	Very low	45.1	Very low	178 Å²	178	123.4 Å²	123.4	78%	0.781	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-50.6	131.5	158.5	-68.6	-86.7	0	0	0	106.7	A103 C107	A103-F105 PolarHBondContact O-N 3.04Å; A103-F105 VanDerWaalsContact O-N 3.17Å; F105-C107 PolarHBondContact O-N 2.62Å
106	P	36.7	Very low	47.5	Very low	120 Å²	120	119.3 Å²	119.3	78%	0.779	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-55.6	116.8	171.2	22.5	-29.7	0	0	0	106.8	D108	P106-D108 PolarHBondContact O-N 3.15Å
107	C	39.9	Very low	50.1	Low	123 Å²	123	115.7 Å²	115.7	83%	0.831	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-59.7	127	172.7	-82.4	0	0	0	0	107.1	F105	F105-C107 PolarHBondContact O-N 2.62Å
108	D	50.7	Low	52.8	Low	125 Å²	125	110 Å²	110	67%	0.668	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-51.1	134.3	168.9	-71.3	-41.2	0	0	0	108.3	P106 V110	P106-D108 PolarHBondContact O-N 3.15Å; D108-V110 PolarHBondContact O-N 3.48Å
109	P	57.4	Low	55.5	Low	72 Å²	72	112.8 Å²	112.8	47%	0.468	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-58.2	128	-177.7	21.9	-31	0	0	0	109.7	I111 V149	P109-I111 PolarHBondContact O-N 2.66Å; P109-V149 HydrophobicContact CB-CG2 4.47Å; P109-V149 HydrophobicContact CG-CG2 4.48Å
110	V	63.9	Low	58.1	Low	122 Å²	122	107.3 Å²	107.3	74%	0.739	59%	0.588	S	S	*	*			trans	-64.2	112.1	176.4	-180	0	0	0	0	108.1	D108 P112	D108-V110 PolarHBondContact O-N 3.48Å; V110-P112 WeakPolarHBondContact O-CD 3.28Å
111	I	67.1	Low	60.8	Low	8 Å²	8	99 Å²	99	4%	0.041	55%	0.55	C	S	.	.			trans	-70.6	125	179.6	-66.7	167.8	0	0	0	108.2	P109 L113 N152 A153 K156 A159	P109-I111 PolarHBondContact O-N 2.66Å; I111-L113 PolarHBondContact O-N 3.05Å; I111-N152 HydrophobicContact CD1-CB 4.17Å; I111-A153 VanDerWaalsContact CG2-CA 3.44Å; I111-A153 HydrophobicContact CG2-CB 3.8Å; I111-K156 HydrophobicContact CD1-CD 4.06Å; I111-A159 HydrophobicContact CB-CB 4.23Å; I111-A159 VanDerWaalsContact CD1-O 3.29Å; I111-A159 WeakPolarHBondContact CD1-O 3.34Å; I111-A159 HydrophobicContact CG2-CB 3.95Å
112	P	72.3	Confident	63.5	Low	48 Å²	48	95.2 Å²	95.2	31%	0.312	52%	0.523	S	S	.	.			trans	-54.3	134.9	175.4	-25.6	32.1	0	0	0	112	V110 R114 A153	V110-P112 WeakPolarHBondContact O-CD 3.28Å; P112-R114 PolarHBondContact O-N 3.33Å; P112-A153 HydrophobicContact CB-CB 4.04Å; P112-A153 HydrophobicContact CG-CB 4.27Å; P112-A153 VanDerWaalsContact O-CB 3.31Å; P112-A153 WeakPolarHBondContact O-CB 3.27Å
113	L	67.9	Low	66.4	Low	148 Å²	148	91.3 Å²	91.3	78%	0.775	51%	0.507	S	S	*	.			trans	-73.3	113.9	173.8	-81.4	152.1	0	0	0	109.4	I111 A159	I111-L113 PolarHBondContact O-N 3.05Å; L113-A159 HydrophobicContact CD2-CB 4.14Å; L113-A159 HydrophobicContact CG-CB 4.44Å
114	R	72	Confident	69.3	Low	72 Å²	72	88.6 Å²	88.6	27%	0.272	48%	0.482	S	S	.	.			trans	-118.4	135.3	168.4	-62.6	-168.5	179.9	-172.5	8	110	P112 T143 T144 E150 A153	P112-R114 PolarHBondContact O-N 3.33Å; R114-T143 VanDerWaalsContact NH2-CB 3.32Å; R114-T143 PolarHBondContact NH2-O 3.05Å; R114-T143 VanDerWaalsContact NH2-O 3.12Å; R114-T144 PolarHBondContact NH1-OG1 2.96Å; R114-E150 IonicContact CZ-OE2 3.93Å; R114-E150 IonicContact NE-OE2 3.83Å; R114-E150 IonicContact NH2-OE2 2.99Å; R114-E150 PolarHBondContact NH2-OE2 3.48Å; R114-A153 HydrophobicContact CG-CB 4.23Å
115	T	64.3	Low	72.2	Confident	128 Å²	128	83.3 Å²	83.3	79%	0.785	45%	0.447	S	S	*	.			trans	-111.8	0.3	-173.5	50	0	0	0	0	114	T117	T115-T117 PolarHBondContact O-N 2.84Å
116	K	80.7	Confident	75	Confident	56 Å²	56	79.6 Å²	79.6	24%	0.243	43%	0.432	C	S	.	.			trans	-61.5	119.6	-172.4	-169.4	162.2	-175.5	169.3	0	111.2	E120 F121 D124 F140	K116-E120 WeakPolarHBondContact CA-OE2 3.35Å; K116-E120 HydrophobicContact CG-CB 4.31Å; K116-F121 HydrophobicContact CG-CB 4.49Å; K116-D124 WeakPolarHBondContact CE-OD2 3.35Å; K116-D124 IonicContact NZ-OD2 2.87Å; K116-D124 PolarHBondContact NZ-OD2 3.23Å; K116-F140 HydrophobicContact CD-CD2 3.9Å; K116-F140 HydrophobicContact CD-CE2 4.08Å
117	T	85.3	Confident	77.7	Confident	63 Å²	63	80 Å²	80	39%	0.387	42%	0.418	S	S	.	.			trans	-84.4	163.2	-177	71	0	0	0	0	111.9	T115 K119 E120 F121	T115-T117 PolarHBondContact O-N 2.84Å; T117-K119 PolarHBondContact O-N 3.18Å; T117-E120 WeakPolarHBondContact CG2-OE1 3.3Å; T117-E120 PolarHBondContact N-OE2 2.89Å; T117-E120 PolarHBondContact O-N 3.17Å; T117-E120 VanDerWaalsContact OG1-CG 3.3Å; T117-E120 WeakPolarHBondContact OG1-CG 3.47Å; T117-E120 PolarHBondContact OG1-N 3.07Å; T117-E120 PolarHBondContact OG1-OE1 2.95Å; T117-F121 PolarHBondContact O-N 3.18Å; T117-F121 VanDerWaalsContact O-N 3.08Å
118	T	86.6	Confident	80.2	Confident	45 Å²	45	74.3 Å²	74.3	28%	0.276	38%	0.38	S	S	.	.	H	α-helix	trans	-59.6	-35.8	176.6	-51.3	0	0	0	0	112.4	Q122 F175 A178	T118-Q122 WeakPolarHBondContact O-CB 3.39Å; T118-Q122 PolarHBondContact O-N 2.92Å; T118-F175 HydrophobicContact CG2-CD2 4.28Å; T118-F175 WeakPolarHBondContact OG1-CB 3.4Å; T118-A178 HydrophobicContact CG2-CB 3.64Å
119	K	87.9	Confident	82.2	Confident	161 Å²	161	71.4 Å²	71.4	70%	0.7	37%	0.373	S	S	*	.	H	α-helix	trans	-70.1	-49.7	178.9	-69.6	-173.7	176.6	-174.9	0	111.3	T117 F121 Q122 E123	T117-K119 PolarHBondContact O-N 3.18Å; K119-F121 VanDerWaalsContact C-N 3.3Å; K119-F121 PolarHBondContact O-N 2.86Å; K119-Q122 PolarHBondContact O-N 3.43Å; K119-E123 WeakPolarHBondContact O-CG 3.46Å; K119-E123 PolarHBondContact O-N 3.18Å
120	E	90.3	Very high	83.9	Confident	84 Å²	84	75.9 Å²	75.9	39%	0.393	39%	0.388	S	S	.	.	H	α-helix	trans	-55.9	-45.1	177.9	-73.1	154.8	-147.1	0	0	111.9	K116 T117 Q122 E123 D124	K116-E120 WeakPolarHBondContact CA-OE2 3.35Å; K116-E120 HydrophobicContact CG-CB 4.31Å; T117-E120 WeakPolarHBondContact CG2-OE1 3.3Å; T117-E120 PolarHBondContact N-OE2 2.89Å; T117-E120 PolarHBondContact O-N 3.17Å; T117-E120 VanDerWaalsContact OG1-CG 3.3Å; T117-E120 WeakPolarHBondContact OG1-CG 3.47Å; T117-E120 PolarHBondContact OG1-N 3.07Å; T117-E120 PolarHBondContact OG1-OE1 2.95Å; E120-Q122 VanDerWaalsContact C-N 3.35Å; E120-Q122 PolarHBondContact O-N 2.94Å; E120-E123 PolarHBondContact O-N 3.4Å; E120-D124 VanDerWaalsContact O-CG 3.24Å; E120-D124 PolarHBondContact O-N 3.31Å
121	F	92.7	Very high	85.2	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-42.1	176.3	176.1	-95.5	0	0	0	112.7	K116 T117 K119 D124 V125 F140 Y141 F175 V179	K116-F121 HydrophobicContact CG-CB 4.49Å; T117-F121 PolarHBondContact O-N 3.18Å; T117-F121 VanDerWaalsContact O-N 3.08Å; K119-F121 VanDerWaalsContact C-N 3.3Å; K119-F121 PolarHBondContact O-N 2.86Å; F121-D124 PolarHBondContact O-N 3Å; F121-V125 HydrophobicContact CD1-CG2 4.25Å; F121-V125 HydrophobicContact CE1-CG2 3.66Å; F121-V125 HydrophobicContact CE2-CG2 4.06Å; F121-V125 HydrophobicContact CZ-CG2 3.55Å; F121-V125 WeakPolarHBondContact O-CG2 3.5Å; F121-V125 PolarHBondContact O-N 2.67Å; F121-F140 AromaticContact CD2-CD1 3.81Å; F121-F140 HydrophobicContact CD2-CD1 3.81Å; F121-F140 AromaticContact CD2-CE1 3.72Å; F121-F140 HydrophobicContact CD2-CE1 3.72Å; F121-F140 HydrophobicContact CD2-CE2 4.47Å; F121-F140 HydrophobicContact CD2-CG 4.23Å; F121-F140 HydrophobicContact CD2-CZ 4.07Å; F121-F140 AromaticContact CE2-CD1 3.38Å; F121-F140 HydrophobicContact CE2-CD1 3.38Å; F121-F140 AromaticContact CE2-CE1 3.44Å; F121-F140 HydrophobicContact CE2-CE1 3.44Å; F121-F140 VanDerWaalsContact CE2-CE1 3.44Å; F121-F140 HydrophobicContact CE2-CG 4.15Å; F121-F140 HydrophobicContact CE2-CZ 4.25Å; F121-F140 HydrophobicContact CZ-CD1 4.41Å; F121-F140 HydrophobicContact CZ-CE1 4.26Å; F121-Y141 HydrophobicContact CE2-CE2 4.43Å; F121-Y141 HydrophobicContact CZ-CE2 4.16Å; F121-Y141 AromaticContact CZ-CZ 3.97Å; F121-F175 HydrophobicContact CB-CE2 3.67Å; F121-F175 HydrophobicContact CB-CZ 4.32Å; F121-F175 HydrophobicContact CD1-CE2 4.38Å; F121-F175 AromaticContact CG-CE2 3.99Å; F121-F175 HydrophobicContact CG-CE2 3.99Å; F121-V179 HydrophobicContact CD1-CG2 3.89Å; F121-V179 HydrophobicContact CD2-CG2 4.36Å; F121-V179 HydrophobicContact CE1-CB 4.22Å; F121-V179 HydrophobicContact CE1-CG2 3.81Å; F121-V179 HydrophobicContact CE2-CG2 4.29Å; F121-V179 HydrophobicContact CG-CG2 4.18Å; F121-V179 HydrophobicContact CZ-CB 4.34Å; F121-V179 HydrophobicContact CZ-CG1 4.32Å; F121-V179 HydrophobicContact CZ-CG2 4.02Å
122	Q	91.8	Very high	86.3	Confident	62 Å²	62	75.7 Å²	75.7	29%	0.29	40%	0.401	S	S	.	.	H	α-helix	trans	-66.3	-40.9	179.6	-162.9	65.3	39.8	0	0	111.4	T118 K119 E120 D124 V125 E126	T118-Q122 WeakPolarHBondContact O-CB 3.39Å; T118-Q122 PolarHBondContact O-N 2.92Å; K119-Q122 PolarHBondContact O-N 3.43Å; E120-Q122 VanDerWaalsContact C-N 3.35Å; E120-Q122 PolarHBondContact O-N 2.94Å; Q122-D124 VanDerWaalsContact C-N 3.33Å; Q122-D124 PolarHBondContact O-N 3.2Å; Q122-V125 PolarHBondContact O-N 3.32Å; Q122-E126 WeakPolarHBondContact O-CB 3.35Å; Q122-E126 WeakPolarHBondContact O-CG 3.11Å; Q122-E126 PolarHBondContact O-N 3.37Å
123	E	91.8	Very high	87.3	Confident	104 Å²	104	76.8 Å²	76.8	49%	0.486	40%	0.404	S	S	.	.	H	α-helix	trans	-61.4	-40.5	174.8	-72	170.3	-165.1	0	0	111.7	K119 E120 E126 R127	K119-E123 WeakPolarHBondContact O-CG 3.46Å; K119-E123 PolarHBondContact O-N 3.18Å; E120-E123 PolarHBondContact O-N 3.4Å; E123-E126 PolarHBondContact O-N 3.09Å; E123-R127 VanDerWaalsContact O-CB 3.24Å; E123-R127 WeakPolarHBondContact O-CB 3.32Å; E123-R127 PolarHBondContact O-N 2.89Å
124	D	91.6	Very high	88.5	Confident	23 Å²	23	72 Å²	72	12%	0.123	38%	0.376	C	S	.	.	H	α-helix	trans	-66.2	-39	176	-68.3	-18.3	0	0	0	111.9	K116 E120 F121 Q122 R127 A128 V137	K116-D124 WeakPolarHBondContact CE-OD2 3.35Å; K116-D124 IonicContact NZ-OD2 2.87Å; K116-D124 PolarHBondContact NZ-OD2 3.23Å; E120-D124 VanDerWaalsContact O-CG 3.24Å; E120-D124 PolarHBondContact O-N 3.31Å; F121-D124 PolarHBondContact O-N 3Å; Q122-D124 VanDerWaalsContact C-N 3.33Å; Q122-D124 PolarHBondContact O-N 3.2Å; D124-R127 IonicContact OD1-CZ 3.32Å; D124-R127 IonicContact OD1-NH1 3.11Å; D124-R127 PolarHBondContact OD1-NH1 3.3Å; D124-R127 IonicContact OD1-NH2 2.74Å; D124-A128 VanDerWaalsContact O-CB 3.24Å; D124-A128 WeakPolarHBondContact O-CB 3.16Å; D124-A128 PolarHBondContact O-N 3.41Å; D124-V137 HydrophobicContact CB-CG2 4.39Å
125	V	92.1	Very high	89.5	Confident	7 Å²	7	77.1 Å²	77.1	4%	0.042	40%	0.395	C	S	.	.	H	α-helix	trans	-66.1	-44.5	174.9	171.7	0	0	0	0	111.1	F121 Q122 A128 A129 W134 V137	F121-V125 HydrophobicContact CD1-CG2 4.25Å; F121-V125 HydrophobicContact CE1-CG2 3.66Å; F121-V125 HydrophobicContact CE2-CG2 4.06Å; F121-V125 HydrophobicContact CZ-CG2 3.55Å; F121-V125 WeakPolarHBondContact O-CG2 3.5Å; F121-V125 PolarHBondContact O-N 2.67Å; Q122-V125 PolarHBondContact O-N 3.32Å; V125-A128 PolarHBondContact O-N 3.14Å; V125-A129 WeakPolarHBondContact O-CB 3.44Å; V125-A129 PolarHBondContact O-N 2.63Å; V125-W134 HydrophobicContact CG1-CZ3 4.38Å; V125-V137 HydrophobicContact CG2-CG1 4.22Å; V125-V137 HydrophobicContact CG2-CG2 4.1Å
126	E	92.6	Very high	90.8	Very high	100 Å²	100	76.5 Å²	76.5	47%	0.467	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-42.6	177.5	-74.1	173.6	-166.5	0	0	111.5	Q122 E123 A129 Q130	Q122-E126 WeakPolarHBondContact O-CB 3.35Å; Q122-E126 WeakPolarHBondContact O-CG 3.11Å; Q122-E126 PolarHBondContact O-N 3.37Å; E123-E126 PolarHBondContact O-N 3.09Å; E126-A129 PolarHBondContact O-N 3.37Å; E126-Q130 WeakPolarHBondContact O-CG 3.45Å; E126-Q130 PolarHBondContact O-N 3.37Å
127	R	93.1	Very high	91.3	Very high	128 Å²	128	73.9 Å²	73.9	48%	0.483	37%	0.372	S	S	.	.	H	α-helix	trans	-63.2	-43	174.8	-169.8	-170.5	-56.1	146	9.6	111.5	E123 D124 A129 Q130 S131 E136	E123-R127 VanDerWaalsContact O-CB 3.24Å; E123-R127 WeakPolarHBondContact O-CB 3.32Å; E123-R127 PolarHBondContact O-N 2.89Å; D124-R127 IonicContact OD1-CZ 3.32Å; D124-R127 IonicContact OD1-NH1 3.11Å; D124-R127 PolarHBondContact OD1-NH1 3.3Å; D124-R127 IonicContact OD1-NH2 2.74Å; R127-A129 VanDerWaalsContact C-N 3.35Å; R127-Q130 PolarHBondContact O-N 2.67Å; R127-S131 VanDerWaalsContact O-CB 3.29Å; R127-S131 WeakPolarHBondContact O-CB 3.27Å; R127-S131 PolarHBondContact O-N 2.95Å; R127-S131 PolarHBondContact O-OG 3.48Å; R127-E136 IonicContact NH1-OE2 3.91Å
128	A	93	Very high	91.7	Very high	4 Å²	4	75.5 Å²	75.5	3%	0.033	37%	0.371	C	S	.	.	H	α-helix	trans	-64.7	-39.6	176.6	0	0	0	0	0	111.6	D124 V125 Q130 G132 D133 W134 V137	D124-A128 VanDerWaalsContact O-CB 3.24Å; D124-A128 WeakPolarHBondContact O-CB 3.16Å; D124-A128 PolarHBondContact O-N 3.41Å; V125-A128 PolarHBondContact O-N 3.14Å; A128-Q130 PolarHBondContact O-N 3.02Å; A128-G132 VanDerWaalsContact O-CA 3.28Å; A128-G132 WeakPolarHBondContact O-CA 3.3Å; A128-G132 PolarHBondContact O-N 2.62Å; A128-D133 WeakPolarHBondContact CA-O 3.47Å; A128-D133 VanDerWaalsContact CB-O 3.31Å; A128-D133 WeakPolarHBondContact CB-O 3.47Å; A128-W134 HydrophobicContact CB-CD2 3.82Å; A128-W134 HydrophobicContact CB-CE3 3.65Å; A128-W134 HydrophobicContact CB-CG 4.33Å; A128-W134 HydrophobicContact CB-CH2 4.45Å; A128-W134 HydrophobicContact CB-CZ3 3.98Å; A128-V137 HydrophobicContact CB-CG2 3.87Å
129	A	92	Very high	92	Very high	64 Å²	64	78.1 Å²	78.1	53%	0.529	38%	0.38	S	S	.	.	H	α-helix	trans	-65.4	-37.2	176.6	0	0	0	0	0	112.7	V125 E126 R127 W134	V125-A129 WeakPolarHBondContact O-CB 3.44Å; V125-A129 PolarHBondContact O-N 2.63Å; E126-A129 PolarHBondContact O-N 3.37Å; R127-A129 VanDerWaalsContact C-N 3.35Å; A129-W134 HydrophobicContact CB-CH2 4.2Å; A129-W134 HydrophobicContact CB-CZ2 4.22Å
130	Q	92.3	Very high	92.3	Very high	166 Å²	166	71.3 Å²	71.3	78%	0.776	35%	0.351	S	S	*	.	H	α-helix	trans	-76.4	-40.4	177.5	-69.7	172.4	26.2	0	0	113.1	E126 R127 A128	E126-Q130 WeakPolarHBondContact O-CG 3.45Å; E126-Q130 PolarHBondContact O-N 3.37Å; R127-Q130 PolarHBondContact O-N 2.67Å; A128-Q130 PolarHBondContact O-N 3.02Å
131	S	92.3	Very high	92.5	Very high	77 Å²	77	67.3 Å²	67.3	54%	0.538	33%	0.332	S	S	.	.	H	α-helix	trans	-88.5	-21.3	-175.3	64.5	0	0	0	0	114.1	R127 D133	R127-S131 VanDerWaalsContact O-CB 3.29Å; R127-S131 WeakPolarHBondContact O-CB 3.27Å; R127-S131 PolarHBondContact O-N 2.95Å; R127-S131 PolarHBondContact O-OG 3.48Å; S131-D133 PolarHBondContact O-N 2.82Å; S131-D133 PolarHBondContact OG-N 3.43Å
132	G	90.5	Very high	92.4	Very high	50 Å²	50	70.4 Å²	70.4	52%	0.515	35%	0.348	S	S	.	.			trans	76.7	-3.8	-170.5	0	0	0	0	0	114.6	A128 W134	A128-G132 VanDerWaalsContact O-CA 3.28Å; A128-G132 WeakPolarHBondContact O-CA 3.3Å; A128-G132 PolarHBondContact O-N 2.62Å; G132-W134 VanDerWaalsContact O-CD1 3.25Å; G132-W134 PolarHBondContact O-N 3.12Å
133	D	92.8	Very high	92.4	Very high	71 Å²	71	69.9 Å²	69.9	38%	0.38	35%	0.35	S	S	.	.			trans	-90	103.1	177.3	-167.8	-8	0	0	0	111.1	A128 S131 R135	A128-D133 WeakPolarHBondContact CA-O 3.47Å; A128-D133 VanDerWaalsContact CB-O 3.31Å; A128-D133 WeakPolarHBondContact CB-O 3.47Å; S131-D133 PolarHBondContact O-N 2.82Å; S131-D133 PolarHBondContact OG-N 3.43Å; D133-R135 WeakPolarHBondContact OD1-CB 3.34Å; D133-R135 VanDerWaalsContact OD1-CG 3.28Å; D133-R135 WeakPolarHBondContact OD1-CG 3.25Å; D133-R135 IonicContact OD1-CZ 3.68Å; D133-R135 PolarHBondContact OD1-N 3.47Å; D133-R135 VanDerWaalsContact OD1-N 3.11Å; D133-R135 IonicContact OD1-NE 3.87Å; D133-R135 PolarHBondContact OD1-NE 3.12Å; D133-R135 IonicContact OD1-NH2 3.58Å; D133-R135 IonicContact OD2-CZ 2.77Å; D133-R135 VanDerWaalsContact OD2-CZ 3.32Å; D133-R135 IonicContact OD2-NE 3.51Å; D133-R135 PolarHBondContact OD2-NE 3.42Å; D133-R135 VanDerWaalsContact OD2-NE 3.11Å; D133-R135 IonicContact OD2-NH2 2.81Å; D133-R135 PolarHBondContact OD2-NH2 3.01Å
134	W	93.5	Very high	92.4	Very high	46 Å²	46	65 Å²	65	17%	0.174	33%	0.326	C	S	.	.			trans	-94.3	10	-178.1	-65.4	88	0	0	0	114.1	V125 A128 A129 G132 E136 V137 R138 T186 P187 I190	V125-W134 HydrophobicContact CG1-CZ3 4.38Å; A128-W134 HydrophobicContact CB-CD2 3.82Å; A128-W134 HydrophobicContact CB-CE3 3.65Å; A128-W134 HydrophobicContact CB-CG 4.33Å; A128-W134 HydrophobicContact CB-CH2 4.45Å; A128-W134 HydrophobicContact CB-CZ3 3.98Å; A129-W134 HydrophobicContact CB-CH2 4.2Å; A129-W134 HydrophobicContact CB-CZ2 4.22Å; G132-W134 VanDerWaalsContact O-CD1 3.25Å; G132-W134 PolarHBondContact O-N 3.12Å; W134-E136 PolarHBondContact O-N 3.39Å; W134-V137 HydrophobicContact CE3-CB 4.08Å; W134-V137 HydrophobicContact CE3-CG1 4.04Å; W134-V137 HydrophobicContact CE3-CG2 4.27Å; W134-V137 HydrophobicContact CZ3-CG1 4.31Å; W134-V137 PolarHBondContact O-N 3.32Å; W134-R138 WeakPolarHBondContact O-CB 3.44Å; W134-R138 PolarHBondContact O-N 3.14Å; W134-T186 HydrophobicContact CE3-CG2 4.29Å; W134-T186 HydrophobicContact CH2-CG2 4.45Å; W134-T186 HydrophobicContact CZ3-CG2 3.78Å; W134-P187 VanDerWaalsContact CD2-CD 3.47Å; W134-P187 HydrophobicContact CD2-CG 3.86Å; W134-P187 VanDerWaalsContact CE2-CD 3.44Å; W134-P187 HydrophobicContact CG-CG 3.75Å; W134-P187 HydrophobicContact CZ2-CG 4.47Å; W134-I190 HydrophobicContact CB-CD1 3.73Å; W134-I190 HydrophobicContact CD2-CD1 4.44Å; W134-I190 HydrophobicContact CE3-CD1 4.25Å; W134-I190 HydrophobicContact CG-CD1 4.27Å
135	R	92.9	Very high	92.4	Very high	180 Å²	180	63.9 Å²	63.9	68%	0.679	32%	0.321	S	S	*	.	H	α-helix	trans	-57.8	-47.2	-173.1	-79.9	-178.9	-82.4	-175.4	-5.3	113.8	D133 R138 E139	D133-R135 WeakPolarHBondContact OD1-CB 3.34Å; D133-R135 VanDerWaalsContact OD1-CG 3.28Å; D133-R135 WeakPolarHBondContact OD1-CG 3.25Å; D133-R135 IonicContact OD1-CZ 3.68Å; D133-R135 PolarHBondContact OD1-N 3.47Å; D133-R135 VanDerWaalsContact OD1-N 3.11Å; D133-R135 IonicContact OD1-NE 3.87Å; D133-R135 PolarHBondContact OD1-NE 3.12Å; D133-R135 IonicContact OD1-NH2 3.58Å; D133-R135 IonicContact OD2-CZ 2.77Å; D133-R135 VanDerWaalsContact OD2-CZ 3.32Å; D133-R135 IonicContact OD2-NE 3.51Å; D133-R135 PolarHBondContact OD2-NE 3.42Å; D133-R135 VanDerWaalsContact OD2-NE 3.11Å; D133-R135 IonicContact OD2-NH2 2.81Å; D133-R135 PolarHBondContact OD2-NH2 3.01Å; R135-R138 PolarHBondContact O-N 3.44Å; R135-E139 WeakPolarHBondContact O-CB 3.31Å; R135-E139 PolarHBondContact O-N 3.46Å
136	E	90.5	Very high	92.1	Very high	115 Å²	115	66.7 Å²	66.7	54%	0.537	34%	0.335	S	S	.	.	H	α-helix	trans	-65.2	-43.1	-179.4	-66.5	-177.5	166.6	0	0	112.1	R127 W134 E139 F140	R127-E136 IonicContact NH1-OE2 3.91Å; W134-E136 PolarHBondContact O-N 3.39Å; E136-E139 PolarHBondContact O-N 2.96Å; E136-F140 PolarHBondContact O-N 3.32Å
137	V	92.4	Very high	92	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.006	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-42.7	177.5	178.2	0	0	0	0	110.7	D124 V125 A128 W134 F140 Y141 T186	D124-V137 HydrophobicContact CB-CG2 4.39Å; V125-V137 HydrophobicContact CG2-CG1 4.22Å; V125-V137 HydrophobicContact CG2-CG2 4.1Å; A128-V137 HydrophobicContact CB-CG2 3.87Å; W134-V137 HydrophobicContact CE3-CB 4.08Å; W134-V137 HydrophobicContact CE3-CG1 4.04Å; W134-V137 HydrophobicContact CE3-CG2 4.27Å; W134-V137 HydrophobicContact CZ3-CG1 4.31Å; W134-V137 PolarHBondContact O-N 3.32Å; V137-F140 WeakPolarHBondContact O-CB 3.48Å; V137-F140 PolarHBondContact O-N 3.43Å; V137-Y141 HydrophobicContact CG1-CD2 3.76Å; V137-Y141 HydrophobicContact CG1-CE2 3.55Å; V137-Y141 WeakPolarHBondContact O-CD2 3.36Å; V137-Y141 PolarHBondContact O-N 2.95Å; V137-T186 HydrophobicContact CG1-CG2 4.41Å
138	R	93.2	Very high	91.8	Very high	97 Å²	97	57.5 Å²	57.5	37%	0.366	30%	0.299	S	S	.	.	H	α-helix	trans	-60.2	-46.6	176.5	179.9	-177.8	177.5	-75.8	0.5	111.5	W134 R135 F140 Y141 L142 I190 L193	W134-R138 WeakPolarHBondContact O-CB 3.44Å; W134-R138 PolarHBondContact O-N 3.14Å; R135-R138 PolarHBondContact O-N 3.44Å; R138-F140 VanDerWaalsContact C-N 3.34Å; R138-Y141 PolarHBondContact O-N 3.13Å; R138-L142 WeakPolarHBondContact O-CB 3.45Å; R138-L142 PolarHBondContact O-N 3.21Å; R138-I190 HydrophobicContact CB-CD1 3.86Å; R138-I190 HydrophobicContact CB-CG1 4.08Å; R138-I190 HydrophobicContact CG-CD1 4.49Å; R138-I190 HydrophobicContact CG-CG1 4.17Å; R138-L193 HydrophobicContact CG-CD1 4.22Å
139	E	92.9	Very high	91.6	Very high	100 Å²	100	59.7 Å²	59.7	47%	0.467	31%	0.312	S	S	.	.	H	α-helix	trans	-62.5	-44.5	178.5	-167.5	60.3	-158.5	0	0	110.5	R135 E136 Y141 L142 T143	R135-E139 WeakPolarHBondContact O-CB 3.31Å; R135-E139 PolarHBondContact O-N 3.46Å; E136-E139 PolarHBondContact O-N 2.96Å; E139-Y141 PolarHBondContact O-N 3.06Å; E139-L142 PolarHBondContact O-N 3.47Å; E139-T143 PolarHBondContact O-N 3.03Å; E139-T143 PolarHBondContact O-OG1 3.25Å
140	F	94	Very high	91.5	Very high	18 Å²	18	58.5 Å²	58.5	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-55.5	-48.9	175.2	172.5	-92.8	0	0	0	112.8	K116 F121 E136 V137 R138 T144 F175 V179	K116-F140 HydrophobicContact CD-CD2 3.9Å; K116-F140 HydrophobicContact CD-CE2 4.08Å; F121-F140 AromaticContact CD2-CD1 3.81Å; F121-F140 HydrophobicContact CD2-CD1 3.81Å; F121-F140 AromaticContact CD2-CE1 3.72Å; F121-F140 HydrophobicContact CD2-CE1 3.72Å; F121-F140 HydrophobicContact CD2-CE2 4.47Å; F121-F140 HydrophobicContact CD2-CG 4.23Å; F121-F140 HydrophobicContact CD2-CZ 4.07Å; F121-F140 AromaticContact CE2-CD1 3.38Å; F121-F140 HydrophobicContact CE2-CD1 3.38Å; F121-F140 AromaticContact CE2-CE1 3.44Å; F121-F140 HydrophobicContact CE2-CE1 3.44Å; F121-F140 VanDerWaalsContact CE2-CE1 3.44Å; F121-F140 HydrophobicContact CE2-CG 4.15Å; F121-F140 HydrophobicContact CE2-CZ 4.25Å; F121-F140 HydrophobicContact CZ-CD1 4.41Å; F121-F140 HydrophobicContact CZ-CE1 4.26Å; E136-F140 PolarHBondContact O-N 3.32Å; V137-F140 WeakPolarHBondContact O-CB 3.48Å; V137-F140 PolarHBondContact O-N 3.43Å; R138-F140 VanDerWaalsContact C-N 3.34Å; F140-T144 WeakPolarHBondContact O-CB 3.27Å; F140-T144 PolarHBondContact O-N 3.25Å; F140-T144 PolarHBondContact O-OG1 3.31Å; F140-F175 HydrophobicContact CE2-CZ 4.12Å; F140-F175 HydrophobicContact CZ-CE1 4.3Å; F140-F175 AromaticContact CZ-CZ 3.78Å; F140-F175 HydrophobicContact CZ-CZ 3.78Å; F140-V179 HydrophobicContact CE1-CG1 3.92Å; F140-V179 HydrophobicContact CE1-CG2 3.93Å; F140-V179 HydrophobicContact CZ-CG2 4.01Å
141	Y	94.1	Very high	91.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.9	-40.5	178.2	-81.9	-69.7	0	0	0	112.1	F121 V137 R138 E139 T144 F145 V179 L183 T186 I190 V194	F121-Y141 HydrophobicContact CE2-CE2 4.43Å; F121-Y141 HydrophobicContact CZ-CE2 4.16Å; F121-Y141 AromaticContact CZ-CZ 3.97Å; V137-Y141 HydrophobicContact CG1-CD2 3.76Å; V137-Y141 HydrophobicContact CG1-CE2 3.55Å; V137-Y141 WeakPolarHBondContact O-CD2 3.36Å; V137-Y141 PolarHBondContact O-N 2.95Å; R138-Y141 PolarHBondContact O-N 3.13Å; E139-Y141 PolarHBondContact O-N 3.06Å; Y141-T144 PolarHBondContact O-N 3.08Å; Y141-F145 HydrophobicContact CD1-CD2 4.01Å; Y141-F145 AromaticContact CD1-CE2 3.7Å; Y141-F145 HydrophobicContact CD1-CE2 3.7Å; Y141-F145 HydrophobicContact CE1-CE2 4.14Å; Y141-F145 WeakPolarHBondContact O-CD2 3.46Å; Y141-F145 PolarHBondContact O-N 2.78Å; Y141-F145 VanDerWaalsContact O-N 3.14Å; Y141-V179 HydrophobicContact CD1-CG1 4.44Å; Y141-V179 HydrophobicContact CE1-CG1 3.57Å; Y141-V179 PolarHBondContact OH-O 3.13Å; Y141-L183 HydrophobicContact CD1-CD1 4.21Å; Y141-L183 HydrophobicContact CE1-CB 4.33Å; Y141-L183 HydrophobicContact CE1-CD1 3.79Å; Y141-L183 HydrophobicContact CE1-CG 4.47Å; Y141-L183 HydrophobicContact CE2-CD1 4.38Å; Y141-L183 WeakPolarHBondContact OH-CA 3.25Å; Y141-L183 PolarHBondContact OH-N 3.05Å; Y141-T186 HydrophobicContact CE2-CG2 4.12Å; Y141-I190 HydrophobicContact CD2-CG2 3.6Å; Y141-I190 HydrophobicContact CE2-CG2 4.24Å; Y141-I190 HydrophobicContact CG-CG2 4.07Å; Y141-V194 HydrophobicContact CD1-CG2 3.48Å; Y141-V194 VanDerWaalsContact CD1-CG2 3.48Å; Y141-V194 HydrophobicContact CE1-CG2 4.31Å; Y141-V194 HydrophobicContact CG-CG2 3.81Å
142	L	91.4	Very high	91.3	Very high	65 Å²	65	47.2 Å²	47.2	34%	0.34	24%	0.235	S	C	.	.	H	α-helix	trans	-59.7	-52.3	177.6	176.9	62.5	0	0	0	111.5	R138 E139 T144 D146 L193	R138-L142 WeakPolarHBondContact O-CB 3.45Å; R138-L142 PolarHBondContact O-N 3.21Å; E139-L142 PolarHBondContact O-N 3.47Å; L142-T144 VanDerWaalsContact C-N 3.34Å; L142-T144 PolarHBondContact O-N 3.38Å; L142-D146 PolarHBondContact O-N 2.81Å; L142-L193 HydrophobicContact CB-CD1 4.24Å; L142-L193 HydrophobicContact CB-CD2 3.62Å; L142-L193 HydrophobicContact CD1-CD1 4.09Å; L142-L193 HydrophobicContact CD1-CD2 3.68Å; L142-L193 HydrophobicContact CD1-CG 4.09Å; L142-L193 HydrophobicContact CG-CD2 4.25Å
143	T	91.1	Very high	91.1	Very high	52 Å²	52	45 Å²	45	32%	0.319	21%	0.212	S	C	.	.	H	α-helix	trans	-70.5	-33.2	-178.5	-27.9	0	0	0	0	111.5	R114 E139 E150	R114-T143 VanDerWaalsContact NH2-CB 3.32Å; R114-T143 PolarHBondContact NH2-O 3.05Å; R114-T143 VanDerWaalsContact NH2-O 3.12Å; E139-T143 PolarHBondContact O-N 3.03Å; E139-T143 PolarHBondContact O-OG1 3.25Å; T143-E150 WeakPolarHBondContact O-CB 3.47Å; T143-E150 WeakPolarHBondContact O-CG 3.41Å
144	T	91.2	Very high	91	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-71	-41.2	-175.9	-62.8	0	0	0	0	112.9	R114 F140 Y141 L142 E150 I151 A154 F155	R114-T144 PolarHBondContact NH1-OG1 2.96Å; F140-T144 WeakPolarHBondContact O-CB 3.27Å; F140-T144 PolarHBondContact O-N 3.25Å; F140-T144 PolarHBondContact O-OG1 3.31Å; Y141-T144 PolarHBondContact O-N 3.08Å; L142-T144 VanDerWaalsContact C-N 3.34Å; L142-T144 PolarHBondContact O-N 3.38Å; T144-E150 CarbonylContact O-C 3.43Å; T144-I151 VanDerWaalsContact O-CG1 3.27Å; T144-I151 WeakPolarHBondContact O-CG1 3.26Å; T144-I151 PolarHBondContact O-N 3.24Å; T144-A154 HydrophobicContact CG2-CB 3.59Å; T144-F155 HydrophobicContact CG2-CD2 4.39Å; T144-F155 HydrophobicContact CG2-CE2 3.54Å; T144-F155 HydrophobicContact CG2-CZ 3.94Å
145	F	91.7	Very high	90.9	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	19%	0.19	C	C	.	.	S	Bend	trans	-98.7	10.2	-174.2	-69.2	-81.6	0	0	0	113.8	Y141 I151 F155 Y180 V194 G197 I198 S201 L221	Y141-F145 HydrophobicContact CD1-CD2 4.01Å; Y141-F145 AromaticContact CD1-CE2 3.7Å; Y141-F145 HydrophobicContact CD1-CE2 3.7Å; Y141-F145 HydrophobicContact CE1-CE2 4.14Å; Y141-F145 WeakPolarHBondContact O-CD2 3.46Å; Y141-F145 PolarHBondContact O-N 2.78Å; Y141-F145 VanDerWaalsContact O-N 3.14Å; F145-I151 HydrophobicContact CD1-CD1 4.29Å; F145-I151 HydrophobicContact CD1-CG1 4.35Å; F145-F155 HydrophobicContact CZ-CE2 4.26Å; F145-F155 HydrophobicContact CZ-CZ 4.34Å; F145-Y180 HydrophobicContact CE1-CE1 4.02Å; F145-Y180 WeakPolarHBondContact CE1-OH 3.35Å; F145-Y180 AromaticContact CZ-CE1 3.65Å; F145-Y180 HydrophobicContact CZ-CE1 3.65Å; F145-Y180 AromaticContact CZ-CZ 3.92Å; F145-V194 HydrophobicContact CD1-CG1 4.29Å; F145-V194 HydrophobicContact CD2-CG1 3.95Å; F145-V194 HydrophobicContact CD2-CG2 4.16Å; F145-V194 HydrophobicContact CE2-CG1 4.22Å; F145-V194 HydrophobicContact CG-CG1 3.99Å; F145-V194 HydrophobicContact CZ-CG1 4.5Å; F145-G197 CarbonylContact O-C 3.46Å; F145-G197 VanDerWaalsContact O-CA 3.26Å; F145-G197 WeakPolarHBondContact O-CA 3.49Å; F145-G197 VanDerWaalsContact O-O 3.14Å; F145-I198 HydrophobicContact CD1-CD1 4.37Å; F145-I198 HydrophobicContact CD1-CG1 4.11Å; F145-S201 PolarHBondContact O-OG 3.01Å; F145-L221 HydrophobicContact CD1-CD2 4.05Å; F145-L221 HydrophobicContact CE1-CD2 4.14Å
146	D	87.7	Confident	90.6	Very high	65 Å²	65	32.7 Å²	32.7	35%	0.348	16%	0.163	S	C	.	.	S	Bend	trans	-68.2	-36	178.9	-175.3	66	0	0	0	113.2	L142 S201 R204	L142-D146 PolarHBondContact O-N 2.81Å; D146-S201 PolarHBondContact O-OG 3.43Å; D146-R204 IonicContact OD2-NH2 3.73Å
147	S	89.2	Confident	90.3	Very high	14 Å²	14	33 Å²	33	10%	0.098	16%	0.159	C	C	.	.			trans	-153.6	164.8	179.5	79.6	0	0	0	0	113	V149 E150 I151 S201	S147-V149 PolarHBondContact O-N 3.35Å; S147-V149 PolarHBondContact OG-N 3.39Å; S147-E150 PolarHBondContact O-N 2.92Å; S147-E150 VanDerWaalsContact O-N 3.16Å; S147-E150 PolarHBondContact OG-N 3.29Å; S147-I151 WeakPolarHBondContact O-CG1 3.39Å; S147-I151 PolarHBondContact O-N 3.44Å; S147-S201 WeakPolarHBondContact CA-OG 3.23Å
148	F	89.5	Confident	89.5	Confident	21 Å²	21	38.7 Å²	38.7	9%	0.092	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-32.7	174.8	-76.5	13.6	0	0	0	112.6	E150 I151 N152 L202 D214 A217 Y218 L221	F148-E150 VanDerWaalsContact C-N 3.34Å; F148-I151 HydrophobicContact CD1-CD1 4.28Å; F148-I151 PolarHBondContact O-N 3.49Å; F148-N152 PolarHBondContact O-N 3.27Å; F148-N152 PolarHBondContact O-ND2 3.16Å; F148-L202 HydrophobicContact CZ-CD2 4.44Å; F148-D214 HydrophobicContact CD2-CB 4.16Å; F148-D214 HydrophobicContact CE2-CB 4.41Å; F148-A217 HydrophobicContact CB-CB 3.81Å; F148-A217 HydrophobicContact CD1-CB 3.8Å; F148-A217 HydrophobicContact CD2-CB 3.72Å; F148-A217 HydrophobicContact CE1-CB 4.28Å; F148-A217 HydrophobicContact CE2-CB 4.19Å; F148-A217 HydrophobicContact CG-CB 3.5Å; F148-A217 VanDerWaalsContact CG-CB 3.5Å; F148-A217 HydrophobicContact CZ-CB 4.46Å; F148-Y218 HydrophobicContact CE2-CE1 4.07Å; F148-Y218 AromaticContact CE2-CE2 3.93Å; F148-Y218 HydrophobicContact CE2-CE2 3.93Å; F148-Y218 AromaticContact CE2-CZ 3.68Å; F148-Y218 HydrophobicContact CZ-CD1 4.27Å; F148-Y218 AromaticContact CZ-CE1 3.71Å; F148-Y218 HydrophobicContact CZ-CE1 3.71Å; F148-Y218 HydrophobicContact CZ-CE2 4.42Å; F148-Y218 AromaticContact CZ-CZ 3.79Å; F148-L221 HydrophobicContact CD1-CD1 4.35Å; F148-L221 HydrophobicContact CE1-CD1 3.58Å; F148-L221 HydrophobicContact CZ-CD1 4.18Å
149	V	87.9	Confident	88.3	Confident	50 Å²	50	34.6 Å²	34.6	30%	0.303	17%	0.173	S	C	.	.	H	α-helix	trans	-64.3	-43.1	176.6	178.8	0	0	0	0	110.1	P109 S147 N152 A153	P109-V149 HydrophobicContact CB-CG2 4.47Å; P109-V149 HydrophobicContact CG-CG2 4.48Å; S147-V149 PolarHBondContact O-N 3.35Å; S147-V149 PolarHBondContact OG-N 3.39Å; V149-N152 PolarHBondContact O-N 3.32Å; V149-A153 WeakPolarHBondContact O-CB 3.28Å; V149-A153 PolarHBondContact O-N 3.06Å
150	E	89.9	Confident	87.1	Confident	40 Å²	40	35.3 Å²	35.3	19%	0.187	18%	0.18	C	C	.	.	H	α-helix	trans	-70.6	-34.3	179.1	-62.7	-56.9	152.8	0	0	113.1	R114 T143 T144 S147 F148 N152 A153 A154	R114-E150 IonicContact CZ-OE2 3.93Å; R114-E150 IonicContact NE-OE2 3.83Å; R114-E150 IonicContact NH2-OE2 2.99Å; R114-E150 PolarHBondContact NH2-OE2 3.48Å; T143-E150 WeakPolarHBondContact O-CB 3.47Å; T143-E150 WeakPolarHBondContact O-CG 3.41Å; T144-E150 CarbonylContact O-C 3.43Å; S147-E150 PolarHBondContact O-N 2.92Å; S147-E150 VanDerWaalsContact O-N 3.16Å; S147-E150 PolarHBondContact OG-N 3.29Å; F148-E150 VanDerWaalsContact C-N 3.34Å; E150-N152 VanDerWaalsContact C-N 3.31Å; E150-N152 PolarHBondContact O-N 3.41Å; E150-A153 WeakPolarHBondContact O-CB 3.32Å; E150-A153 PolarHBondContact O-N 3.03Å; E150-A154 WeakPolarHBondContact O-CB 3.43Å; E150-A154 PolarHBondContact O-N 3.11Å
151	I	91.1	Very high	85.7	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-45.6	171.6	-67.7	172.4	0	0	0	109.7	T144 F145 S147 F148 A154 F155 A217 V220 L221	T144-I151 VanDerWaalsContact O-CG1 3.27Å; T144-I151 WeakPolarHBondContact O-CG1 3.26Å; T144-I151 PolarHBondContact O-N 3.24Å; F145-I151 HydrophobicContact CD1-CD1 4.29Å; F145-I151 HydrophobicContact CD1-CG1 4.35Å; S147-I151 WeakPolarHBondContact O-CG1 3.39Å; S147-I151 PolarHBondContact O-N 3.44Å; F148-I151 HydrophobicContact CD1-CD1 4.28Å; F148-I151 PolarHBondContact O-N 3.49Å; I151-A154 PolarHBondContact O-N 3.29Å; I151-F155 HydrophobicContact CG2-CD2 3.92Å; I151-F155 HydrophobicContact CG2-CE2 4.43Å; I151-F155 VanDerWaalsContact O-CD2 3.25Å; I151-F155 WeakPolarHBondContact O-CD2 3.18Å; I151-F155 PolarHBondContact O-N 3.17Å; I151-A217 HydrophobicContact CB-CB 4.46Å; I151-A217 HydrophobicContact CD1-CB 4.47Å; I151-A217 HydrophobicContact CG2-CB 4.19Å; I151-V220 HydrophobicContact CG2-CB 3.87Å; I151-V220 HydrophobicContact CG2-CG1 3.86Å; I151-V220 HydrophobicContact CG2-CG2 4.18Å; I151-L221 HydrophobicContact CD1-CD1 4.08Å; I151-L221 HydrophobicContact CD1-CD2 3.7Å; I151-L221 HydrophobicContact CD1-CG 3.88Å
152	N	88.9	Confident	84.3	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.027	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-41.5	176.2	-77.7	-75.1	0	0	0	111.6	I111 F148 V149 E150 A154 F155 K156 D213 R216	I111-N152 HydrophobicContact CD1-CB 4.17Å; F148-N152 PolarHBondContact O-N 3.27Å; F148-N152 PolarHBondContact O-ND2 3.16Å; V149-N152 PolarHBondContact O-N 3.32Å; E150-N152 VanDerWaalsContact C-N 3.31Å; E150-N152 PolarHBondContact O-N 3.41Å; N152-A154 VanDerWaalsContact C-N 3.28Å; N152-A154 PolarHBondContact O-N 2.94Å; N152-F155 PolarHBondContact O-N 3.21Å; N152-K156 WeakPolarHBondContact O-CB 3.37Å; N152-K156 PolarHBondContact O-N 3.39Å; N152-D213 PolarHBondContact ND2-O 2.98Å; N152-D213 PolarHBondContact OD1-O 2.65Å; N152-R216 VanDerWaalsContact OD1-CB 3.23Å; N152-R216 WeakPolarHBondContact OD1-CB 3.33Å; N152-R216 WeakPolarHBondContact OD1-CD 3.47Å
153	A	87.9	Confident	82.9	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.033	21%	0.21	C	C	.	.	H	α-helix	trans	-57.6	-40.9	175.9	0	0	0	0	0	112.5	I111 P112 R114 V149 E150	I111-A153 VanDerWaalsContact CG2-CA 3.44Å; I111-A153 HydrophobicContact CG2-CB 3.8Å; P112-A153 HydrophobicContact CB-CB 4.04Å; P112-A153 HydrophobicContact CG-CB 4.27Å; P112-A153 VanDerWaalsContact O-CB 3.31Å; P112-A153 WeakPolarHBondContact O-CB 3.27Å; R114-A153 HydrophobicContact CG-CB 4.23Å; V149-A153 WeakPolarHBondContact O-CB 3.28Å; V149-A153 PolarHBondContact O-N 3.06Å; E150-A153 WeakPolarHBondContact O-CB 3.32Å; E150-A153 PolarHBondContact O-N 3.03Å
154	A	89.1	Confident	81.9	Confident	12 Å²	12	42.5 Å²	42.5	10%	0.099	22%	0.218	C	C	.	.	H	α-helix	trans	-77.4	-38.8	-178.8	0	0	0	0	0	113.5	T144 E150 I151 N152 F175	T144-A154 HydrophobicContact CG2-CB 3.59Å; E150-A154 WeakPolarHBondContact O-CB 3.43Å; E150-A154 PolarHBondContact O-N 3.11Å; I151-A154 PolarHBondContact O-N 3.29Å; N152-A154 VanDerWaalsContact C-N 3.28Å; N152-A154 PolarHBondContact O-N 2.94Å; A154-F175 WeakPolarHBondContact O-CE1 3.27Å
155	F	91.6	Very high	81.4	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.009	24%	0.238	C	C	.	.	H	α-helix	trans	-110	-12.1	-166.8	-62.4	-64.7	0	0	0	115.4	T144 F145 I151 N152 V171 N172 F175 V176 V179 V220	T144-F155 HydrophobicContact CG2-CD2 4.39Å; T144-F155 HydrophobicContact CG2-CE2 3.54Å; T144-F155 HydrophobicContact CG2-CZ 3.94Å; F145-F155 HydrophobicContact CZ-CE2 4.26Å; F145-F155 HydrophobicContact CZ-CZ 4.34Å; I151-F155 HydrophobicContact CG2-CD2 3.92Å; I151-F155 HydrophobicContact CG2-CE2 4.43Å; I151-F155 VanDerWaalsContact O-CD2 3.25Å; I151-F155 WeakPolarHBondContact O-CD2 3.18Å; I151-F155 PolarHBondContact O-N 3.17Å; N152-F155 PolarHBondContact O-N 3.21Å; F155-V171 HydrophobicContact CB-CG1 4.25Å; F155-V171 CarbonylContact O-C 3.54Å; F155-V171 WeakPolarHBondContact O-CA 3.17Å; F155-N172 PolarHBondContact O-N 2.99Å; F155-F175 AromaticContact CD1-CD1 3.7Å; F155-F175 HydrophobicContact CD1-CD1 3.7Å; F155-F175 HydrophobicContact CD1-CE1 4.14Å; F155-F175 HydrophobicContact CD1-CG 4.43Å; F155-F175 HydrophobicContact CE1-CD1 4Å; F155-F175 HydrophobicContact CE1-CE1 4.17Å; F155-V176 HydrophobicContact CB-CG2 3.92Å; F155-V176 HydrophobicContact CD1-CB 4.3Å; F155-V176 HydrophobicContact CD1-CG2 3.4Å; F155-V176 HydrophobicContact CD2-CG2 4.48Å; F155-V176 HydrophobicContact CE1-CB 4.46Å; F155-V176 HydrophobicContact CE1-CG2 3.97Å; F155-V176 HydrophobicContact CG-CG2 3.69Å; F155-V179 HydrophobicContact CE1-CB 4.07Å; F155-V179 HydrophobicContact CE1-CG1 4.34Å; F155-V179 HydrophobicContact CE1-CG2 3.92Å; F155-V179 HydrophobicContact CZ-CB 4.24Å; F155-V179 HydrophobicContact CZ-CG1 4.01Å; F155-V179 HydrophobicContact CZ-CG2 4.37Å; F155-V220 HydrophobicContact CB-CG2 4.22Å; F155-V220 HydrophobicContact CD2-CG1 3.7Å; F155-V220 HydrophobicContact CD2-CG2 4.23Å; F155-V220 HydrophobicContact CE2-CG1 3.75Å; F155-V220 HydrophobicContact CG-CG1 4.41Å; F155-V220 HydrophobicContact CG-CG2 4.4Å
156	K	87	Confident	80.9	Confident	23 Å²	23	48.2 Å²	48.2	10%	0.1	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-77.8	132.8	175.9	-164.2	178.6	175.9	-177.4	0	109.6	I111 N152 E158 A159 G161 F163 D213	I111-K156 HydrophobicContact CD1-CD 4.06Å; N152-K156 WeakPolarHBondContact O-CB 3.37Å; N152-K156 PolarHBondContact O-N 3.39Å; K156-E158 VanDerWaalsContact C-N 3.31Å; K156-E158 WeakPolarHBondContact CD-O 3.44Å; K156-E158 VanDerWaalsContact CE-O 3.23Å; K156-E158 WeakPolarHBondContact CE-O 3.23Å; K156-E158 WeakPolarHBondContact CG-O 3.46Å; K156-E158 PolarHBondContact O-N 3.42Å; K156-A159 WeakPolarHBondContact CE-O 3.36Å; K156-A159 PolarHBondContact NZ-O 2.99Å; K156-G161 WeakPolarHBondContact CE-O 3.33Å; K156-G161 PolarHBondContact NZ-O 3.01Å; K156-F163 HydrophobicContact CG-CD2 4.32Å; K156-F163 HydrophobicContact CG-CE2 4.48Å; K156-D213 IonicContact NZ-OD1 2.72Å; K156-D213 PolarHBondContact NZ-OD1 3.39Å
157	R	84.5	Confident	80.5	Confident	122 Å²	122	52.2 Å²	52.2	46%	0.46	27%	0.267	S	S	.	.	S	Bend	trans	-62.4	-37.7	-178.2	-71.4	-174.4	-57.7	-147.9	-1.7	112.8	D168 G170 N172	R157-D168 IonicContact CZ-OD1 3.48Å; R157-D168 IonicContact CZ-OD2 3.02Å; R157-D168 IonicContact NH1-OD2 3.11Å; R157-D168 IonicContact NH2-OD1 3.67Å; R157-D168 PolarHBondContact NH2-OD1 3.03Å; R157-D168 IonicContact NH2-OD2 2.91Å; R157-D168 PolarHBondContact NH2-OD2 2.89Å; R157-G170 PolarHBondContact N-O 3.39Å; R157-N172 HydrophobicContact CG-CB 3.95Å
158	E	75.4	Confident	80.1	Confident	121 Å²	121	53.1 Å²	53.1	57%	0.565	27%	0.271	S	S	*	.	S	Bend	trans	-131.5	116.6	173.5	-57.4	172.4	-178	0	0	108.2	K156 N160 G161 F163	K156-E158 VanDerWaalsContact C-N 3.31Å; K156-E158 WeakPolarHBondContact CD-O 3.44Å; K156-E158 VanDerWaalsContact CE-O 3.23Å; K156-E158 WeakPolarHBondContact CE-O 3.23Å; K156-E158 WeakPolarHBondContact CG-O 3.46Å; K156-E158 PolarHBondContact O-N 3.42Å; E158-N160 PolarHBondContact O-N 3.39Å; E158-G161 PolarHBondContact O-N 2.8Å; E158-F163 HydrophobicContact CB-CE2 3.86Å; E158-F163 HydrophobicContact CB-CZ 4.17Å; E158-F163 HydrophobicContact CG-CE2 4.34Å; E158-F163 HydrophobicContact CG-CZ 4.14Å
159	A	67.3	Low	79.9	Confident	11 Å²	11	52.7 Å²	52.7	9%	0.091	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-44.8	-175	0	0	0	0	0	112.2	I111 L113 K156	I111-A159 HydrophobicContact CB-CB 4.23Å; I111-A159 VanDerWaalsContact CD1-O 3.29Å; I111-A159 WeakPolarHBondContact CD1-O 3.34Å; I111-A159 HydrophobicContact CG2-CB 3.95Å; L113-A159 HydrophobicContact CD2-CB 4.14Å; L113-A159 HydrophobicContact CG-CB 4.44Å; K156-A159 WeakPolarHBondContact CE-O 3.36Å; K156-A159 PolarHBondContact NZ-O 2.99Å
160	N	67.9	Low	79.8	Confident	115 Å²	115	50.3 Å²	50.3	62%	0.615	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	11.3	-178.9	-61.6	-25.3	0	0	0	114	E158	E158-N160 PolarHBondContact O-N 3.39Å
161	G	66.1	Low	79.8	Confident	11 Å²	11	48.9 Å²	48.9	11%	0.113	25%	0.25	C	C	.	.			trans	-67.9	136.8	178.4	0	0	0	0	0	112.3	K156 E158 F163	K156-G161 WeakPolarHBondContact CE-O 3.33Å; K156-G161 PolarHBondContact NZ-O 3.01Å; E158-G161 PolarHBondContact O-N 2.8Å; G161-F163 VanDerWaalsContact C-N 3.26Å; G161-F163 WeakPolarHBondContact O-CD2 3Å; G161-F163 PolarHBondContact O-N 3.5Å
162	L	62.9	Low	79.7	Confident	156 Å²	156	51.4 Å²	51.4	82%	0.817	26%	0.263	S	S	*	.			trans	-78.6	65.1	179.3	-72.1	159.7	0	0	0	111.3	N164	L162-N164 PolarHBondContact O-N 2.97Å
163	F	63.4	Low	79.7	Confident	30 Å²	30	52.7 Å²	52.7	13%	0.132	28%	0.277	C	S	.	.			trans	-81.3	42.5	179.3	-61.6	-72.8	0	0	0	113.5	K156 E158 G161 T165 R216	K156-F163 HydrophobicContact CG-CD2 4.32Å; K156-F163 HydrophobicContact CG-CE2 4.48Å; E158-F163 HydrophobicContact CB-CE2 3.86Å; E158-F163 HydrophobicContact CB-CZ 4.17Å; E158-F163 HydrophobicContact CG-CE2 4.34Å; E158-F163 HydrophobicContact CG-CZ 4.14Å; G161-F163 VanDerWaalsContact C-N 3.26Å; G161-F163 WeakPolarHBondContact O-CD2 3Å; G161-F163 PolarHBondContact O-N 3.5Å; F163-T165 PolarHBondContact O-N 3.18Å; F163-T165 VanDerWaalsContact O-N 3.12Å; F163-R216 PolarHBondContact O-NH2 3.33Å
164	N	69.6	Low	79.8	Confident	88 Å²	88	60.7 Å²	60.7	47%	0.471	31%	0.311	S	S	.	.			trans	-84.8	24.4	-172.4	-66.4	-20.3	0	0	0	113.5	L162 F253	L162-N164 PolarHBondContact O-N 2.97Å; N164-F253 WeakPolarHBondContact O-CE1 3.29Å
165	T	80.5	Confident	80	Confident	70 Å²	70	60.3 Å²	60.3	43%	0.429	31%	0.308	S	S	.	.	S	Bend	trans	-102.9	153.9	-177.7	68.8	0	0	0	0	111.6	F163 E167 D168 W257	F163-T165 PolarHBondContact O-N 3.18Å; F163-T165 VanDerWaalsContact O-N 3.12Å; T165-E167 PolarHBondContact O-N 3.33Å; T165-D168 PolarHBondContact OG1-N 3.37Å; T165-W257 PolarHBondContact O-NE1 2.97Å
166	I	81.1	Confident	80.1	Confident	52 Å²	52	60.2 Å²	60.2	27%	0.267	31%	0.307	S	S	.	.	S	Bend	trans	-67.1	-26.6	172.3	58.1	174.4	0	0	0	111.4	F253 H256	I166-F253 HydrophobicContact CG2-CD1 3.81Å; I166-F253 HydrophobicContact CG2-CD2 4.38Å; I166-F253 HydrophobicContact CG2-CE1 3.73Å; I166-F253 HydrophobicContact CG2-CE2 4.29Å; I166-F253 HydrophobicContact CG2-CG 4.15Å; I166-F253 HydrophobicContact CG2-CZ 3.97Å; I166-H256 HydrophobicContact CB-CB 4.19Å; I166-H256 WeakPolarHBondContact O-CB 3.42Å
167	E	78.6	Confident	80.4	Confident	149 Å²	149	60.5 Å²	60.5	70%	0.696	31%	0.312	S	S	*	.	S	Bend	trans	-75.8	-32.3	-175.6	-61.4	-174.4	170.5	0	0	112.6	T165 R260	T165-E167 PolarHBondContact O-N 3.33Å; E167-R260 WeakPolarHBondContact O-CD 3.4Å; E167-R260 PolarHBondContact O-NH1 3.4Å
168	D	81.9	Confident	80.8	Confident	33 Å²	33	55.4 Å²	55.4	18%	0.176	30%	0.296	C	S	.	.			trans	-137	117.6	-176.9	-154.2	-37.6	0	0	0	112.5	R157 T165 G170 R260	R157-D168 IonicContact CZ-OD1 3.48Å; R157-D168 IonicContact CZ-OD2 3.02Å; R157-D168 IonicContact NH1-OD2 3.11Å; R157-D168 IonicContact NH2-OD1 3.67Å; R157-D168 PolarHBondContact NH2-OD1 3.03Å; R157-D168 IonicContact NH2-OD2 2.91Å; R157-D168 PolarHBondContact NH2-OD2 2.89Å; T165-D168 PolarHBondContact OG1-N 3.37Å; D168-G170 PolarHBondContact O-N 3.18Å; D168-G170 WeakPolarHBondContact OD1-CA 3.47Å; D168-G170 PolarHBondContact OD1-N 2.58Å; D168-R260 IonicContact OD1-NH1 2.78Å; D168-R260 IonicContact OD2-NH1 3.97Å; D168-R260 PolarHBondContact OD2-NH1 3.03Å; D168-R260 VanDerWaalsContact OD2-NH1 3.16Å
169	S	85.3	Confident	81.7	Confident	11 Å²	11	49.7 Å²	49.7	8%	0.077	27%	0.269	C	S	.	.			trans	-71.3	-16.3	174.5	65.9	0	0	0	0	112.6	V171 R216 W257	S169-V171 PolarHBondContact O-N 2.77Å; S169-V171 PolarHBondContact OG-N 3.32Å; S169-R216 VanDerWaalsContact O-CD 3.29Å; S169-R216 WeakPolarHBondContact O-CD 3.47Å; S169-R216 PolarHBondContact O-NE 2.89Å; S169-W257 VanDerWaalsContact CB-CD2 3.45Å
170	G	85.6	Confident	83	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.265	C	S	.	.			trans	72.3	-2	-171.8	0	0	0	0	0	114.1	R157 D168	R157-G170 PolarHBondContact N-O 3.39Å; D168-G170 PolarHBondContact O-N 3.18Å; D168-G170 WeakPolarHBondContact OD1-CA 3.47Å; D168-G170 PolarHBondContact OD1-N 2.58Å
171	V	89.6	Confident	84.2	Confident	11 Å²	11	48.1 Å²	48.1	7%	0.067	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-82.7	132.1	-178.3	176.2	0	0	0	0	110.2	F155 S169 G173 V176 R216 F219 V220	F155-V171 HydrophobicContact CB-CG1 4.25Å; F155-V171 CarbonylContact O-C 3.54Å; F155-V171 WeakPolarHBondContact O-CA 3.17Å; S169-V171 PolarHBondContact O-N 2.77Å; S169-V171 PolarHBondContact OG-N 3.32Å; V171-G173 VanDerWaalsContact C-N 3.34Å; V171-G173 PolarHBondContact O-N 3.22Å; V171-V176 HydrophobicContact CG1-CG2 3.68Å; V171-R216 HydrophobicContact CG2-CB 3.94Å; V171-R216 HydrophobicContact CG2-CG 3.94Å; V171-F219 HydrophobicContact CB-CD1 4.41Å; V171-F219 HydrophobicContact CB-CE1 4.37Å; V171-F219 HydrophobicContact CG1-CD1 4.39Å; V171-F219 HydrophobicContact CG1-CE1 4.34Å; V171-F219 HydrophobicContact CG2-CD1 4.3Å; V171-V220 HydrophobicContact CG1-CG2 3.89Å
172	N	90.2	Very high	85.5	Confident	54 Å²	54	47.9 Å²	47.9	29%	0.289	26%	0.256	S	S	.	.			trans	-75.2	84.2	172	-171.8	-16.9	0	0	0	110.5	F155 R157 K174 F175 V176	F155-N172 PolarHBondContact O-N 2.99Å; R157-N172 HydrophobicContact CG-CB 3.95Å; N172-K174 PolarHBondContact O-N 2.98Å; N172-K174 PolarHBondContact OD1-N 2.79Å; N172-F175 HydrophobicContact CB-CB 3.99Å; N172-F175 PolarHBondContact O-N 3.06Å; N172-F175 PolarHBondContact OD1-N 3.18Å; N172-F175 VanDerWaalsContact OD1-N 3.13Å; N172-V176 WeakPolarHBondContact O-CG2 3.36Å; N172-V176 PolarHBondContact O-N 3.37Å
173	G	88.8	Confident	87.1	Confident	31 Å²	31	40.5 Å²	40.5	32%	0.32	22%	0.217	S	C	.	.	H	α-helix	trans	-59.4	-29.2	-178.4	0	0	0	0	0	114.6	V171 S177	V171-G173 VanDerWaalsContact C-N 3.34Å; V171-G173 PolarHBondContact O-N 3.22Å; G173-S177 WeakPolarHBondContact O-CB 3.31Å; G173-S177 PolarHBondContact O-N 2.96Å; G173-S177 PolarHBondContact O-OG 2.93Å
174	K	89.8	Confident	88.4	Confident	172 Å²	172	43.7 Å²	43.7	75%	0.748	24%	0.236	S	C	*	.	H	α-helix	trans	-66.3	-43.9	174.3	-68.9	-175.3	179.3	-179.9	0	110.7	N172 S177 A178	N172-K174 PolarHBondContact O-N 2.98Å; N172-K174 PolarHBondContact OD1-N 2.79Å; K174-S177 PolarHBondContact O-N 2.82Å; K174-A178 PolarHBondContact O-N 2.89Å
175	F	93.4	Very high	89.5	Confident	5 Å²	5	43.3 Å²	43.3	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-67.7	-43.3	177.6	-172.5	-138.7	0	0	0	112.2	T118 F121 F140 A154 F155 N172 S177 A178 V179	T118-F175 HydrophobicContact CG2-CD2 4.28Å; T118-F175 WeakPolarHBondContact OG1-CB 3.4Å; F121-F175 HydrophobicContact CB-CE2 3.67Å; F121-F175 HydrophobicContact CB-CZ 4.32Å; F121-F175 HydrophobicContact CD1-CE2 4.38Å; F121-F175 AromaticContact CG-CE2 3.99Å; F121-F175 HydrophobicContact CG-CE2 3.99Å; F140-F175 HydrophobicContact CE2-CZ 4.12Å; F140-F175 HydrophobicContact CZ-CE1 4.3Å; F140-F175 AromaticContact CZ-CZ 3.78Å; F140-F175 HydrophobicContact CZ-CZ 3.78Å; A154-F175 WeakPolarHBondContact O-CE1 3.27Å; F155-F175 AromaticContact CD1-CD1 3.7Å; F155-F175 HydrophobicContact CD1-CD1 3.7Å; F155-F175 HydrophobicContact CD1-CE1 4.14Å; F155-F175 HydrophobicContact CD1-CG 4.43Å; F155-F175 HydrophobicContact CE1-CD1 4Å; F155-F175 HydrophobicContact CE1-CE1 4.17Å; N172-F175 HydrophobicContact CB-CB 3.99Å; N172-F175 PolarHBondContact O-N 3.06Å; N172-F175 PolarHBondContact OD1-N 3.18Å; N172-F175 VanDerWaalsContact OD1-N 3.13Å; F175-S177 PolarHBondContact O-N 3.4Å; F175-A178 PolarHBondContact O-N 3.44Å; F175-V179 HydrophobicContact CD2-CG2 3.92Å; F175-V179 HydrophobicContact CE1-CG2 4.41Å; F175-V179 HydrophobicContact CE2-CG2 3.57Å; F175-V179 HydrophobicContact CG-CG2 4.48Å; F175-V179 HydrophobicContact CZ-CG2 3.86Å; F175-V179 WeakPolarHBondContact O-CG2 3.29Å; F175-V179 PolarHBondContact O-N 2.84Å
176	V	93.8	Very high	90.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.2	-42.6	172.7	173.5	0	0	0	0	111.2	F155 V171 N172 Y180 V220	F155-V176 HydrophobicContact CB-CG2 3.92Å; F155-V176 HydrophobicContact CD1-CB 4.3Å; F155-V176 HydrophobicContact CD1-CG2 3.4Å; F155-V176 HydrophobicContact CD2-CG2 4.48Å; F155-V176 HydrophobicContact CE1-CB 4.46Å; F155-V176 HydrophobicContact CE1-CG2 3.97Å; F155-V176 HydrophobicContact CG-CG2 3.69Å; V171-V176 HydrophobicContact CG1-CG2 3.68Å; N172-V176 WeakPolarHBondContact O-CG2 3.36Å; N172-V176 PolarHBondContact O-N 3.37Å; V176-Y180 HydrophobicContact CG1-CD2 3.6Å; V176-Y180 HydrophobicContact CG1-CE2 3.64Å; V176-Y180 WeakPolarHBondContact O-CB 3.36Å; V176-Y180 VanDerWaalsContact O-CD2 3.3Å; V176-Y180 WeakPolarHBondContact O-CD2 3.3Å; V176-Y180 PolarHBondContact O-N 3.2Å; V176-Y180 VanDerWaalsContact O-N 3.08Å; V176-V220 HydrophobicContact CG1-CG1 4.37Å; V176-V220 HydrophobicContact CG2-CG1 4.47Å; V176-V220 HydrophobicContact CG2-CG2 4.07Å
177	S	91.9	Very high	90.7	Very high	29 Å²	29	39.6 Å²	39.6	20%	0.203	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-50.7	178.4	-56.6	0	0	0	0	111.3	G173 K174 F175 V179 Y180 D181	G173-S177 WeakPolarHBondContact O-CB 3.31Å; G173-S177 PolarHBondContact O-N 2.96Å; G173-S177 PolarHBondContact O-OG 2.93Å; K174-S177 PolarHBondContact O-N 2.82Å; F175-S177 PolarHBondContact O-N 3.4Å; S177-V179 PolarHBondContact O-N 3.47Å; S177-Y180 PolarHBondContact O-N 3.06Å; S177-D181 VanDerWaalsContact O-CB 3.27Å; S177-D181 WeakPolarHBondContact O-CB 3.44Å; S177-D181 PolarHBondContact O-N 2.83Å
178	A	93.1	Very high	91.4	Very high	15 Å²	15	39.1 Å²	39.1	12%	0.124	22%	0.218	C	C	.	.	H	α-helix	trans	-58.3	-43.8	178.8	0	0	0	0	0	113.1	T118 K174 F175 S182	T118-A178 HydrophobicContact CG2-CB 3.64Å; K174-A178 PolarHBondContact O-N 2.89Å; F175-A178 PolarHBondContact O-N 3.44Å; A178-S182 WeakPolarHBondContact O-CB 3.48Å; A178-S182 PolarHBondContact O-N 3.26Å; A178-S182 VanDerWaalsContact O-N 3.09Å; A178-S182 PolarHBondContact O-OG 3.27Å
179	V	94.9	Very high	91.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-43.2	178.3	171.9	0	0	0	0	111.6	F121 F140 Y141 F155 F175 S177 L183	F121-V179 HydrophobicContact CD1-CG2 3.89Å; F121-V179 HydrophobicContact CD2-CG2 4.36Å; F121-V179 HydrophobicContact CE1-CB 4.22Å; F121-V179 HydrophobicContact CE1-CG2 3.81Å; F121-V179 HydrophobicContact CE2-CG2 4.29Å; F121-V179 HydrophobicContact CG-CG2 4.18Å; F121-V179 HydrophobicContact CZ-CB 4.34Å; F121-V179 HydrophobicContact CZ-CG1 4.32Å; F121-V179 HydrophobicContact CZ-CG2 4.02Å; F140-V179 HydrophobicContact CE1-CG1 3.92Å; F140-V179 HydrophobicContact CE1-CG2 3.93Å; F140-V179 HydrophobicContact CZ-CG2 4.01Å; Y141-V179 HydrophobicContact CD1-CG1 4.44Å; Y141-V179 HydrophobicContact CE1-CG1 3.57Å; Y141-V179 PolarHBondContact OH-O 3.13Å; F155-V179 HydrophobicContact CE1-CB 4.07Å; F155-V179 HydrophobicContact CE1-CG1 4.34Å; F155-V179 HydrophobicContact CE1-CG2 3.92Å; F155-V179 HydrophobicContact CZ-CB 4.24Å; F155-V179 HydrophobicContact CZ-CG1 4.01Å; F155-V179 HydrophobicContact CZ-CG2 4.37Å; F175-V179 HydrophobicContact CD2-CG2 3.92Å; F175-V179 HydrophobicContact CE1-CG2 4.41Å; F175-V179 HydrophobicContact CE2-CG2 3.57Å; F175-V179 HydrophobicContact CG-CG2 4.48Å; F175-V179 HydrophobicContact CZ-CG2 3.86Å; F175-V179 WeakPolarHBondContact O-CG2 3.29Å; F175-V179 PolarHBondContact O-N 2.84Å; S177-V179 PolarHBondContact O-N 3.47Å; V179-L183 PolarHBondContact O-N 2.84Å
180	Y	94.8	Very high	92.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-76.7	-36.5	179.4	-81	-45.9	0	0	0	113.6	F145 V176 S177 S182 L183 V220 Q223 N224 P225	F145-Y180 HydrophobicContact CE1-CE1 4.02Å; F145-Y180 WeakPolarHBondContact CE1-OH 3.35Å; F145-Y180 AromaticContact CZ-CE1 3.65Å; F145-Y180 HydrophobicContact CZ-CE1 3.65Å; F145-Y180 AromaticContact CZ-CZ 3.92Å; V176-Y180 HydrophobicContact CG1-CD2 3.6Å; V176-Y180 HydrophobicContact CG1-CE2 3.64Å; V176-Y180 WeakPolarHBondContact O-CB 3.36Å; V176-Y180 VanDerWaalsContact O-CD2 3.3Å; V176-Y180 WeakPolarHBondContact O-CD2 3.3Å; V176-Y180 PolarHBondContact O-N 3.2Å; V176-Y180 VanDerWaalsContact O-N 3.08Å; S177-Y180 PolarHBondContact O-N 3.06Å; Y180-S182 PolarHBondContact O-N 2.81Å; Y180-L183 HydrophobicContact CD1-CD2 4.15Å; Y180-L183 WeakPolarHBondContact O-CB 3.42Å; Y180-L183 PolarHBondContact O-N 2.78Å; Y180-L183 VanDerWaalsContact O-N 3.14Å; Y180-V220 HydrophobicContact CE2-CG1 4.09Å; Y180-V220 WeakPolarHBondContact CE2-O 3.3Å; Y180-V220 PolarHBondContact OH-O 3.49Å; Y180-Q223 HydrophobicContact CD2-CB 4.05Å; Y180-Q223 HydrophobicContact CE2-CB 3.85Å; Y180-N224 HydrophobicContact CD1-CB 4.28Å; Y180-N224 HydrophobicContact CE1-CB 3.63Å; Y180-P225 WeakPolarHBondContact O-CG 3.22Å
181	D	92.5	Very high	92.8	Very high	93 Å²	93	43.5 Å²	43.5	50%	0.497	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-33.3	179.3	-65.2	-9.6	0	0	0	110.4	S177 R265	S177-D181 VanDerWaalsContact O-CB 3.27Å; S177-D181 WeakPolarHBondContact O-CB 3.44Å; S177-D181 PolarHBondContact O-N 2.83Å; D181-R265 IonicContact OD1-CZ 3.27Å; D181-R265 IonicContact OD1-NH1 3.02Å; D181-R265 PolarHBondContact OD1-NH1 3.44Å; D181-R265 IonicContact OD1-NH2 3.52Å
182	S	94.5	Very high	92.9	Very high	7 Å²	7	49.5 Å²	49.5	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-71.8	-29.1	172.9	-60.2	0	0	0	0	113.5	A178 Y180 L184 S185 T186	A178-S182 WeakPolarHBondContact O-CB 3.48Å; A178-S182 PolarHBondContact O-N 3.26Å; A178-S182 VanDerWaalsContact O-N 3.09Å; A178-S182 PolarHBondContact O-OG 3.27Å; Y180-S182 PolarHBondContact O-N 2.81Å; S182-L184 VanDerWaalsContact C-N 3.33Å; S182-L184 PolarHBondContact O-N 3.07Å; S182-S185 PolarHBondContact O-N 3.23Å; S182-S185 PolarHBondContact O-OG 3.31Å; S182-T186 WeakPolarHBondContact O-CG2 3.48Å; S182-T186 PolarHBondContact O-N 3.46Å
183	L	94.8	Very high	93.1	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-40.9	-172	179.5	57.9	0	0	0	113.2	Y141 V179 Y180 S185 T186 Q191 V194 Q226	Y141-L183 HydrophobicContact CD1-CD1 4.21Å; Y141-L183 HydrophobicContact CE1-CB 4.33Å; Y141-L183 HydrophobicContact CE1-CD1 3.79Å; Y141-L183 HydrophobicContact CE1-CG 4.47Å; Y141-L183 HydrophobicContact CE2-CD1 4.38Å; Y141-L183 WeakPolarHBondContact OH-CA 3.25Å; Y141-L183 PolarHBondContact OH-N 3.05Å; V179-L183 PolarHBondContact O-N 2.84Å; Y180-L183 HydrophobicContact CD1-CD2 4.15Å; Y180-L183 WeakPolarHBondContact O-CB 3.42Å; Y180-L183 PolarHBondContact O-N 2.78Å; Y180-L183 VanDerWaalsContact O-N 3.14Å; L183-S185 PolarHBondContact O-N 3.46Å; L183-T186 WeakPolarHBondContact O-CB 3.26Å; L183-T186 PolarHBondContact O-N 3.22Å; L183-T186 VanDerWaalsContact O-N 3.15Å; L183-T186 PolarHBondContact O-OG1 2.82Å; L183-Q191 HydrophobicContact CD1-CG 4.33Å; L183-V194 HydrophobicContact CD1-CB 4.46Å; L183-V194 HydrophobicContact CD1-CG2 3.82Å; L183-V194 HydrophobicContact CD2-CG1 4.14Å; L183-Q226 HydrophobicContact CD2-CG 3.91Å; L183-Q226 HydrophobicContact CG-CG 4.42Å
184	L	91.2	Very high	93.4	Very high	98 Å²	98	46.6 Å²	46.6	51%	0.513	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.7	-179.1	-65.4	-176	0	0	0	113.1	S182 Q191 P225 Q226	S182-L184 VanDerWaalsContact C-N 3.33Å; S182-L184 PolarHBondContact O-N 3.07Å; L184-Q191 PolarHBondContact O-NE2 3.23Å; L184-P225 HydrophobicContact CD1-CB 4.02Å; L184-P225 HydrophobicContact CD1-CG 4.42Å; L184-P225 HydrophobicContact CD2-CB 4.42Å; L184-P225 HydrophobicContact CD2-CG 4.36Å; L184-P225 HydrophobicContact CG-CB 4.18Å; L184-P225 HydrophobicContact CG-CG 4.07Å; L184-Q226 HydrophobicContact CD2-CG 4.31Å
185	S	92.4	Very high	93.6	Very high	79 Å²	79	39.5 Å²	39.5	55%	0.552	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-9.9	175.6	71.6	0	0	0	0	113.7	S182 L183	S182-S185 PolarHBondContact O-N 3.23Å; S182-S185 PolarHBondContact O-OG 3.31Å; L183-S185 PolarHBondContact O-N 3.46Å
186	T	93.6	Very high	93.5	Very high	6 Å²	6	46 Å²	46	4%	0.037	24%	0.239	C	C	.	.	S	Bend	trans	-79.7	157.7	179.7	68.8	0	0	0	0	112.2	W134 V137 Y141 S182 L183 Q191	W134-T186 HydrophobicContact CE3-CG2 4.29Å; W134-T186 HydrophobicContact CH2-CG2 4.45Å; W134-T186 HydrophobicContact CZ3-CG2 3.78Å; V137-T186 HydrophobicContact CG1-CG2 4.41Å; Y141-T186 HydrophobicContact CE2-CG2 4.12Å; S182-T186 WeakPolarHBondContact O-CG2 3.48Å; S182-T186 PolarHBondContact O-N 3.46Å; L183-T186 WeakPolarHBondContact O-CB 3.26Å; L183-T186 PolarHBondContact O-N 3.22Å; L183-T186 VanDerWaalsContact O-N 3.15Å; L183-T186 PolarHBondContact O-OG1 2.82Å; T186-Q191 PolarHBondContact O-NE2 2.73Å
187	P	94.4	Very high	93.3	Very high	39 Å²	39	46.4 Å²	46.4	25%	0.253	24%	0.244	S	C	.	.			trans	-49.5	147.4	171.1	-32.5	37.7	0	0	0	114.8	W134 D189 I190 Q191	W134-P187 VanDerWaalsContact CD2-CD 3.47Å; W134-P187 HydrophobicContact CD2-CG 3.86Å; W134-P187 VanDerWaalsContact CE2-CD 3.44Å; W134-P187 HydrophobicContact CG-CG 3.75Å; W134-P187 HydrophobicContact CZ2-CG 4.47Å; P187-D189 WeakPolarHBondContact CB-OD1 3.46Å; P187-D189 PolarHBondContact O-N 3.03Å; P187-D189 VanDerWaalsContact O-N 3.17Å; P187-I190 PolarHBondContact O-N 3.42Å; P187-I190 VanDerWaalsContact O-N 3.07Å; P187-Q191 PolarHBondContact O-N 3.2Å
188	Q	92.4	Very high	93.3	Very high	139 Å²	139	45 Å²	45	65%	0.65	24%	0.235	S	C	*	.	H	α-helix	trans	-60.4	-28.6	-175.4	-73.5	-169.1	1.7	0	0	114	Q191 K192	Q188-Q191 PolarHBondContact O-N 3.37Å; Q188-K192 WeakPolarHBondContact O-CB 3.29Å; Q188-K192 VanDerWaalsContact O-CG 3.28Å; Q188-K192 WeakPolarHBondContact O-CG 3.29Å; Q188-K192 PolarHBondContact O-N 3.03Å
189	D	93.2	Very high	93.1	Very high	91 Å²	91	47.2 Å²	47.2	49%	0.487	24%	0.244	S	C	.	.	H	α-helix	trans	-66.4	-39.5	176.4	64.5	-55.4	0	0	0	111.6	P187 K192 L193	P187-D189 WeakPolarHBondContact CB-OD1 3.46Å; P187-D189 PolarHBondContact O-N 3.03Å; P187-D189 VanDerWaalsContact O-N 3.17Å; D189-K192 PolarHBondContact O-N 3.04Å; D189-L193 VanDerWaalsContact O-CB 3.27Å; D189-L193 WeakPolarHBondContact O-CB 3.38Å; D189-L193 PolarHBondContact O-N 3.38Å
190	I	94.1	Very high	92.8	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-66.1	-44.7	174.1	-59.3	-176.4	0	0	0	110.3	W134 R138 Y141 P187 K192 L193 V194	W134-I190 HydrophobicContact CB-CD1 3.73Å; W134-I190 HydrophobicContact CD2-CD1 4.44Å; W134-I190 HydrophobicContact CE3-CD1 4.25Å; W134-I190 HydrophobicContact CG-CD1 4.27Å; R138-I190 HydrophobicContact CB-CD1 3.86Å; R138-I190 HydrophobicContact CB-CG1 4.08Å; R138-I190 HydrophobicContact CG-CD1 4.49Å; R138-I190 HydrophobicContact CG-CG1 4.17Å; Y141-I190 HydrophobicContact CD2-CG2 3.6Å; Y141-I190 HydrophobicContact CE2-CG2 4.24Å; Y141-I190 HydrophobicContact CG-CG2 4.07Å; P187-I190 PolarHBondContact O-N 3.42Å; P187-I190 VanDerWaalsContact O-N 3.07Å; I190-K192 PolarHBondContact O-N 2.88Å; I190-L193 WeakPolarHBondContact O-CB 3.46Å; I190-L193 PolarHBondContact O-N 3.2Å; I190-L193 VanDerWaalsContact O-N 3.12Å; I190-V194 PolarHBondContact O-N 3.18Å
191	Q	94.5	Very high	92.4	Very high	44 Å²	44	51 Å²	51	21%	0.206	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-47.1	175.5	-68.8	-169.8	36.3	0	0	111.9	L183 L184 T186 P187 Q188 L193 V194 L195 Q226	L183-Q191 HydrophobicContact CD1-CG 4.33Å; L184-Q191 PolarHBondContact O-NE2 3.23Å; T186-Q191 PolarHBondContact O-NE2 2.73Å; P187-Q191 PolarHBondContact O-N 3.2Å; Q188-Q191 PolarHBondContact O-N 3.37Å; Q191-L193 VanDerWaalsContact C-N 3.3Å; Q191-L193 PolarHBondContact O-N 3.27Å; Q191-V194 PolarHBondContact O-N 3.5Å; Q191-L195 PolarHBondContact O-N 2.89Å; Q191-Q226 VanDerWaalsContact C-NE2 3.28Å; Q191-Q226 VanDerWaalsContact CA-NE2 3.33Å; Q191-Q226 VanDerWaalsContact CB-NE2 3.3Å; Q191-Q226 PolarHBondContact O-NE2 3.19Å
192	K	93.4	Very high	92	Very high	136 Å²	136	47.1 Å²	47.1	59%	0.591	24%	0.244	S	C	*	.	H	α-helix	trans	-64.6	-35.4	176	-72.8	172.4	-174.5	175.6	0	112.2	Q188 D189 I190 L195 K196	Q188-K192 WeakPolarHBondContact O-CB 3.29Å; Q188-K192 VanDerWaalsContact O-CG 3.28Å; Q188-K192 WeakPolarHBondContact O-CG 3.29Å; Q188-K192 PolarHBondContact O-N 3.03Å; D189-K192 PolarHBondContact O-N 3.04Å; I190-K192 PolarHBondContact O-N 2.88Å; K192-L195 PolarHBondContact O-N 3.37Å; K192-K196 PolarHBondContact O-N 3.5Å
193	L	94.1	Very high	91.4	Very high	24 Å²	24	52.7 Å²	52.7	13%	0.126	27%	0.272	C	S	.	.	H	α-helix	trans	-63.1	-45	178.3	-173.1	155.5	0	0	0	111.4	R138 L142 D189 I190 Q191 L195 K196 G197	R138-L193 HydrophobicContact CG-CD1 4.22Å; L142-L193 HydrophobicContact CB-CD1 4.24Å; L142-L193 HydrophobicContact CB-CD2 3.62Å; L142-L193 HydrophobicContact CD1-CD1 4.09Å; L142-L193 HydrophobicContact CD1-CD2 3.68Å; L142-L193 HydrophobicContact CD1-CG 4.09Å; L142-L193 HydrophobicContact CG-CD2 4.25Å; D189-L193 VanDerWaalsContact O-CB 3.27Å; D189-L193 WeakPolarHBondContact O-CB 3.38Å; D189-L193 PolarHBondContact O-N 3.38Å; I190-L193 WeakPolarHBondContact O-CB 3.46Å; I190-L193 PolarHBondContact O-N 3.2Å; I190-L193 VanDerWaalsContact O-N 3.12Å; Q191-L193 VanDerWaalsContact C-N 3.3Å; Q191-L193 PolarHBondContact O-N 3.27Å; L193-L195 VanDerWaalsContact C-N 3.35Å; L193-L195 PolarHBondContact O-N 3.17Å; L193-K196 WeakPolarHBondContact O-CB 3.37Å; L193-K196 PolarHBondContact O-N 3.41Å; L193-G197 PolarHBondContact O-N 2.85Å
194	V	93.8	Very high	90.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.7	-47.9	175.9	172.4	0	0	0	0	110.6	Y141 F145 L183 I190 Q191 K196 G197 I198	Y141-V194 HydrophobicContact CD1-CG2 3.48Å; Y141-V194 VanDerWaalsContact CD1-CG2 3.48Å; Y141-V194 HydrophobicContact CE1-CG2 4.31Å; Y141-V194 HydrophobicContact CG-CG2 3.81Å; F145-V194 HydrophobicContact CD1-CG1 4.29Å; F145-V194 HydrophobicContact CD2-CG1 3.95Å; F145-V194 HydrophobicContact CD2-CG2 4.16Å; F145-V194 HydrophobicContact CE2-CG1 4.22Å; F145-V194 HydrophobicContact CG-CG1 3.99Å; F145-V194 HydrophobicContact CZ-CG1 4.5Å; L183-V194 HydrophobicContact CD1-CB 4.46Å; L183-V194 HydrophobicContact CD1-CG2 3.82Å; L183-V194 HydrophobicContact CD2-CG1 4.14Å; I190-V194 PolarHBondContact O-N 3.18Å; Q191-V194 PolarHBondContact O-N 3.5Å; V194-K196 VanDerWaalsContact C-N 3.31Å; V194-K196 PolarHBondContact O-N 3.16Å; V194-G197 PolarHBondContact O-N 3.16Å; V194-I198 HydrophobicContact CG1-CD1 3.93Å; V194-I198 HydrophobicContact CG1-CG1 4.49Å; V194-I198 VanDerWaalsContact O-CG1 3.32Å; V194-I198 WeakPolarHBondContact O-CG1 3.48Å; V194-I198 PolarHBondContact O-N 3.09Å
195	L	93.9	Very high	88.7	Confident	24 Å²	24	62.5 Å²	62.5	13%	0.126	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-40.6	177.4	-67.4	176	0	0	0	112.3	Q191 K192 L193 I198 I199 Q226 Y227 T232 I235	Q191-L195 PolarHBondContact O-N 2.89Å; K192-L195 PolarHBondContact O-N 3.37Å; L193-L195 VanDerWaalsContact C-N 3.35Å; L193-L195 PolarHBondContact O-N 3.17Å; L195-I198 PolarHBondContact O-N 3.27Å; L195-I199 VanDerWaalsContact O-CG1 3.28Å; L195-I199 WeakPolarHBondContact O-CG1 3.42Å; L195-I199 PolarHBondContact O-N 2.72Å; L195-Q226 HydrophobicContact CD2-CB 4.09Å; L195-Y227 HydrophobicContact CD2-CE1 4.39Å; L195-T232 HydrophobicContact CD1-CG2 3.68Å; L195-T232 HydrophobicContact CD2-CG2 4.29Å; L195-I235 HydrophobicContact CB-CD1 3.88Å; L195-I235 HydrophobicContact CD1-CD1 4.37Å; L195-I235 HydrophobicContact CD2-CD1 3.98Å; L195-I235 HydrophobicContact CG-CD1 4.3Å
196	K	92.3	Very high	87.2	Confident	140 Å²	140	64.8 Å²	64.8	61%	0.609	31%	0.306	S	S	*	.	H	α-helix	trans	-62.6	-43.5	175.4	-174.5	-179.4	177.9	-177.3	0	111.9	K192 L193 V194 I198 I199 N200	K192-K196 PolarHBondContact O-N 3.5Å; L193-K196 WeakPolarHBondContact O-CB 3.37Å; L193-K196 PolarHBondContact O-N 3.41Å; V194-K196 VanDerWaalsContact C-N 3.31Å; V194-K196 PolarHBondContact O-N 3.16Å; K196-I198 VanDerWaalsContact C-N 3.34Å; K196-I198 PolarHBondContact O-N 3.21Å; K196-I199 PolarHBondContact O-N 2.93Å; K196-N200 VanDerWaalsContact O-CG 3.26Å; K196-N200 PolarHBondContact O-N 3.4Å
197	G	90.2	Very high	85.3	Confident	10 Å²	10	73.2 Å²	73.2	10%	0.103	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-43.8	174.7	0	0	0	0	0	112.2	F145 L193 V194 N200 S201	F145-G197 CarbonylContact O-C 3.46Å; F145-G197 VanDerWaalsContact O-CA 3.26Å; F145-G197 WeakPolarHBondContact O-CA 3.49Å; F145-G197 VanDerWaalsContact O-O 3.14Å; L193-G197 PolarHBondContact O-N 2.85Å; V194-G197 PolarHBondContact O-N 3.16Å; G197-N200 PolarHBondContact O-N 2.97Å; G197-S201 WeakPolarHBondContact O-CB 3.35Å; G197-S201 PolarHBondContact O-N 3Å; G197-S201 PolarHBondContact O-OG 2.87Å
198	I	91.1	Very high	83.8	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-46.6	175.7	-64.6	172.7	0	0	0	111.1	F145 V194 L195 K196 N200 S201 L202 L221 N224 I235	F145-I198 HydrophobicContact CD1-CD1 4.37Å; F145-I198 HydrophobicContact CD1-CG1 4.11Å; V194-I198 HydrophobicContact CG1-CD1 3.93Å; V194-I198 HydrophobicContact CG1-CG1 4.49Å; V194-I198 VanDerWaalsContact O-CG1 3.32Å; V194-I198 WeakPolarHBondContact O-CG1 3.48Å; V194-I198 PolarHBondContact O-N 3.09Å; L195-I198 PolarHBondContact O-N 3.27Å; K196-I198 VanDerWaalsContact C-N 3.34Å; K196-I198 PolarHBondContact O-N 3.21Å; I198-N200 VanDerWaalsContact C-N 3.33Å; I198-N200 PolarHBondContact O-N 2.78Å; I198-S201 WeakPolarHBondContact O-CB 3.48Å; I198-S201 PolarHBondContact O-N 3.38Å; I198-L202 HydrophobicContact CG2-CD1 3.72Å; I198-L202 HydrophobicContact CG2-CG 4.14Å; I198-L202 WeakPolarHBondContact O-CB 3.26Å; I198-L202 VanDerWaalsContact O-CG 3.26Å; I198-L202 WeakPolarHBondContact O-CG 3.39Å; I198-L202 PolarHBondContact O-N 2.96Å; I198-L221 HydrophobicContact CD1-CD2 3.91Å; I198-L221 HydrophobicContact CG1-CD2 3.7Å; I198-L221 HydrophobicContact CG2-CD2 4.35Å; I198-N224 WeakPolarHBondContact CD1-ND2 3.48Å; I198-I235 HydrophobicContact CG2-CG2 3.95Å
199	I	89.8	Confident	82.4	Confident	61 Å²	61	72.2 Å²	72.2	31%	0.313	36%	0.355	S	S	.	.	H	α-helix	trans	-55.8	-50.3	176.1	-71	162.6	0	0	0	110.2	L195 K196 S201 L202 L203 I235	L195-I199 VanDerWaalsContact O-CG1 3.28Å; L195-I199 WeakPolarHBondContact O-CG1 3.42Å; L195-I199 PolarHBondContact O-N 2.72Å; K196-I199 PolarHBondContact O-N 2.93Å; I199-S201 VanDerWaalsContact C-N 3.29Å; I199-S201 PolarHBondContact O-N 3.49Å; I199-L202 PolarHBondContact O-N 3.12Å; I199-L203 HydrophobicContact CG2-CD1 3.5Å; I199-L203 VanDerWaalsContact CG2-CD1 3.5Å; I199-L203 HydrophobicContact CG2-CG 4.06Å; I199-L203 WeakPolarHBondContact O-CB 3.43Å; I199-L203 VanDerWaalsContact O-CG 3.29Å; I199-L203 WeakPolarHBondContact O-CG 3.28Å; I199-L203 PolarHBondContact O-N 3.45Å; I199-I235 HydrophobicContact CD1-CD1 3.6Å; I199-I235 HydrophobicContact CD1-CG1 3.87Å; I199-I235 HydrophobicContact CG1-CD1 3.84Å; I199-I235 HydrophobicContact CG1-CG1 3.77Å; I199-I235 HydrophobicContact CG1-CG2 4.09Å
200	N	87.9	Confident	81.5	Confident	68 Å²	68	72 Å²	72	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-59.5	-41.8	179.6	-70.7	-13.7	0	0	0	111.5	K196 G197 I198 L203 R204	K196-N200 VanDerWaalsContact O-CG 3.26Å; K196-N200 PolarHBondContact O-N 3.4Å; G197-N200 PolarHBondContact O-N 2.97Å; I198-N200 VanDerWaalsContact C-N 3.33Å; I198-N200 PolarHBondContact O-N 2.78Å; N200-L203 PolarHBondContact O-N 3.34Å; N200-R204 WeakPolarHBondContact O-CG 3.4Å; N200-R204 PolarHBondContact O-N 3.15Å
201	S	85.3	Confident	80.9	Confident	11 Å²	11	73.6 Å²	73.6	8%	0.077	36%	0.358	C	S	.	.	H	α-helix	trans	-63.5	-41.3	176.6	-66.9	0	0	0	0	112.4	F145 D146 S147 G197 I198 I199	F145-S201 PolarHBondContact O-OG 3.01Å; D146-S201 PolarHBondContact O-OG 3.43Å; S147-S201 WeakPolarHBondContact CA-OG 3.23Å; G197-S201 WeakPolarHBondContact O-CB 3.35Å; G197-S201 PolarHBondContact O-N 3Å; G197-S201 PolarHBondContact O-OG 2.87Å; I198-S201 WeakPolarHBondContact O-CB 3.48Å; I198-S201 PolarHBondContact O-N 3.38Å; I199-S201 VanDerWaalsContact C-N 3.29Å; I199-S201 PolarHBondContact O-N 3.49Å
202	L	85	Confident	80.5	Confident	12 Å²	12	73.9 Å²	73.9	6%	0.063	36%	0.358	C	S	.	.	H	α-helix	trans	-75.6	-29.4	-179.6	-66.4	174.2	0	0	0	113.1	F148 I198 I199 Y218 I235 L239 Q242	F148-L202 HydrophobicContact CZ-CD2 4.44Å; I198-L202 HydrophobicContact CG2-CD1 3.72Å; I198-L202 HydrophobicContact CG2-CG 4.14Å; I198-L202 WeakPolarHBondContact O-CB 3.26Å; I198-L202 VanDerWaalsContact O-CG 3.26Å; I198-L202 WeakPolarHBondContact O-CG 3.39Å; I198-L202 PolarHBondContact O-N 2.96Å; I199-L202 PolarHBondContact O-N 3.12Å; L202-Y218 HydrophobicContact CD2-CE1 4.37Å; L202-I235 HydrophobicContact CD1-CG2 4.31Å; L202-L239 HydrophobicContact CD1-CB 4.07Å; L202-L239 HydrophobicContact CD2-CD1 3.97Å; L202-Q242 PolarHBondContact O-NE2 3.32Å
203	L	81.6	Confident	80.1	Confident	124 Å²	124	68.8 Å²	68.8	65%	0.649	34%	0.337	S	S	*	.	H	α-helix	trans	-80.3	-20.4	-178.5	-74.8	177.5	0	0	0	114.1	I199 N200 E205	I199-L203 HydrophobicContact CG2-CD1 3.5Å; I199-L203 VanDerWaalsContact CG2-CD1 3.5Å; I199-L203 HydrophobicContact CG2-CG 4.06Å; I199-L203 WeakPolarHBondContact O-CB 3.43Å; I199-L203 VanDerWaalsContact O-CG 3.29Å; I199-L203 WeakPolarHBondContact O-CG 3.28Å; I199-L203 PolarHBondContact O-N 3.45Å; N200-L203 PolarHBondContact O-N 3.34Å; L203-E205 PolarHBondContact O-N 2.88Å
204	R	74.4	Confident	79.8	Confident	146 Å²	146	68 Å²	68	55%	0.551	33%	0.333	S	S	*	.	S	Bend	trans	-60	114.3	176.8	-76.3	179.8	-168.4	-169.9	9.7	109.3	D146 N200 W206	D146-R204 IonicContact OD2-NH2 3.73Å; N200-R204 WeakPolarHBondContact O-CG 3.4Å; N200-R204 PolarHBondContact O-N 3.15Å; R204-W206 PolarHBondContact O-N 3.49Å
205	E	55	Low	79.6	Confident	158 Å²	158	68 Å²	68	74%	0.738	33%	0.333	S	S	*	.			trans	-60.6	110.5	176.4	-76	-170.4	166.9	0	0	110.1	L203 K207	L203-E205 PolarHBondContact O-N 2.88Å; E205-K207 VanDerWaalsContact OE2-CE 3.24Å; E205-K207 WeakPolarHBondContact OE2-CE 3.29Å; E205-K207 IonicContact OE2-NZ 2.7Å; E205-K207 PolarHBondContact OE2-NZ 3.21Å
206	W	60.6	Low	79.5	Confident	126 Å²	126	66.9 Å²	66.9	48%	0.477	33%	0.327	S	S	.	.			trans	-86.5	114.6	176	-166.5	-92.5	0	0	0	110.3	R204 G208 P209	R204-W206 PolarHBondContact O-N 3.49Å; W206-G208 PolarHBondContact NE1-O 3.1Å; W206-P209 PolarHBondContact NE1-O 3.22Å; W206-P209 VanDerWaalsContact NE1-O 3.13Å
207	K	54.4	Low	79.6	Confident	183 Å²	183	60.2 Å²	60.2	80%	0.796	30%	0.298	S	S	*	.			trans	-102.4	5.9	-178.4	-65.5	-177.7	179.2	174.8	0	114	E205	E205-K207 VanDerWaalsContact OE2-CE 3.24Å; E205-K207 WeakPolarHBondContact OE2-CE 3.29Å; E205-K207 IonicContact OE2-NZ 2.7Å; E205-K207 PolarHBondContact OE2-NZ 3.21Å
208	G	62.7	Low	79.8	Confident	40 Å²	40	59.8 Å²	59.8	41%	0.412	29%	0.294	S	S	.	.	S	Bend	trans	-115.3	178.4	-178.4	0	0	0	0	0	114.8	W206	W206-G208 PolarHBondContact NE1-O 3.1Å
209	P	64.1	Low	80	Confident	118 Å²	118	60.2 Å²	60.2	77%	0.766	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-63.8	143	167.9	27.9	-32.2	0	0	0	110.1	W206	W206-P209 PolarHBondContact NE1-O 3.22Å; W206-P209 VanDerWaalsContact NE1-O 3.13Å
210	R	72.3	Confident	80.3	Confident	85 Å²	85	57.4 Å²	57.4	32%	0.321	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-68.9	133.8	175.1	-68.6	-76.2	-171.8	-179.8	0.8	109.5	D214 Y218 L246	R210-D214 WeakPolarHBondContact CA-OD2 3.48Å; R210-Y218 PolarHBondContact NH1-OH 2.98Å; R210-Y218 PolarHBondContact NH2-OH 3.46Å; R210-L246 HydrophobicContact CG-CD2 4.46Å
211	T	83.1	Confident	80.7	Confident	36 Å²	36	54.1 Å²	54.1	22%	0.221	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-89.2	165.8	174.5	66.9	0	0	0	0	111	D213 D214 L215	T211-D213 PolarHBondContact O-N 2.87Å; T211-D213 PolarHBondContact OG1-N 2.71Å; T211-D214 PolarHBondContact N-OD2 3.03Å; T211-D214 WeakPolarHBondContact O-CB 3.47Å; T211-D214 PolarHBondContact O-N 3.09Å; T211-D214 VanDerWaalsContact OG1-CG 3.24Å; T211-D214 PolarHBondContact OG1-N 3.3Å; T211-D214 PolarHBondContact OG1-OD2 3.17Å; T211-D214 VanDerWaalsContact OG1-OD2 3.11Å; T211-L215 PolarHBondContact O-N 2.98Å
212	K	85.5	Confident	81.2	Confident	49 Å²	49	54 Å²	54	21%	0.213	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-24.5	172.3	-63.1	-57.6	178	-170.3	0	112.6	D214 L215 R216 D250	K212-D214 VanDerWaalsContact C-N 3.33Å; K212-L215 HydrophobicContact CD-CD1 3.65Å; K212-L215 WeakPolarHBondContact O-CB 3.23Å; K212-L215 PolarHBondContact O-N 3.39Å; K212-R216 WeakPolarHBondContact O-CG 3.45Å; K212-R216 PolarHBondContact O-N 3.21Å; K212-R216 VanDerWaalsContact O-N 3.15Å; K212-D250 IonicContact NZ-OD1 3.25Å; K212-D250 PolarHBondContact NZ-OD1 2.65Å
213	D	85	Confident	81.7	Confident	30 Å²	30	53.5 Å²	53.5	16%	0.16	26%	0.259	C	S	.	.	H	α-helix	trans	-67.8	-33.5	171.6	-69	-49.7	0	0	0	111.6	N152 K156 T211 L215 R216 A217	N152-D213 PolarHBondContact ND2-O 2.98Å; N152-D213 PolarHBondContact OD1-O 2.65Å; K156-D213 IonicContact NZ-OD1 2.72Å; K156-D213 PolarHBondContact NZ-OD1 3.39Å; T211-D213 PolarHBondContact O-N 2.87Å; T211-D213 PolarHBondContact OG1-N 2.71Å; D213-L215 VanDerWaalsContact C-N 3.31Å; D213-L215 PolarHBondContact O-N 3.31Å; D213-R216 WeakPolarHBondContact O-CB 3.48Å; D213-R216 PolarHBondContact O-N 2.88Å; D213-R216 IonicContact OD1-CZ 2.62Å; D213-R216 IonicContact OD1-NH1 3.55Å; D213-R216 PolarHBondContact OD1-NH1 3.24Å; D213-R216 IonicContact OD2-NH1 3.75Å; D213-A217 PolarHBondContact O-N 2.88Å
214	D	87.7	Confident	82.4	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-40.9	171.6	-60.2	-40.6	0	0	0	111.6	F148 R210 T211 K212 R216 A217 Y218	F148-D214 HydrophobicContact CD2-CB 4.16Å; F148-D214 HydrophobicContact CE2-CB 4.41Å; R210-D214 WeakPolarHBondContact CA-OD2 3.48Å; T211-D214 PolarHBondContact N-OD2 3.03Å; T211-D214 WeakPolarHBondContact O-CB 3.47Å; T211-D214 PolarHBondContact O-N 3.09Å; T211-D214 VanDerWaalsContact OG1-CG 3.24Å; T211-D214 PolarHBondContact OG1-N 3.3Å; T211-D214 PolarHBondContact OG1-OD2 3.17Å; T211-D214 VanDerWaalsContact OG1-OD2 3.11Å; K212-D214 VanDerWaalsContact C-N 3.33Å; D214-R216 VanDerWaalsContact C-N 3.32Å; D214-R216 PolarHBondContact O-N 3.43Å; D214-A217 WeakPolarHBondContact O-CB 3.34Å; D214-A217 PolarHBondContact O-N 3.34Å; D214-Y218 HydrophobicContact CB-CE2 4.43Å; D214-Y218 WeakPolarHBondContact O-CD2 3.48Å; D214-Y218 PolarHBondContact O-N 2.97Å
215	L	90.5	Very high	83.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-38.9	176.8	-58.6	-175.6	0	0	0	112.1	T211 K212 D213 A217 Y218 F219 L246 D250 F253 W257	T211-L215 PolarHBondContact O-N 2.98Å; K212-L215 HydrophobicContact CD-CD1 3.65Å; K212-L215 WeakPolarHBondContact O-CB 3.23Å; K212-L215 PolarHBondContact O-N 3.39Å; D213-L215 VanDerWaalsContact C-N 3.31Å; D213-L215 PolarHBondContact O-N 3.31Å; L215-A217 VanDerWaalsContact C-N 3.33Å; L215-Y218 PolarHBondContact O-N 3.22Å; L215-F219 WeakPolarHBondContact O-CB 3.46Å; L215-F219 PolarHBondContact O-N 3.25Å; L215-L246 HydrophobicContact CD2-CD1 3.78Å; L215-L246 HydrophobicContact CD2-CD2 4.01Å; L215-L246 HydrophobicContact CD2-CG 4.48Å; L215-D250 HydrophobicContact CD1-CB 3.8Å; L215-D250 WeakPolarHBondContact CD1-OD1 3.41Å; L215-D250 HydrophobicContact CD2-CB 3.73Å; L215-D250 HydrophobicContact CG-CB 4.4Å; L215-F253 HydrophobicContact CD1-CB 4.18Å; L215-W257 HydrophobicContact CB-CH2 3.9Å; L215-W257 HydrophobicContact CB-CZ3 3.56Å; L215-W257 HydrophobicContact CD1-CH2 4.42Å
216	R	92.1	Very high	85.3	Confident	1 Å²	1	34.3 Å²	34.3	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-41.7	174.6	-68.9	175.1	-172.3	100.4	12.9	110.8	N152 F163 S169 V171 K212 D213 D214 F219 V220 W257	N152-R216 VanDerWaalsContact OD1-CB 3.23Å; N152-R216 WeakPolarHBondContact OD1-CB 3.33Å; N152-R216 WeakPolarHBondContact OD1-CD 3.47Å; F163-R216 PolarHBondContact O-NH2 3.33Å; S169-R216 VanDerWaalsContact O-CD 3.29Å; S169-R216 WeakPolarHBondContact O-CD 3.47Å; S169-R216 PolarHBondContact O-NE 2.89Å; V171-R216 HydrophobicContact CG2-CB 3.94Å; V171-R216 HydrophobicContact CG2-CG 3.94Å; K212-R216 WeakPolarHBondContact O-CG 3.45Å; K212-R216 PolarHBondContact O-N 3.21Å; K212-R216 VanDerWaalsContact O-N 3.15Å; D213-R216 WeakPolarHBondContact O-CB 3.48Å; D213-R216 PolarHBondContact O-N 2.88Å; D213-R216 IonicContact OD1-CZ 2.62Å; D213-R216 IonicContact OD1-NH1 3.55Å; D213-R216 PolarHBondContact OD1-NH1 3.24Å; D213-R216 IonicContact OD2-NH1 3.75Å; D214-R216 VanDerWaalsContact C-N 3.32Å; D214-R216 PolarHBondContact O-N 3.43Å; R216-F219 WeakPolarHBondContact O-CB 3.07Å; R216-F219 PolarHBondContact O-N 3.15Å; R216-V220 WeakPolarHBondContact O-CG2 3.33Å; R216-V220 PolarHBondContact O-N 3.37Å; R216-W257 HydrophobicContact CG-CH2 4.05Å; R216-W257 HydrophobicContact CG-CZ3 4.09Å
217	A	93.3	Very high	86.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-46.2	174.9	0	0	0	0	0	111.2	F148 I151 D213 D214 L215 F219 V220 L221	F148-A217 HydrophobicContact CB-CB 3.81Å; F148-A217 HydrophobicContact CD1-CB 3.8Å; F148-A217 HydrophobicContact CD2-CB 3.72Å; F148-A217 HydrophobicContact CE1-CB 4.28Å; F148-A217 HydrophobicContact CE2-CB 4.19Å; F148-A217 HydrophobicContact CG-CB 3.5Å; F148-A217 VanDerWaalsContact CG-CB 3.5Å; F148-A217 HydrophobicContact CZ-CB 4.46Å; I151-A217 HydrophobicContact CB-CB 4.46Å; I151-A217 HydrophobicContact CD1-CB 4.47Å; I151-A217 HydrophobicContact CG2-CB 4.19Å; D213-A217 PolarHBondContact O-N 2.88Å; D214-A217 WeakPolarHBondContact O-CB 3.34Å; D214-A217 PolarHBondContact O-N 3.34Å; L215-A217 VanDerWaalsContact C-N 3.33Å; A217-F219 PolarHBondContact O-N 3.42Å; A217-V220 PolarHBondContact O-N 3.18Å; A217-L221 WeakPolarHBondContact O-CB 3.24Å; A217-L221 VanDerWaalsContact O-CG 3.24Å; A217-L221 WeakPolarHBondContact O-CG 3.37Å; A217-L221 PolarHBondContact O-N 3.27Å
218	Y	94.7	Very high	88.8	Confident	1 Å²	1	23.2 Å²	23.2	0%	0.004	14%	0.139	C	C	.	.	H	α-helix	trans	-59.6	-43.6	173.3	-71.8	-57.3	0	0	0	113.4	F148 L202 R210 D214 L215 V220 L221 I222 L239 Q242 I243 L246	F148-Y218 HydrophobicContact CE2-CE1 4.07Å; F148-Y218 AromaticContact CE2-CE2 3.93Å; F148-Y218 HydrophobicContact CE2-CE2 3.93Å; F148-Y218 AromaticContact CE2-CZ 3.68Å; F148-Y218 HydrophobicContact CZ-CD1 4.27Å; F148-Y218 AromaticContact CZ-CE1 3.71Å; F148-Y218 HydrophobicContact CZ-CE1 3.71Å; F148-Y218 HydrophobicContact CZ-CE2 4.42Å; F148-Y218 AromaticContact CZ-CZ 3.79Å; L202-Y218 HydrophobicContact CD2-CE1 4.37Å; R210-Y218 PolarHBondContact NH1-OH 2.98Å; R210-Y218 PolarHBondContact NH2-OH 3.46Å; D214-Y218 HydrophobicContact CB-CE2 4.43Å; D214-Y218 WeakPolarHBondContact O-CD2 3.48Å; D214-Y218 PolarHBondContact O-N 2.97Å; L215-Y218 PolarHBondContact O-N 3.22Å; Y218-V220 VanDerWaalsContact C-N 3.27Å; Y218-V220 PolarHBondContact O-N 3.23Å; Y218-L221 PolarHBondContact O-N 3.49Å; Y218-I222 PolarHBondContact O-N 2.83Å; Y218-L239 HydrophobicContact CD1-CD1 3.66Å; Y218-L239 HydrophobicContact CE1-CD1 4.09Å; Y218-Q242 HydrophobicContact CE1-CB 3.86Å; Y218-Q242 PolarHBondContact OH-OE1 3.38Å; Y218-I243 HydrophobicContact CD1-CD1 4.37Å; Y218-I243 HydrophobicContact CD1-CG1 3.79Å; Y218-I243 HydrophobicContact CE1-CG1 4.5Å; Y218-I243 HydrophobicContact CG-CG1 4.04Å; Y218-L246 HydrophobicContact CD2-CD1 4.37Å; Y218-L246 HydrophobicContact CD2-CD2 4.49Å; Y218-L246 HydrophobicContact CE2-CD2 4.19Å
219	F	94.9	Very high	90.2	Very high	9 Å²	9	23.8 Å²	23.8	4%	0.039	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-33.9	177.1	176.4	-102.6	0	0	0	112.4	V171 L215 R216 A217 I222 Q223 L254 W257 L258 L261	V171-F219 HydrophobicContact CB-CD1 4.41Å; V171-F219 HydrophobicContact CB-CE1 4.37Å; V171-F219 HydrophobicContact CG1-CD1 4.39Å; V171-F219 HydrophobicContact CG1-CE1 4.34Å; V171-F219 HydrophobicContact CG2-CD1 4.3Å; L215-F219 WeakPolarHBondContact O-CB 3.46Å; L215-F219 PolarHBondContact O-N 3.25Å; R216-F219 WeakPolarHBondContact O-CB 3.07Å; R216-F219 PolarHBondContact O-N 3.15Å; A217-F219 PolarHBondContact O-N 3.42Å; F219-I222 WeakPolarHBondContact O-CG2 3.33Å; F219-Q223 WeakPolarHBondContact O-CG 3.41Å; F219-Q223 PolarHBondContact O-NE2 2.95Å; F219-L254 HydrophobicContact CB-CD2 4.15Å; F219-W257 HydrophobicContact CB-CE3 4.37Å; F219-W257 HydrophobicContact CD2-CB 4.09Å; F219-W257 HydrophobicContact CE2-CB 3.91Å; F219-W257 HydrophobicContact CG-CE3 4.49Å; F219-W257 HydrophobicContact CZ-CB 4.33Å; F219-L258 HydrophobicContact CD2-CD2 4.2Å; F219-L258 HydrophobicContact CE2-CD2 4.03Å; F219-L258 HydrophobicContact CE2-CG 4.41Å; F219-L261 HydrophobicContact CE2-CD1 4.4Å; F219-L261 HydrophobicContact CE2-CD2 4.2Å; F219-L261 HydrophobicContact CE2-CG 4.28Å; F219-L261 HydrophobicContact CZ-CD2 3.7Å; F219-L261 HydrophobicContact CZ-CG 4.18Å
220	V	95.6	Very high	91.5	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-75.3	-46.8	172.3	172.5	0	0	0	0	110.8	I151 F155 V171 V176 Y180 R216 A217 Y218 I222 Q223	I151-V220 HydrophobicContact CG2-CB 3.87Å; I151-V220 HydrophobicContact CG2-CG1 3.86Å; I151-V220 HydrophobicContact CG2-CG2 4.18Å; F155-V220 HydrophobicContact CB-CG2 4.22Å; F155-V220 HydrophobicContact CD2-CG1 3.7Å; F155-V220 HydrophobicContact CD2-CG2 4.23Å; F155-V220 HydrophobicContact CE2-CG1 3.75Å; F155-V220 HydrophobicContact CG-CG1 4.41Å; F155-V220 HydrophobicContact CG-CG2 4.4Å; V171-V220 HydrophobicContact CG1-CG2 3.89Å; V176-V220 HydrophobicContact CG1-CG1 4.37Å; V176-V220 HydrophobicContact CG2-CG1 4.47Å; V176-V220 HydrophobicContact CG2-CG2 4.07Å; Y180-V220 HydrophobicContact CE2-CG1 4.09Å; Y180-V220 WeakPolarHBondContact CE2-O 3.3Å; Y180-V220 PolarHBondContact OH-O 3.49Å; R216-V220 WeakPolarHBondContact O-CG2 3.33Å; R216-V220 PolarHBondContact O-N 3.37Å; A217-V220 PolarHBondContact O-N 3.18Å; Y218-V220 VanDerWaalsContact C-N 3.27Å; Y218-V220 PolarHBondContact O-N 3.23Å; V220-I222 PolarHBondContact O-N 3.44Å; V220-Q223 WeakPolarHBondContact O-CB 3.25Å; V220-Q223 PolarHBondContact O-N 2.92Å
221	L	96.1	Very high	92.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.8	-39	-173.6	-74.2	177.9	0	0	0	113.2	F145 F148 I151 I198 A217 Y218 Q223 N224 Y227 L239	F145-L221 HydrophobicContact CD1-CD2 4.05Å; F145-L221 HydrophobicContact CE1-CD2 4.14Å; F148-L221 HydrophobicContact CD1-CD1 4.35Å; F148-L221 HydrophobicContact CE1-CD1 3.58Å; F148-L221 HydrophobicContact CZ-CD1 4.18Å; I151-L221 HydrophobicContact CD1-CD1 4.08Å; I151-L221 HydrophobicContact CD1-CD2 3.7Å; I151-L221 HydrophobicContact CD1-CG 3.88Å; I198-L221 HydrophobicContact CD1-CD2 3.91Å; I198-L221 HydrophobicContact CG1-CD2 3.7Å; I198-L221 HydrophobicContact CG2-CD2 4.35Å; A217-L221 WeakPolarHBondContact O-CB 3.24Å; A217-L221 VanDerWaalsContact O-CG 3.24Å; A217-L221 WeakPolarHBondContact O-CG 3.37Å; A217-L221 PolarHBondContact O-N 3.27Å; Y218-L221 PolarHBondContact O-N 3.49Å; L221-Q223 PolarHBondContact O-N 3.37Å; L221-N224 WeakPolarHBondContact O-CB 3.26Å; L221-N224 PolarHBondContact O-N 3.04Å; L221-N224 VanDerWaalsContact O-N 3.13Å; L221-Y227 VanDerWaalsContact O-CE2 3.29Å; L221-Y227 WeakPolarHBondContact O-CE2 3.17Å; L221-L239 HydrophobicContact CB-CD1 4.01Å; L221-L239 HydrophobicContact CB-CD2 4.03Å; L221-L239 HydrophobicContact CD1-CD1 4.33Å
222	I	96.3	Very high	92.9	Very high	9 Å²	9	19.3 Å²	19.3	5%	0.046	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.1	179.2	-164.5	167.3	0	0	0	112.5	Y218 F219 V220 N224 I243 L269 V305 F309	Y218-I222 PolarHBondContact O-N 2.83Å; F219-I222 WeakPolarHBondContact O-CG2 3.33Å; V220-I222 PolarHBondContact O-N 3.44Å; I222-N224 VanDerWaalsContact C-N 3.33Å; I222-N224 PolarHBondContact O-N 2.69Å; I222-I243 HydrophobicContact CB-CD1 4.18Å; I222-I243 HydrophobicContact CD1-CD1 3.93Å; I222-I243 HydrophobicContact CG1-CD1 4.39Å; I222-L269 WeakPolarHBondContact O-CD2 3.45Å; I222-V305 HydrophobicContact CD1-CG1 3.55Å; I222-F309 HydrophobicContact CD1-CE2 3.78Å; I222-F309 HydrophobicContact CD1-CZ 4.07Å
223	Q	96.1	Very high	93.3	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-9.6	-178.3	-58.3	-176.4	56.7	0	0	114.3	Y180 F219 V220 L221 P225 L269 R272	Y180-Q223 HydrophobicContact CD2-CB 4.05Å; Y180-Q223 HydrophobicContact CE2-CB 3.85Å; F219-Q223 WeakPolarHBondContact O-CG 3.41Å; F219-Q223 PolarHBondContact O-NE2 2.95Å; V220-Q223 WeakPolarHBondContact O-CB 3.25Å; V220-Q223 PolarHBondContact O-N 2.92Å; L221-Q223 PolarHBondContact O-N 3.37Å; Q223-P225 WeakPolarHBondContact O-CD 3.23Å; Q223-L269 HydrophobicContact CB-CD2 4.47Å; Q223-L269 HydrophobicContact CG-CD1 4.01Å; Q223-R272 PolarHBondContact O-NH1 2.87Å
224	N	95.9	Very high	93.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.122	C	C	.	.			trans	-58.8	119.8	-174.6	-177.2	-12.8	0	0	0	112.4	Y180 I198 L221 I222 Q226 Y227 R272	Y180-N224 HydrophobicContact CD1-CB 4.28Å; Y180-N224 HydrophobicContact CE1-CB 3.63Å; I198-N224 WeakPolarHBondContact CD1-ND2 3.48Å; L221-N224 WeakPolarHBondContact O-CB 3.26Å; L221-N224 PolarHBondContact O-N 3.04Å; L221-N224 VanDerWaalsContact O-N 3.13Å; I222-N224 VanDerWaalsContact C-N 3.33Å; I222-N224 PolarHBondContact O-N 2.69Å; N224-Q226 VanDerWaalsContact C-N 3.26Å; N224-Q226 PolarHBondContact ND2-OE1 3.18Å; N224-Q226 PolarHBondContact O-N 3.05Å; N224-Q226 WeakPolarHBondContact OD1-CB 3.24Å; N224-Q226 VanDerWaalsContact OD1-CG 3.27Å; N224-Q226 WeakPolarHBondContact OD1-CG 3.34Å; N224-Q226 PolarHBondContact OD1-N 2.79Å; N224-Q226 PolarHBondContact OD1-OE1 3.08Å; N224-Y227 HydrophobicContact CB-CD2 4.01Å; N224-Y227 HydrophobicContact CB-CE2 3.67Å; N224-Y227 VanDerWaalsContact O-CD2 3.3Å; N224-Y227 WeakPolarHBondContact O-CD2 3.41Å; N224-Y227 PolarHBondContact O-N 3.41Å; N224-R272 PolarHBondContact O-NH1 2.69Å
225	P	95.3	Very high	94.1	Very high	13 Å²	13	19.5 Å²	19.5	8%	0.084	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-69.6	-16.9	-176.5	28.6	-35.5	0	0	0	115.1	Y180 L184 Q223 Y227 S228	Y180-P225 WeakPolarHBondContact O-CG 3.22Å; L184-P225 HydrophobicContact CD1-CB 4.02Å; L184-P225 HydrophobicContact CD1-CG 4.42Å; L184-P225 HydrophobicContact CD2-CB 4.42Å; L184-P225 HydrophobicContact CD2-CG 4.36Å; L184-P225 HydrophobicContact CG-CB 4.18Å; L184-P225 HydrophobicContact CG-CG 4.07Å; Q223-P225 WeakPolarHBondContact O-CD 3.23Å; P225-Y227 PolarHBondContact O-N 2.87Å; P225-S228 PolarHBondContact O-N 3.39Å
226	Q	94.9	Very high	94.4	Very high	11 Å²	11	19.6 Å²	19.6	5%	0.051	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-62.7	-23.8	178.7	-62.1	179.1	-67.9	0	0	112.9	L183 L184 Q191 L195 N224 S228 S229 T232	L183-Q226 HydrophobicContact CD2-CG 3.91Å; L183-Q226 HydrophobicContact CG-CG 4.42Å; L184-Q226 HydrophobicContact CD2-CG 4.31Å; Q191-Q226 VanDerWaalsContact C-NE2 3.28Å; Q191-Q226 VanDerWaalsContact CA-NE2 3.33Å; Q191-Q226 VanDerWaalsContact CB-NE2 3.3Å; Q191-Q226 PolarHBondContact O-NE2 3.19Å; L195-Q226 HydrophobicContact CD2-CB 4.09Å; N224-Q226 VanDerWaalsContact C-N 3.26Å; N224-Q226 PolarHBondContact ND2-OE1 3.18Å; N224-Q226 PolarHBondContact O-N 3.05Å; N224-Q226 WeakPolarHBondContact OD1-CB 3.24Å; N224-Q226 VanDerWaalsContact OD1-CG 3.27Å; N224-Q226 WeakPolarHBondContact OD1-CG 3.34Å; N224-Q226 PolarHBondContact OD1-N 2.79Å; N224-Q226 PolarHBondContact OD1-OE1 3.08Å; Q226-S228 PolarHBondContact O-N 3.44Å; Q226-S229 PolarHBondContact O-N 3.44Å; Q226-S229 VanDerWaalsContact O-N 3.11Å; Q226-T232 HydrophobicContact CB-CG2 4.47Å; Q226-T232 WeakPolarHBondContact O-CG2 3.24Å; Q226-T232 PolarHBondContact O-OG1 2.9Å
227	Y	95.6	Very high	94.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-65.9	-3.1	177.1	-61.4	-30.7	0	0	0	114.8	L195 L221 N224 P225 T232 Y233 I235 F236 L239	L195-Y227 HydrophobicContact CD2-CE1 4.39Å; L221-Y227 VanDerWaalsContact O-CE2 3.29Å; L221-Y227 WeakPolarHBondContact O-CE2 3.17Å; N224-Y227 HydrophobicContact CB-CD2 4.01Å; N224-Y227 HydrophobicContact CB-CE2 3.67Å; N224-Y227 VanDerWaalsContact O-CD2 3.3Å; N224-Y227 WeakPolarHBondContact O-CD2 3.41Å; N224-Y227 PolarHBondContact O-N 3.41Å; P225-Y227 PolarHBondContact O-N 2.87Å; Y227-T232 VanDerWaalsContact CA-OG1 3.31Å; Y227-T232 WeakPolarHBondContact CA-OG1 3.19Å; Y227-Y233 WeakPolarHBondContact O-CE1 3.4Å; Y227-I235 HydrophobicContact CE1-CB 4.48Å; Y227-I235 HydrophobicContact CE1-CG2 4.17Å; Y227-F236 HydrophobicContact CD1-CB 3.71Å; Y227-F236 HydrophobicContact CD1-CD2 4.16Å; Y227-F236 HydrophobicContact CD1-CG 4.1Å; Y227-F236 HydrophobicContact CD2-CB 4.48Å; Y227-F236 AromaticContact CD2-CD2 3.36Å; Y227-F236 HydrophobicContact CD2-CD2 3.36Å; Y227-F236 AromaticContact CD2-CE2 3.7Å; Y227-F236 HydrophobicContact CD2-CE2 3.7Å; Y227-F236 HydrophobicContact CD2-CG 4.03Å; Y227-F236 HydrophobicContact CE1-CB 4.2Å; Y227-F236 AromaticContact CE2-CD2 3.77Å; Y227-F236 HydrophobicContact CE2-CD2 3.77Å; Y227-F236 HydrophobicContact CE2-CE2 4.25Å; Y227-F236 HydrophobicContact CG-CB 3.89Å; Y227-F236 HydrophobicContact CG-CD1 4.44Å; Y227-F236 AromaticContact CG-CD2 3.59Å; Y227-F236 HydrophobicContact CG-CD2 3.59Å; Y227-F236 HydrophobicContact CG-CE2 4.21Å; Y227-F236 AromaticContact CG-CG 3.74Å; Y227-F236 HydrophobicContact CG-CG 3.74Å; Y227-L239 HydrophobicContact CE2-CD2 3.62Å
228	S	93.2	Very high	94.6	Very high	77 Å²	77	22.5 Å²	22.5	54%	0.538	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-76.2	-11.5	169.8	-67.3	0	0	0	0	113.2	P225 Q226 R272	P225-S228 PolarHBondContact O-N 3.39Å; Q226-S228 PolarHBondContact O-N 3.44Å; S228-R272 PolarHBondContact OG-NE 3.37Å
229	S	91.8	Very high	94.7	Very high	52 Å²	52	22.5 Å²	22.5	36%	0.364	14%	0.139	S	C	.	.	S	Bend	trans	-97.3	134.2	177.5	179.4	0	0	0	0	112	Q226 S231 T232 Y233	Q226-S229 PolarHBondContact O-N 3.44Å; Q226-S229 VanDerWaalsContact O-N 3.11Å; S229-S231 PolarHBondContact O-N 3.24Å; S229-S231 PolarHBondContact OG-OG 2.85Å; S229-T232 PolarHBondContact O-N 3.15Å; S229-T232 PolarHBondContact O-OG1 2.89Å; S229-Y233 VanDerWaalsContact O-CD1 3.25Å; S229-Y233 WeakPolarHBondContact O-CD1 3.07Å; S229-Y233 WeakPolarHBondContact O-CE1 3.46Å
230	T	91.7	Very high	94.7	Very high	40 Å²	40	22 Å²	22	25%	0.245	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-54.8	-36.7	177.6	49.8	0	0	0	0	112.9	T232 Y233 T279 E288	T230-T232 PolarHBondContact O-N 3.42Å; T230-Y233 HydrophobicContact CG2-CD2 4.41Å; T230-Y233 HydrophobicContact CG2-CE2 3.9Å; T230-Y233 VanDerWaalsContact O-CB 3.29Å; T230-Y233 WeakPolarHBondContact O-CB 3.25Å; T230-Y233 PolarHBondContact O-N 3.06Å; T230-T279 HydrophobicContact CG2-CG2 3.93Å; T230-E288 WeakPolarHBondContact CB-OE1 3.27Å; T230-E288 PolarHBondContact OG1-OE1 3.43Å
231	S	91	Very high	94.7	Very high	99 Å²	99	27 Å²	27	69%	0.692	16%	0.156	S	C	*	.	G	3₁₀ helix	trans	-57.6	-19.2	176.5	61.3	0	0	0	0	114.6	S229	S229-S231 PolarHBondContact O-N 3.24Å; S229-S231 PolarHBondContact OG-OG 2.85Å
232	T	93.9	Very high	94.6	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.031	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-104.2	-2.6	-179	70.2	0	0	0	0	113.5	L195 Q226 Y227 S229 T230 V234 I235 F236	L195-T232 HydrophobicContact CD1-CG2 3.68Å; L195-T232 HydrophobicContact CD2-CG2 4.29Å; Q226-T232 HydrophobicContact CB-CG2 4.47Å; Q226-T232 WeakPolarHBondContact O-CG2 3.24Å; Q226-T232 PolarHBondContact O-OG1 2.9Å; Y227-T232 VanDerWaalsContact CA-OG1 3.31Å; Y227-T232 WeakPolarHBondContact CA-OG1 3.19Å; S229-T232 PolarHBondContact O-N 3.15Å; S229-T232 PolarHBondContact O-OG1 2.89Å; T230-T232 PolarHBondContact O-N 3.42Å; T232-V234 VanDerWaalsContact C-N 3.27Å; T232-V234 PolarHBondContact O-N 3.42Å; T232-I235 WeakPolarHBondContact O-CB 3.45Å; T232-I235 PolarHBondContact O-N 3.16Å; T232-F236 PolarHBondContact O-N 3.16Å
233	Y	94.7	Very high	94.5	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-29.8	-171.9	-80.6	8.5	0	0	0	114	Y227 S229 T230 I235 F236 A237 F276 T279 L289	Y227-Y233 WeakPolarHBondContact O-CE1 3.4Å; S229-Y233 VanDerWaalsContact O-CD1 3.25Å; S229-Y233 WeakPolarHBondContact O-CD1 3.07Å; S229-Y233 WeakPolarHBondContact O-CE1 3.46Å; T230-Y233 HydrophobicContact CG2-CD2 4.41Å; T230-Y233 HydrophobicContact CG2-CE2 3.9Å; T230-Y233 VanDerWaalsContact O-CB 3.29Å; T230-Y233 WeakPolarHBondContact O-CB 3.25Å; T230-Y233 PolarHBondContact O-N 3.06Å; Y233-I235 VanDerWaalsContact C-N 3.34Å; Y233-I235 PolarHBondContact O-N 2.78Å; Y233-F236 PolarHBondContact O-N 3.44Å; Y233-A237 VanDerWaalsContact O-CB 3.23Å; Y233-A237 WeakPolarHBondContact O-CB 3.31Å; Y233-A237 PolarHBondContact O-N 3.19Å; Y233-F276 AromaticContact CD1-CD2 3.8Å; Y233-F276 HydrophobicContact CD1-CD2 3.8Å; Y233-F276 HydrophobicContact CD1-CE2 4.28Å; Y233-F276 AromaticContact CD2-CD2 3.78Å; Y233-F276 HydrophobicContact CD2-CD2 3.78Å; Y233-F276 HydrophobicContact CD2-CE2 4.06Å; Y233-F276 HydrophobicContact CE1-CD2 4.08Å; Y233-F276 HydrophobicContact CE2-CD2 4.08Å; Y233-F276 AromaticContact CG-CD2 3.63Å; Y233-F276 HydrophobicContact CG-CD2 3.63Å; Y233-F276 AromaticContact CG-CE2 3.77Å; Y233-F276 HydrophobicContact CG-CE2 3.77Å; Y233-T279 HydrophobicContact CE2-CG2 3.79Å; Y233-T279 PolarHBondContact OH-OG1 3.07Å; Y233-L289 HydrophobicContact CD2-CD2 4.13Å
234	V	93.4	Very high	94.5	Very high	65 Å²	65	28.9 Å²	28.9	39%	0.394	17%	0.166	S	C	.	.	H	α-helix	trans	-61.2	-45.9	174.2	179	0	0	0	0	110.7	T232 A237 H238 P290 W298	T232-V234 VanDerWaalsContact C-N 3.27Å; T232-V234 PolarHBondContact O-N 3.42Å; V234-A237 PolarHBondContact O-N 3.32Å; V234-H238 PolarHBondContact O-CD2 3.26Å; V234-H238 PolarHBondContact O-N 3.45Å; V234-H238 VanDerWaalsContact O-N 3.16Å; V234-P290 HydrophobicContact CG2-CG 4.07Å; V234-W298 HydrophobicContact CB-CH2 4.36Å; V234-W298 HydrophobicContact CB-CZ2 4.33Å; V234-W298 HydrophobicContact CG2-CH2 3.78Å; V234-W298 HydrophobicContact CG2-CZ2 3.98Å
235	I	94.7	Very high	94.3	Very high	21 Å²	21	32.8 Å²	32.8	11%	0.108	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-46.8	178.5	-52.2	171.5	0	0	0	109.3	L195 I198 I199 L202 Y227 T232 Y233 A237 H238 L239	L195-I235 HydrophobicContact CB-CD1 3.88Å; L195-I235 HydrophobicContact CD1-CD1 4.37Å; L195-I235 HydrophobicContact CD2-CD1 3.98Å; L195-I235 HydrophobicContact CG-CD1 4.3Å; I198-I235 HydrophobicContact CG2-CG2 3.95Å; I199-I235 HydrophobicContact CD1-CD1 3.6Å; I199-I235 HydrophobicContact CD1-CG1 3.87Å; I199-I235 HydrophobicContact CG1-CD1 3.84Å; I199-I235 HydrophobicContact CG1-CG1 3.77Å; I199-I235 HydrophobicContact CG1-CG2 4.09Å; L202-I235 HydrophobicContact CD1-CG2 4.31Å; Y227-I235 HydrophobicContact CE1-CB 4.48Å; Y227-I235 HydrophobicContact CE1-CG2 4.17Å; T232-I235 WeakPolarHBondContact O-CB 3.45Å; T232-I235 PolarHBondContact O-N 3.16Å; Y233-I235 VanDerWaalsContact C-N 3.34Å; Y233-I235 PolarHBondContact O-N 2.78Å; I235-A237 VanDerWaalsContact C-N 3.35Å; I235-A237 PolarHBondContact O-N 2.97Å; I235-H238 PolarHBondContact O-N 2.85Å; I235-L239 PolarHBondContact O-N 2.9Å; I235-L239 VanDerWaalsContact O-N 3.08Å
236	F	96.7	Very high	94.1	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-44.2	179.5	-170.6	-145.5	0	0	0	111.7	Y227 T232 Y233 H238 L239 L240 R272 L273 F276	Y227-F236 HydrophobicContact CD1-CB 3.71Å; Y227-F236 HydrophobicContact CD1-CD2 4.16Å; Y227-F236 HydrophobicContact CD1-CG 4.1Å; Y227-F236 HydrophobicContact CD2-CB 4.48Å; Y227-F236 AromaticContact CD2-CD2 3.36Å; Y227-F236 HydrophobicContact CD2-CD2 3.36Å; Y227-F236 AromaticContact CD2-CE2 3.7Å; Y227-F236 HydrophobicContact CD2-CE2 3.7Å; Y227-F236 HydrophobicContact CD2-CG 4.03Å; Y227-F236 HydrophobicContact CE1-CB 4.2Å; Y227-F236 AromaticContact CE2-CD2 3.77Å; Y227-F236 HydrophobicContact CE2-CD2 3.77Å; Y227-F236 HydrophobicContact CE2-CE2 4.25Å; Y227-F236 HydrophobicContact CG-CB 3.89Å; Y227-F236 HydrophobicContact CG-CD1 4.44Å; Y227-F236 AromaticContact CG-CD2 3.59Å; Y227-F236 HydrophobicContact CG-CD2 3.59Å; Y227-F236 HydrophobicContact CG-CE2 4.21Å; Y227-F236 AromaticContact CG-CG 3.74Å; Y227-F236 HydrophobicContact CG-CG 3.74Å; T232-F236 PolarHBondContact O-N 3.16Å; Y233-F236 PolarHBondContact O-N 3.44Å; F236-H238 VanDerWaalsContact C-N 3.34Å; F236-H238 PolarHBondContact O-N 3.46Å; F236-L239 HydrophobicContact CD2-CD2 4.4Å; F236-L239 WeakPolarHBondContact O-CB 3.48Å; F236-L239 PolarHBondContact O-N 3.11Å; F236-L240 HydrophobicContact CD1-CD1 3.98Å; F236-L240 HydrophobicContact CD2-CD1 4.2Å; F236-L240 HydrophobicContact CD2-CD2 4.34Å; F236-L240 HydrophobicContact CD2-CG 4.01Å; F236-L240 HydrophobicContact CE1-CD1 3.83Å; F236-L240 HydrophobicContact CE2-CD1 4.05Å; F236-L240 HydrophobicContact CE2-CD2 3.7Å; F236-L240 HydrophobicContact CE2-CG 3.85Å; F236-L240 HydrophobicContact CG-CD1 4.16Å; F236-L240 HydrophobicContact CG-CG 4.42Å; F236-L240 HydrophobicContact CZ-CD1 3.86Å; F236-L240 HydrophobicContact CZ-CD2 3.9Å; F236-L240 HydrophobicContact CZ-CG 4.13Å; F236-L240 VanDerWaalsContact O-CG 3.26Å; F236-L240 WeakPolarHBondContact O-CG 3.41Å; F236-L240 PolarHBondContact O-N 3.12Å; F236-R272 HydrophobicContact CE1-CG 4.31Å; F236-L273 HydrophobicContact CE1-CD2 4.23Å; F236-L273 HydrophobicContact CZ-CD2 3.7Å; F236-L273 HydrophobicContact CZ-CG 4.35Å; F236-F276 HydrophobicContact CD1-CB 4.28Å; F236-F276 AromaticContact CD1-CD2 3.55Å; F236-F276 HydrophobicContact CD1-CD2 3.55Å; F236-F276 HydrophobicContact CD1-CE2 4.02Å; F236-F276 AromaticContact CD1-CG 3.95Å; F236-F276 HydrophobicContact CD1-CG 3.95Å; F236-F276 HydrophobicContact CE1-CB 4.01Å; F236-F276 HydrophobicContact CE1-CD2 4.13Å; F236-F276 HydrophobicContact CE1-CG 4.06Å
237	A	95.4	Very high	93.9	Very high	1 Å²	1	35 Å²	35	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-56	-47.9	176.1	0	0	0	0	0	111.3	Y233 V234 I235 L239 L240 R241 F276 W297 W298	Y233-A237 VanDerWaalsContact O-CB 3.23Å; Y233-A237 WeakPolarHBondContact O-CB 3.31Å; Y233-A237 PolarHBondContact O-N 3.19Å; V234-A237 PolarHBondContact O-N 3.32Å; I235-A237 VanDerWaalsContact C-N 3.35Å; I235-A237 PolarHBondContact O-N 2.97Å; A237-L239 VanDerWaalsContact C-N 3.34Å; A237-L239 PolarHBondContact O-N 3.22Å; A237-L240 PolarHBondContact O-N 2.76Å; A237-R241 PolarHBondContact O-N 3.25Å; A237-F276 HydrophobicContact CB-CE2 4.39Å; A237-F276 HydrophobicContact CB-CZ 3.87Å; A237-W297 HydrophobicContact CB-CH2 3.67Å; A237-W297 HydrophobicContact CB-CZ3 3.69Å; A237-W297 VanDerWaalsContact O-CZ3 3.28Å; A237-W297 WeakPolarHBondContact O-CZ3 3.3Å; A237-W298 HydrophobicContact CB-CD2 3.55Å; A237-W298 VanDerWaalsContact CB-CE2 3.42Å; A237-W298 HydrophobicContact CB-CE3 4.11Å; A237-W298 HydrophobicContact CB-CG 3.82Å; A237-W298 HydrophobicContact CB-CH2 4.42Å; A237-W298 HydrophobicContact CB-CZ2 3.89Å
238	H	94.4	Very high	93.6	Very high	62 Å²	62	38.6 Å²	38.6	29%	0.287	23%	0.231	S	C	.	.	H	α-helix	trans	-61.8	-39.9	178.7	-80.5	-68.1	0	0	0	113	V234 I235 F236 R241 Q242 W297	V234-H238 PolarHBondContact O-CD2 3.26Å; V234-H238 PolarHBondContact O-N 3.45Å; V234-H238 VanDerWaalsContact O-N 3.16Å; I235-H238 PolarHBondContact O-N 2.85Å; F236-H238 VanDerWaalsContact C-N 3.34Å; F236-H238 PolarHBondContact O-N 3.46Å; H238-R241 PolarHBondContact O-N 3.08Å; H238-Q242 WeakPolarHBondContact O-CG 3.42Å; H238-Q242 PolarHBondContact O-N 3.18Å; H238-Q242 VanDerWaalsContact O-N 3.15Å; H238-W297 AromaticContact CE1-CH2 3.95Å; H238-W297 AromaticContact CE1-CZ2 3.87Å; H238-W297 AromaticContact ND1-CH2 3.87Å
239	L	96.1	Very high	93.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-50.1	172	175.5	64.3	0	0	0	111.2	L202 Y218 L221 Y227 I235 F236 A237 R241 Q242 I243	L202-L239 HydrophobicContact CD1-CB 4.07Å; L202-L239 HydrophobicContact CD2-CD1 3.97Å; Y218-L239 HydrophobicContact CD1-CD1 3.66Å; Y218-L239 HydrophobicContact CE1-CD1 4.09Å; L221-L239 HydrophobicContact CB-CD1 4.01Å; L221-L239 HydrophobicContact CB-CD2 4.03Å; L221-L239 HydrophobicContact CD1-CD1 4.33Å; Y227-L239 HydrophobicContact CE2-CD2 3.62Å; I235-L239 PolarHBondContact O-N 2.9Å; I235-L239 VanDerWaalsContact O-N 3.08Å; F236-L239 HydrophobicContact CD2-CD2 4.4Å; F236-L239 WeakPolarHBondContact O-CB 3.48Å; F236-L239 PolarHBondContact O-N 3.11Å; A237-L239 VanDerWaalsContact C-N 3.34Å; A237-L239 PolarHBondContact O-N 3.22Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 2.94Å; L239-Q242 PolarHBondContact O-N 3.1Å; L239-Q242 VanDerWaalsContact O-N 3.12Å; L239-I243 HydrophobicContact CD1-CD1 4.02Å; L239-I243 HydrophobicContact CD1-CG1 4.36Å; L239-I243 HydrophobicContact CG-CD1 4.01Å; L239-I243 WeakPolarHBondContact O-CG1 3.37Å; L239-I243 PolarHBondContact O-N 3.08Å
240	L	96.9	Very high	93.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-38.7	179.6	-64.8	173	0	0	0	111.9	F236 A237 Q242 I243 A244 L273 F276 A302 V305	F236-L240 HydrophobicContact CD1-CD1 3.98Å; F236-L240 HydrophobicContact CD2-CD1 4.2Å; F236-L240 HydrophobicContact CD2-CD2 4.34Å; F236-L240 HydrophobicContact CD2-CG 4.01Å; F236-L240 HydrophobicContact CE1-CD1 3.83Å; F236-L240 HydrophobicContact CE2-CD1 4.05Å; F236-L240 HydrophobicContact CE2-CD2 3.7Å; F236-L240 HydrophobicContact CE2-CG 3.85Å; F236-L240 HydrophobicContact CG-CD1 4.16Å; F236-L240 HydrophobicContact CG-CG 4.42Å; F236-L240 HydrophobicContact CZ-CD1 3.86Å; F236-L240 HydrophobicContact CZ-CD2 3.9Å; F236-L240 HydrophobicContact CZ-CG 4.13Å; F236-L240 VanDerWaalsContact O-CG 3.26Å; F236-L240 WeakPolarHBondContact O-CG 3.41Å; F236-L240 PolarHBondContact O-N 3.12Å; A237-L240 PolarHBondContact O-N 2.76Å; L240-Q242 PolarHBondContact O-N 3.37Å; L240-I243 PolarHBondContact O-N 2.86Å; L240-A244 WeakPolarHBondContact O-CB 3.4Å; L240-A244 PolarHBondContact O-N 3Å; L240-L273 HydrophobicContact CD1-CD2 4.03Å; L240-L273 HydrophobicContact CD2-CD2 3.55Å; L240-L273 HydrophobicContact CG-CD2 4.46Å; L240-F276 HydrophobicContact CD1-CD1 4.19Å; L240-F276 HydrophobicContact CD1-CE1 4.06Å; L240-F276 HydrophobicContact CD1-CZ 4.4Å; L240-A302 HydrophobicContact CD1-CB 3.81Å; L240-V305 HydrophobicContact CB-CG2 4.26Å; L240-V305 HydrophobicContact CD2-CB 3.88Å; L240-V305 HydrophobicContact CD2-CG1 3.75Å; L240-V305 HydrophobicContact CD2-CG2 3.87Å; L240-V305 WeakPolarHBondContact O-CG2 3.5Å
241	R	94.5	Very high	93.5	Very high	104 Å²	104	34.3 Å²	34.3	39%	0.392	21%	0.205	S	C	.	.	H	α-helix	trans	-61.7	-42.9	175.7	-171.2	177.4	72.8	172.4	4	111.8	A237 H238 L239 A244 A245 W297	A237-R241 PolarHBondContact O-N 3.25Å; H238-R241 PolarHBondContact O-N 3.08Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 2.94Å; R241-A244 PolarHBondContact O-N 3.16Å; R241-A245 WeakPolarHBondContact O-CB 3.42Å; R241-A245 PolarHBondContact O-N 3.47Å; R241-A245 VanDerWaalsContact O-N 3.09Å; R241-W297 HydrophobicContact CB-CE3 3.87Å; R241-W297 HydrophobicContact CB-CH2 4.5Å; R241-W297 HydrophobicContact CB-CZ3 3.68Å; R241-W297 HydrophobicContact CG-CE3 4.01Å; R241-W297 HydrophobicContact CG-CZ3 4.23Å
242	Q	93.5	Very high	93.6	Very high	38 Å²	38	31.9 Å²	31.9	18%	0.178	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-42.3	178.2	-70.3	-174.3	-0.1	0	0	111.6	L202 Y218 H238 L239 L240 A245 L246	L202-Q242 PolarHBondContact O-NE2 3.32Å; Y218-Q242 HydrophobicContact CE1-CB 3.86Å; Y218-Q242 PolarHBondContact OH-OE1 3.38Å; H238-Q242 WeakPolarHBondContact O-CG 3.42Å; H238-Q242 PolarHBondContact O-N 3.18Å; H238-Q242 VanDerWaalsContact O-N 3.15Å; L239-Q242 PolarHBondContact O-N 3.1Å; L239-Q242 VanDerWaalsContact O-N 3.12Å; L240-Q242 PolarHBondContact O-N 3.37Å; Q242-A245 PolarHBondContact O-N 3.44Å; Q242-L246 PolarHBondContact O-N 3.4Å
243	I	95.1	Very high	93.5	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-43.7	175.8	-61.9	173.5	0	0	0	110.7	Y218 I222 L239 L240 A245 L246 H251 L254 V305 L308	Y218-I243 HydrophobicContact CD1-CD1 4.37Å; Y218-I243 HydrophobicContact CD1-CG1 3.79Å; Y218-I243 HydrophobicContact CE1-CG1 4.5Å; Y218-I243 HydrophobicContact CG-CG1 4.04Å; I222-I243 HydrophobicContact CB-CD1 4.18Å; I222-I243 HydrophobicContact CD1-CD1 3.93Å; I222-I243 HydrophobicContact CG1-CD1 4.39Å; L239-I243 HydrophobicContact CD1-CD1 4.02Å; L239-I243 HydrophobicContact CD1-CG1 4.36Å; L239-I243 HydrophobicContact CG-CD1 4.01Å; L239-I243 WeakPolarHBondContact O-CG1 3.37Å; L239-I243 PolarHBondContact O-N 3.08Å; L240-I243 PolarHBondContact O-N 2.86Å; I243-A245 PolarHBondContact O-N 3.03Å; I243-L246 HydrophobicContact CG2-CD1 4.3Å; I243-L246 WeakPolarHBondContact O-CB 3.42Å; I243-L246 WeakPolarHBondContact O-CG 3.39Å; I243-L246 PolarHBondContact O-N 3.11Å; I243-H251 PolarHBondContact O-NE2 3.01Å; I243-L254 HydrophobicContact CG2-CD1 3.99Å; I243-V305 HydrophobicContact CB-CG2 3.89Å; I243-V305 HydrophobicContact CG2-CG1 4.39Å; I243-V305 HydrophobicContact CG2-CG2 3.79Å; I243-L308 HydrophobicContact CG2-CD1 3.91Å
244	A	94.8	Very high	93.6	Very high	9 Å²	9	33.3 Å²	33.3	7%	0.074	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-28.7	178.1	0	0	0	0	0	113.2	L240 R241 K304 V305	L240-A244 WeakPolarHBondContact O-CB 3.4Å; L240-A244 PolarHBondContact O-N 3Å; R241-A244 PolarHBondContact O-N 3.16Å; A244-K304 HydrophobicContact CB-CB 4.22Å; A244-K304 HydrophobicContact CB-CD 4.06Å; A244-K304 HydrophobicContact CB-CG 4.38Å; A244-K304 WeakPolarHBondContact O-CD 3.26Å; A244-K304 VanDerWaalsContact O-CE 3.31Å; A244-K304 WeakPolarHBondContact O-CE 3.47Å; A244-K304 PolarHBondContact O-NZ 3.09Å; A244-V305 HydrophobicContact CB-CG2 4.31Å
245	A	92.4	Very high	93.7	Very high	82 Å²	82	30.2 Å²	30.2	68%	0.678	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-2.6	179.6	0	0	0	0	0	114.4	R241 Q242 I243	R241-A245 WeakPolarHBondContact O-CB 3.42Å; R241-A245 PolarHBondContact O-N 3.47Å; R241-A245 VanDerWaalsContact O-N 3.09Å; Q242-A245 PolarHBondContact O-N 3.44Å; I243-A245 PolarHBondContact O-N 3.03Å
246	L	91.4	Very high	93.6	Very high	13 Å²	13	31.3 Å²	31.3	7%	0.068	18%	0.175	C	C	.	.	S	Bend	trans	-63.6	160.3	175.1	-63.2	171.3	0	0	0	111.8	R210 L215 Y218 Q242 I243 D250 H251 L254	R210-L246 HydrophobicContact CG-CD2 4.46Å; L215-L246 HydrophobicContact CD2-CD1 3.78Å; L215-L246 HydrophobicContact CD2-CD2 4.01Å; L215-L246 HydrophobicContact CD2-CG 4.48Å; Y218-L246 HydrophobicContact CD2-CD1 4.37Å; Y218-L246 HydrophobicContact CD2-CD2 4.49Å; Y218-L246 HydrophobicContact CE2-CD2 4.19Å; Q242-L246 PolarHBondContact O-N 3.4Å; I243-L246 HydrophobicContact CG2-CD1 4.3Å; I243-L246 WeakPolarHBondContact O-CB 3.42Å; I243-L246 WeakPolarHBondContact O-CG 3.39Å; I243-L246 PolarHBondContact O-N 3.11Å; L246-D250 HydrophobicContact CB-CB 4.13Å; L246-H251 PolarHBondContact O-CE1 3.15Å; L246-L254 HydrophobicContact CD1-CD1 3.59Å
247	S	91.3	Very high	93.5	Very high	56 Å²	56	31.3 Å²	31.3	39%	0.392	17%	0.174	S	C	.	.			trans	-68.8	155.5	176.7	75.7	0	0	0	0	111.6	A249 D250 H251	S247-A249 PolarHBondContact O-N 3.29Å; S247-D250 PolarHBondContact O-N 3.44Å; S247-D250 PolarHBondContact OG-N 3.23Å; S247-D250 PolarHBondContact OG-OD2 2.72Å; S247-H251 PolarHBondContact O-N 2.85Å
248	E	89.2	Confident	93.5	Very high	76 Å²	76	31.5 Å²	31.5	36%	0.355	18%	0.175	S	C	.	.	H	α-helix	trans	-56.1	-36.8	174.7	-67.8	-72.8	137.8	0	0	111.9	D250 H251 H252	E248-D250 VanDerWaalsContact C-N 3.35Å; E248-D250 PolarHBondContact O-N 3.12Å; E248-H251 PolarHBondContact O-N 2.97Å; E248-H252 PolarHBondContact O-N 3.46Å
249	A	89.6	Confident	93.4	Very high	60 Å²	60	32.3 Å²	32.3	50%	0.496	18%	0.178	S	C	.	.	H	α-helix	trans	-62.8	-41.8	175.5	0	0	0	0	0	111.5	S247 H252 F253	S247-A249 PolarHBondContact O-N 3.29Å; A249-H252 WeakPolarHBondContact O-CB 3.48Å; A249-H252 PolarHBondContact O-N 3.23Å; A249-F253 VanDerWaalsContact O-CD2 3.27Å; A249-F253 WeakPolarHBondContact O-CD2 3.34Å; A249-F253 PolarHBondContact O-N 3.19Å
250	D	91.6	Very high	93.2	Very high	20 Å²	20	39.4 Å²	39.4	11%	0.107	21%	0.205	C	C	.	.	H	α-helix	trans	-73.1	-35.3	178.7	-64	-37.1	0	0	0	112.7	K212 L215 L246 S247 E248 H252 F253 L254	K212-D250 IonicContact NZ-OD1 3.25Å; K212-D250 PolarHBondContact NZ-OD1 2.65Å; L215-D250 HydrophobicContact CD1-CB 3.8Å; L215-D250 WeakPolarHBondContact CD1-OD1 3.41Å; L215-D250 HydrophobicContact CD2-CB 3.73Å; L215-D250 HydrophobicContact CG-CB 4.4Å; L246-D250 HydrophobicContact CB-CB 4.13Å; S247-D250 PolarHBondContact O-N 3.44Å; S247-D250 PolarHBondContact OG-N 3.23Å; S247-D250 PolarHBondContact OG-OD2 2.72Å; E248-D250 VanDerWaalsContact C-N 3.35Å; E248-D250 PolarHBondContact O-N 3.12Å; D250-H252 PolarHBondContact O-N 3Å; D250-F253 PolarHBondContact O-N 2.93Å; D250-L254 PolarHBondContact O-N 3.26Å
251	H	93.8	Very high	93	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-38.1	169.5	-72.4	151.2	0	0	0	111.5	L40 I243 L246 S247 E248 F253 L254 V255 L308	L40-H251 HydrophobicContact CD1-CB 3.81Å; L40-H251 WeakPolarHBondContact CD1-ND1 3.32Å; I243-H251 PolarHBondContact O-NE2 3.01Å; L246-H251 PolarHBondContact O-CE1 3.15Å; S247-H251 PolarHBondContact O-N 2.85Å; E248-H251 PolarHBondContact O-N 2.97Å; H251-F253 PolarHBondContact O-N 2.8Å; H251-L254 PolarHBondContact O-N 2.97Å; H251-V255 WeakPolarHBondContact O-CB 3.15Å; H251-V255 VanDerWaalsContact O-CG2 3.27Å; H251-V255 WeakPolarHBondContact O-CG2 3.28Å; H251-V255 PolarHBondContact O-N 3.22Å; H251-L308 HydrophobicContact CB-CD2 3.57Å
252	H	92	Very high	92.9	Very high	48 Å²	48	38.9 Å²	38.9	22%	0.222	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-43.9	174.8	-171	55.2	0	0	0	113	F43 E248 A249 D250 V255 H256	F43-H252 HydrophobicContact CE2-CB 3.95Å; F43-H252 AromaticContact CE2-ND1 3.8Å; F43-H252 HydrophobicContact CZ-CB 3.54Å; F43-H252 AromaticContact CZ-CG 3.76Å; F43-H252 AromaticContact CZ-ND1 3.35Å; F43-H252 VanDerWaalsContact CZ-ND1 3.35Å; F43-H252 WeakPolarHBondContact CZ-ND1 3.49Å; E248-H252 PolarHBondContact O-N 3.46Å; A249-H252 WeakPolarHBondContact O-CB 3.48Å; A249-H252 PolarHBondContact O-N 3.23Å; D250-H252 PolarHBondContact O-N 3Å; H252-V255 PolarHBondContact O-N 3.03Å; H252-H256 AromaticContact CE1-CD2 3.44Å; H252-H256 PolarHBondContact CE1-CD2 3.11Å; H252-H256 VanDerWaalsContact CE1-CD2 3.44Å; H252-H256 AromaticContact CE1-NE2 3.16Å; H252-H256 PolarHBondContact CE1-NE2 3.15Å; H252-H256 AromaticContact ND1-CD2 3.72Å; H252-H256 AromaticContact ND1-NE2 3.82Å; H252-H256 AromaticContact NE2-CD2 3.91Å; H252-H256 AromaticContact NE2-NE2 3.78Å; H252-H256 PolarHBondContact O-CD2 3.46Å; H252-H256 PolarHBondContact O-N 3.15Å
253	F	92.9	Very high	93	Very high	32 Å²	32	39.4 Å²	39.4	14%	0.14	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-48.6	173.6	-78.8	-92.4	0	0	0	111.4	N164 I166 L215 A249 D250 H251 V255 H256 W257	N164-F253 WeakPolarHBondContact O-CE1 3.29Å; I166-F253 HydrophobicContact CG2-CD1 3.81Å; I166-F253 HydrophobicContact CG2-CD2 4.38Å; I166-F253 HydrophobicContact CG2-CE1 3.73Å; I166-F253 HydrophobicContact CG2-CE2 4.29Å; I166-F253 HydrophobicContact CG2-CG 4.15Å; I166-F253 HydrophobicContact CG2-CZ 3.97Å; L215-F253 HydrophobicContact CD1-CB 4.18Å; A249-F253 VanDerWaalsContact O-CD2 3.27Å; A249-F253 WeakPolarHBondContact O-CD2 3.34Å; A249-F253 PolarHBondContact O-N 3.19Å; D250-F253 PolarHBondContact O-N 2.93Å; H251-F253 PolarHBondContact O-N 2.8Å; F253-V255 VanDerWaalsContact C-N 3.33Å; F253-V255 PolarHBondContact O-N 2.92Å; F253-H256 PolarHBondContact O-N 3.29Å; F253-W257 HydrophobicContact CB-CD2 4.47Å; F253-W257 HydrophobicContact CB-CH2 4.36Å; F253-W257 HydrophobicContact CB-CZ2 4.11Å; F253-W257 HydrophobicContact CD1-CH2 4.49Å; F253-W257 AromaticContact CD1-CZ2 3.71Å; F253-W257 HydrophobicContact CD1-CZ2 3.71Å; F253-W257 HydrophobicContact CG-CZ2 4.33Å; F253-W257 PolarHBondContact O-N 3.05Å
254	L	94.8	Very high	92.9	Very high	7 Å²	7	48 Å²	48	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-42.6	-179.9	-71	178.9	0	0	0	112.2	F219 I243 L246 D250 H251 H256 W257 L258 L308	F219-L254 HydrophobicContact CB-CD2 4.15Å; I243-L254 HydrophobicContact CG2-CD1 3.99Å; L246-L254 HydrophobicContact CD1-CD1 3.59Å; D250-L254 PolarHBondContact O-N 3.26Å; H251-L254 PolarHBondContact O-N 2.97Å; L254-H256 PolarHBondContact O-N 3.44Å; L254-W257 HydrophobicContact CD2-CE3 4.06Å; L254-W257 HydrophobicContact CD2-CZ3 4.37Å; L254-W257 PolarHBondContact O-N 2.96Å; L254-L258 VanDerWaalsContact O-CB 3.28Å; L254-L258 WeakPolarHBondContact O-CB 3.33Å; L254-L258 WeakPolarHBondContact O-CG 3.45Å; L254-L258 PolarHBondContact O-N 2.58Å; L254-L308 HydrophobicContact CD1-CD1 4.48Å
255	V	95.6	Very high	92.9	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.5	-47.4	177.4	165.8	0	0	0	0	111.4	F43 H251 H252 F253 K259 L308 A311 A312 V315	F43-V255 HydrophobicContact CE1-CG2 4.41Å; H251-V255 WeakPolarHBondContact O-CB 3.15Å; H251-V255 VanDerWaalsContact O-CG2 3.27Å; H251-V255 WeakPolarHBondContact O-CG2 3.28Å; H251-V255 PolarHBondContact O-N 3.22Å; H252-V255 PolarHBondContact O-N 3.03Å; F253-V255 VanDerWaalsContact C-N 3.33Å; F253-V255 PolarHBondContact O-N 2.92Å; V255-K259 PolarHBondContact O-N 3.36Å; V255-K259 VanDerWaalsContact O-N 3.11Å; V255-L308 HydrophobicContact CG2-CB 4.23Å; V255-L308 HydrophobicContact CG2-CD2 3.91Å; V255-A311 HydrophobicContact CG1-CB 4.02Å; V255-A311 HydrophobicContact CG2-CB 3.8Å; V255-A312 HydrophobicContact CG1-CB 4.25Å; V255-A312 VanDerWaalsContact O-CB 3.32Å; V255-A312 WeakPolarHBondContact O-CB 3.37Å; V255-V315 HydrophobicContact CG1-CG2 3.99Å
256	H	93.3	Very high	93.1	Very high	44 Å²	44	44.1 Å²	44.1	20%	0.204	22%	0.224	C	C	.	.	H	α-helix	trans	-69	-34.7	178.8	-81.9	-88.4	0	0	0	113.1	I166 H252 F253 L254	I166-H256 HydrophobicContact CB-CB 4.19Å; I166-H256 WeakPolarHBondContact O-CB 3.42Å; H252-H256 AromaticContact CE1-CD2 3.44Å; H252-H256 PolarHBondContact CE1-CD2 3.11Å; H252-H256 VanDerWaalsContact CE1-CD2 3.44Å; H252-H256 AromaticContact CE1-NE2 3.16Å; H252-H256 PolarHBondContact CE1-NE2 3.15Å; H252-H256 AromaticContact ND1-CD2 3.72Å; H252-H256 AromaticContact ND1-NE2 3.82Å; H252-H256 AromaticContact NE2-CD2 3.91Å; H252-H256 AromaticContact NE2-NE2 3.78Å; H252-H256 PolarHBondContact O-CD2 3.46Å; H252-H256 PolarHBondContact O-N 3.15Å; F253-H256 PolarHBondContact O-N 3.29Å; L254-H256 PolarHBondContact O-N 3.44Å
257	W	94.4	Very high	93.3	Very high	1 Å²	1	48 Å²	48	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-72.2	-40.2	176.1	-61.2	-13.9	0	0	0	112.5	T165 S169 L215 R216 F219 F253 L254 K259 R260	T165-W257 PolarHBondContact O-NE1 2.97Å; S169-W257 VanDerWaalsContact CB-CD2 3.45Å; L215-W257 HydrophobicContact CB-CH2 3.9Å; L215-W257 HydrophobicContact CB-CZ3 3.56Å; L215-W257 HydrophobicContact CD1-CH2 4.42Å; R216-W257 HydrophobicContact CG-CH2 4.05Å; R216-W257 HydrophobicContact CG-CZ3 4.09Å; F219-W257 HydrophobicContact CB-CE3 4.37Å; F219-W257 HydrophobicContact CD2-CB 4.09Å; F219-W257 HydrophobicContact CE2-CB 3.91Å; F219-W257 HydrophobicContact CG-CE3 4.49Å; F219-W257 HydrophobicContact CZ-CB 4.33Å; F253-W257 HydrophobicContact CB-CD2 4.47Å; F253-W257 HydrophobicContact CB-CH2 4.36Å; F253-W257 HydrophobicContact CB-CZ2 4.11Å; F253-W257 HydrophobicContact CD1-CH2 4.49Å; F253-W257 AromaticContact CD1-CZ2 3.71Å; F253-W257 HydrophobicContact CD1-CZ2 3.71Å; F253-W257 HydrophobicContact CG-CZ2 4.33Å; F253-W257 PolarHBondContact O-N 3.05Å; L254-W257 HydrophobicContact CD2-CE3 4.06Å; L254-W257 HydrophobicContact CD2-CZ3 4.37Å; L254-W257 PolarHBondContact O-N 2.96Å; W257-K259 VanDerWaalsContact C-N 3.27Å; W257-K259 PolarHBondContact O-N 2.92Å; W257-R260 PolarHBondContact O-N 2.88Å; W257-R260 VanDerWaalsContact O-N 3.09Å
258	L	95.5	Very high	93.6	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-37.2	174.3	-73.5	171.3	0	0	0	111.6	F219 L254 R260 L261 F266 L308 F309 A312	F219-L258 HydrophobicContact CD2-CD2 4.2Å; F219-L258 HydrophobicContact CE2-CD2 4.03Å; F219-L258 HydrophobicContact CE2-CG 4.41Å; L254-L258 VanDerWaalsContact O-CB 3.28Å; L254-L258 WeakPolarHBondContact O-CB 3.33Å; L254-L258 WeakPolarHBondContact O-CG 3.45Å; L254-L258 PolarHBondContact O-N 2.58Å; L258-R260 PolarHBondContact O-N 3.15Å; L258-R260 VanDerWaalsContact O-N 3.16Å; L258-L261 HydrophobicContact CD2-CD1 3.77Å; L258-L261 WeakPolarHBondContact O-CB 3.49Å; L258-L261 WeakPolarHBondContact O-CG 3.42Å; L258-L261 PolarHBondContact O-N 3.03Å; L258-L261 VanDerWaalsContact O-N 3.09Å; L258-F266 HydrophobicContact CB-CE2 4.42Å; L258-L308 HydrophobicContact CD1-CB 4.15Å; L258-F309 HydrophobicContact CD1-CD2 4.14Å; L258-F309 HydrophobicContact CD1-CE2 4.07Å; L258-F309 HydrophobicContact CD1-CG 4.39Å; L258-F309 HydrophobicContact CD1-CZ 4.27Å; L258-F309 HydrophobicContact CD2-CD1 4.44Å; L258-F309 HydrophobicContact CD2-CE1 3.74Å; L258-F309 HydrophobicContact CD2-CE2 4.21Å; L258-F309 HydrophobicContact CD2-CZ 3.6Å; L258-A312 HydrophobicContact CB-CB 3.85Å
259	K	93.6	Very high	94	Very high	80 Å²	80	44.7 Å²	44.7	35%	0.348	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.9	174.6	160.4	170.3	-179.3	-177	0	113.6	V255 W257 A312 V315 S316 I320	V255-K259 PolarHBondContact O-N 3.36Å; V255-K259 VanDerWaalsContact O-N 3.11Å; W257-K259 VanDerWaalsContact C-N 3.27Å; W257-K259 PolarHBondContact O-N 2.92Å; K259-A312 HydrophobicContact CB-CB 4.36Å; K259-V315 HydrophobicContact CD-CG2 4.01Å; K259-V315 PolarHBondContact NZ-O 3.17Å; K259-S316 VanDerWaalsContact CD-OG 3.23Å; K259-S316 WeakPolarHBondContact CD-OG 3.4Å; K259-S316 WeakPolarHBondContact CG-OG 3.35Å; K259-I320 HydrophobicContact CB-CD1 4.49Å
260	R	91.3	Very high	94.4	Very high	148 Å²	148	41.8 Å²	41.8	56%	0.558	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.4	-180	-62.8	-170.4	67.9	-174.9	-1.3	114	E167 D168 W257 L258	E167-R260 WeakPolarHBondContact O-CD 3.4Å; E167-R260 PolarHBondContact O-NH1 3.4Å; D168-R260 IonicContact OD1-NH1 2.78Å; D168-R260 IonicContact OD2-NH1 3.97Å; D168-R260 PolarHBondContact OD2-NH1 3.03Å; D168-R260 VanDerWaalsContact OD2-NH1 3.16Å; W257-R260 PolarHBondContact O-N 2.88Å; W257-R260 VanDerWaalsContact O-N 3.09Å; L258-R260 PolarHBondContact O-N 3.15Å; L258-R260 VanDerWaalsContact O-N 3.16Å
261	L	92.6	Very high	94.6	Very high	23 Å²	23	45.8 Å²	45.8	12%	0.12	21%	0.211	C	C	.	.	S	Bend	trans	-66.2	153.1	174.2	-66.5	176.2	0	0	0	110.8	F219 L258 F266 L269	F219-L261 HydrophobicContact CE2-CD1 4.4Å; F219-L261 HydrophobicContact CE2-CD2 4.2Å; F219-L261 HydrophobicContact CE2-CG 4.28Å; F219-L261 HydrophobicContact CZ-CD2 3.7Å; F219-L261 HydrophobicContact CZ-CG 4.18Å; L258-L261 HydrophobicContact CD2-CD1 3.77Å; L258-L261 WeakPolarHBondContact O-CB 3.49Å; L258-L261 WeakPolarHBondContact O-CG 3.42Å; L258-L261 PolarHBondContact O-N 3.03Å; L258-L261 VanDerWaalsContact O-N 3.09Å; L261-F266 HydrophobicContact CB-CB 4.32Å; L261-F266 HydrophobicContact CB-CD2 4.43Å; L261-F266 HydrophobicContact CD1-CD2 4.45Å; L261-L269 HydrophobicContact CD1-CD1 3.81Å
262	S	92.7	Very high	94.8	Very high	71 Å²	71	46.6 Å²	46.6	50%	0.497	21%	0.214	S	C	.	.			trans	-65.7	145.8	171.1	66.3	0	0	0	0	110.3	R264 R265 F266	S262-R264 PolarHBondContact O-N 3.49Å; S262-R264 VanDerWaalsContact O-N 3.16Å; S262-R265 PolarHBondContact O-N 2.79Å; S262-R265 WeakPolarHBondContact OG-CB 3.43Å; S262-R265 PolarHBondContact OG-N 2.85Å; S262-F266 WeakPolarHBondContact O-CB 3.41Å; S262-F266 PolarHBondContact O-N 3.4Å
263	A	94.4	Very high	95.1	Very high	49 Å²	49	44.4 Å²	44.4	41%	0.405	20%	0.204	S	C	.	.	H	α-helix	trans	-53.7	-39.2	-179.3	0	0	0	0	0	112.6	R267 I320	A263-R267 WeakPolarHBondContact O-CB 3.32Å; A263-R267 PolarHBondContact O-N 3.27Å; A263-I320 HydrophobicContact CB-CG2 4.1Å
264	R	94.3	Very high	95.3	Very high	183 Å²	183	43.7 Å²	43.7	69%	0.691	20%	0.201	S	C	*	.	H	α-helix	trans	-59	-51.2	174.4	-179.1	-179.2	175.3	-173.3	-0.6	112	S262 Q268	S262-R264 PolarHBondContact O-N 3.49Å; S262-R264 VanDerWaalsContact O-N 3.16Å; R264-Q268 WeakPolarHBondContact O-CG 3.45Å; R264-Q268 PolarHBondContact O-N 2.96Å; R264-Q268 VanDerWaalsContact O-N 3.12Å
265	R	93.7	Very high	95.4	Very high	10 Å²	10	48.5 Å²	48.5	4%	0.038	22%	0.224	C	C	.	.	H	α-helix	trans	-67.2	-42.5	-177.9	-171.1	61.4	146.8	-151.9	-8.1	110.8	D181 S262 R267 Q268 L269	D181-R265 IonicContact OD1-CZ 3.27Å; D181-R265 IonicContact OD1-NH1 3.02Å; D181-R265 PolarHBondContact OD1-NH1 3.44Å; D181-R265 IonicContact OD1-NH2 3.52Å; S262-R265 PolarHBondContact O-N 2.79Å; S262-R265 WeakPolarHBondContact OG-CB 3.43Å; S262-R265 PolarHBondContact OG-N 2.85Å; R265-R267 PolarHBondContact O-N 2.87Å; R265-Q268 PolarHBondContact O-N 3.35Å; R265-L269 HydrophobicContact CG-CD1 4.38Å; R265-L269 VanDerWaalsContact O-CG 3.28Å; R265-L269 WeakPolarHBondContact O-CG 3.39Å; R265-L269 PolarHBondContact O-N 3.13Å
266	F	96.8	Very high	95.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.1	-48.7	177.7	-170.4	-83.8	0	0	0	111.4	L258 L261 S262 Q268 L269 V270 F309 A312 N313 I320 M321 F326	L258-F266 HydrophobicContact CB-CE2 4.42Å; L261-F266 HydrophobicContact CB-CB 4.32Å; L261-F266 HydrophobicContact CB-CD2 4.43Å; L261-F266 HydrophobicContact CD1-CD2 4.45Å; S262-F266 WeakPolarHBondContact O-CB 3.41Å; S262-F266 PolarHBondContact O-N 3.4Å; F266-Q268 PolarHBondContact O-N 3.35Å; F266-L269 PolarHBondContact O-N 3.17Å; F266-V270 HydrophobicContact CD1-CG2 4.15Å; F266-V270 HydrophobicContact CE1-CG2 3.91Å; F266-V270 PolarHBondContact O-N 2.9Å; F266-V270 VanDerWaalsContact O-N 3.1Å; F266-F309 HydrophobicContact CD2-CD1 4.02Å; F266-F309 HydrophobicContact CD2-CE1 4.41Å; F266-F309 HydrophobicContact CE1-CB 4.49Å; F266-F309 HydrophobicContact CE1-CD1 4.26Å; F266-F309 HydrophobicContact CE2-CB 4.46Å; F266-F309 AromaticContact CE2-CD1 3.66Å; F266-F309 HydrophobicContact CE2-CD1 3.66Å; F266-F309 HydrophobicContact CE2-CE1 4.41Å; F266-F309 HydrophobicContact CE2-CG 4.46Å; F266-F309 HydrophobicContact CG-CD1 4.46Å; F266-F309 HydrophobicContact CZ-CB 3.93Å; F266-F309 AromaticContact CZ-CD1 3.8Å; F266-F309 HydrophobicContact CZ-CD1 3.8Å; F266-F309 HydrophobicContact CZ-CG 4.35Å; F266-F309 WeakPolarHBondContact CZ-O 3.49Å; F266-A312 HydrophobicContact CE2-CB 3.96Å; F266-A312 HydrophobicContact CZ-CB 4.28Å; F266-N313 HydrophobicContact CE1-CB 4.39Å; F266-N313 HydrophobicContact CZ-CB 4.21Å; F266-I320 HydrophobicContact CB-CG2 3.97Å; F266-I320 HydrophobicContact CD1-CB 4.37Å; F266-I320 HydrophobicContact CD1-CG2 3.91Å; F266-I320 HydrophobicContact CD2-CD1 3.85Å; F266-I320 HydrophobicContact CD2-CG2 4.43Å; F266-I320 HydrophobicContact CE1-CB 4.49Å; F266-I320 HydrophobicContact CE1-CD1 4.43Å; F266-I320 HydrophobicContact CE1-CG2 4.5Å; F266-I320 HydrophobicContact CE2-CD1 3.67Å; F266-I320 HydrophobicContact CG-CD1 4.3Å; F266-I320 HydrophobicContact CG-CG2 3.86Å; F266-I320 HydrophobicContact CZ-CD1 3.97Å; F266-M321 HydrophobicContact CD1-CG 4.34Å; F266-M321 HydrophobicContact CD1-SD 3.49Å; F266-M321 WeakPolarHBondContact CD1-SD 3.27Å; F266-M321 HydrophobicContact CE1-CG 4.21Å; F266-M321 HydrophobicContact CE1-SD 3.59Å; F266-M321 VanDerWaalsContact CE1-SD 3.59Å; F266-F326 AromaticContact CE1-CZ 3.9Å; F266-F326 HydrophobicContact CE1-CZ 3.9Å; F266-F326 HydrophobicContact CZ-CZ 4.31Å
267	R	96.9	Very high	95.7	Very high	94 Å²	94	46.4 Å²	46.4	36%	0.355	21%	0.214	S	C	.	.	H	α-helix	trans	-59.1	-47.1	176.1	-178.8	179.2	-70	134.1	0.1	112.5	A263 R265 L269 V270 E271 M321 D325	A263-R267 WeakPolarHBondContact O-CB 3.32Å; A263-R267 PolarHBondContact O-N 3.27Å; R265-R267 PolarHBondContact O-N 2.87Å; R267-L269 PolarHBondContact O-N 3.21Å; R267-V270 PolarHBondContact O-N 3.33Å; R267-V270 VanDerWaalsContact O-N 3.15Å; R267-E271 WeakPolarHBondContact CD-OE1 3.43Å; R267-E271 HydrophobicContact CG-CG 4.24Å; R267-E271 VanDerWaalsContact CG-OE1 3.26Å; R267-E271 WeakPolarHBondContact CG-OE1 3.43Å; R267-E271 WeakPolarHBondContact O-CG 3.38Å; R267-E271 PolarHBondContact O-N 2.99Å; R267-M321 HydrophobicContact CB-CE 4.27Å; R267-M321 HydrophobicContact CB-SD 4.39Å; R267-M321 HydrophobicContact CG-CE 4.02Å; R267-D325 IonicContact CZ-OD2 2.62Å; R267-D325 IonicContact NE-OD2 3.42Å; R267-D325 PolarHBondContact NE-OD2 3.21Å; R267-D325 IonicContact NH2-OD2 3.88Å
268	Q	95.9	Very high	95.7	Very high	60 Å²	60	47 Å²	47	28%	0.28	22%	0.218	S	C	.	.	H	α-helix	trans	-57.3	-34.7	178	-74	174.2	-21.6	0	0	113.2	R264 R265 F266 R272	R264-Q268 WeakPolarHBondContact O-CG 3.45Å; R264-Q268 PolarHBondContact O-N 2.96Å; R264-Q268 VanDerWaalsContact O-N 3.12Å; R265-Q268 PolarHBondContact O-N 3.35Å; F266-Q268 PolarHBondContact O-N 3.35Å; Q268-R272 WeakPolarHBondContact O-CB 3.44Å; Q268-R272 PolarHBondContact O-N 3.01Å; Q268-R272 VanDerWaalsContact O-N 3.09Å
269	L	97.5	Very high	95.7	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-75.7	-39.5	178.6	-62.5	170.8	0	0	0	112	I222 Q223 L261 R265 F266 R267 R272 L273 F309	I222-L269 WeakPolarHBondContact O-CD2 3.45Å; Q223-L269 HydrophobicContact CB-CD2 4.47Å; Q223-L269 HydrophobicContact CG-CD1 4.01Å; L261-L269 HydrophobicContact CD1-CD1 3.81Å; R265-L269 HydrophobicContact CG-CD1 4.38Å; R265-L269 VanDerWaalsContact O-CG 3.28Å; R265-L269 WeakPolarHBondContact O-CG 3.39Å; R265-L269 PolarHBondContact O-N 3.13Å; F266-L269 PolarHBondContact O-N 3.17Å; R267-L269 PolarHBondContact O-N 3.21Å; L269-R272 PolarHBondContact O-N 3.12Å; L269-L273 WeakPolarHBondContact O-CG 3.5Å; L269-L273 PolarHBondContact O-N 3.34Å; L269-F309 HydrophobicContact CB-CE1 3.61Å; L269-F309 HydrophobicContact CB-CZ 3.83Å; L269-F309 HydrophobicContact CD1-CE1 3.86Å; L269-F309 HydrophobicContact CD1-CZ 4.03Å; L269-F309 HydrophobicContact CG-CE1 4.39Å
270	V	98.1	Very high	95.7	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-51.1	173.1	168.9	0	0	0	0	110.1	F266 R267 R272 L273 L274 L306 F309 M321 F326	F266-V270 HydrophobicContact CD1-CG2 4.15Å; F266-V270 HydrophobicContact CE1-CG2 3.91Å; F266-V270 PolarHBondContact O-N 2.9Å; F266-V270 VanDerWaalsContact O-N 3.1Å; R267-V270 PolarHBondContact O-N 3.33Å; R267-V270 VanDerWaalsContact O-N 3.15Å; V270-R272 VanDerWaalsContact C-N 3.28Å; V270-R272 PolarHBondContact O-N 3.31Å; V270-L273 PolarHBondContact O-N 2.86Å; V270-L273 VanDerWaalsContact O-N 3.15Å; V270-L274 HydrophobicContact CG1-CD1 3.84Å; V270-L274 HydrophobicContact CG1-CG 4.37Å; V270-L274 WeakPolarHBondContact O-CG 3.28Å; V270-L274 PolarHBondContact O-N 3.39Å; V270-L306 HydrophobicContact CB-CD1 4.45Å; V270-L306 HydrophobicContact CG1-CD1 4.07Å; V270-L306 HydrophobicContact CG2-CD1 4.35Å; V270-F309 HydrophobicContact CG2-CB 3.94Å; V270-F309 HydrophobicContact CG2-CD1 3.84Å; V270-F309 HydrophobicContact CG2-CG 4.1Å; V270-M321 HydrophobicContact CB-CE 4.21Å; V270-M321 HydrophobicContact CB-SD 4.33Å; V270-M321 HydrophobicContact CG1-CE 3.96Å; V270-M321 HydrophobicContact CG1-SD 4.48Å; V270-M321 HydrophobicContact CG2-SD 4.04Å; V270-F326 HydrophobicContact CG1-CD1 4.06Å; V270-F326 HydrophobicContact CG1-CE1 4.14Å; V270-F326 HydrophobicContact CG1-CG 4.45Å; V270-F326 HydrophobicContact CG2-CE1 3.83Å; V270-F326 HydrophobicContact CG2-CZ 3.99Å
271	E	97.6	Very high	95.7	Very high	103 Å²	103	40.2 Å²	40.2	48%	0.481	20%	0.195	S	C	.	.	H	α-helix	trans	-55.8	-42.1	176.4	-73.4	170	179.8	0	0	111.8	R267 L274 Q275	R267-E271 WeakPolarHBondContact CD-OE1 3.43Å; R267-E271 HydrophobicContact CG-CG 4.24Å; R267-E271 VanDerWaalsContact CG-OE1 3.26Å; R267-E271 WeakPolarHBondContact CG-OE1 3.43Å; R267-E271 WeakPolarHBondContact O-CG 3.38Å; R267-E271 PolarHBondContact O-N 2.99Å; E271-L274 PolarHBondContact O-N 3.5Å; E271-Q275 VanDerWaalsContact O-CB 3.3Å; E271-Q275 WeakPolarHBondContact O-CB 3.33Å; E271-Q275 PolarHBondContact O-N 3.46Å
272	R	97.5	Very high	95.7	Very high	17 Å²	17	43.6 Å²	43.6	6%	0.064	21%	0.209	C	C	.	.	H	α-helix	trans	-64.5	-42.7	177.7	-170.2	-176.4	-60.3	140	12.4	112.8	Q223 N224 S228 F236 Q268 L269 V270 Q275 F276	Q223-R272 PolarHBondContact O-NH1 2.87Å; N224-R272 PolarHBondContact O-NH1 2.69Å; S228-R272 PolarHBondContact OG-NE 3.37Å; F236-R272 HydrophobicContact CE1-CG 4.31Å; Q268-R272 WeakPolarHBondContact O-CB 3.44Å; Q268-R272 PolarHBondContact O-N 3.01Å; Q268-R272 VanDerWaalsContact O-N 3.09Å; L269-R272 PolarHBondContact O-N 3.12Å; V270-R272 VanDerWaalsContact C-N 3.28Å; V270-R272 PolarHBondContact O-N 3.31Å; R272-Q275 PolarHBondContact O-N 3.21Å; R272-F276 WeakPolarHBondContact O-CB 3.27Å; R272-F276 PolarHBondContact O-N 3.09Å
273	L	98.2	Very high	95.5	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-42.6	176	-74.9	166.5	0	0	0	111.3	F236 L240 L269 V270 F276 I277 V305 L306 F309	F236-L273 HydrophobicContact CE1-CD2 4.23Å; F236-L273 HydrophobicContact CZ-CD2 3.7Å; F236-L273 HydrophobicContact CZ-CG 4.35Å; L240-L273 HydrophobicContact CD1-CD2 4.03Å; L240-L273 HydrophobicContact CD2-CD2 3.55Å; L240-L273 HydrophobicContact CG-CD2 4.46Å; L269-L273 WeakPolarHBondContact O-CG 3.5Å; L269-L273 PolarHBondContact O-N 3.34Å; V270-L273 PolarHBondContact O-N 2.86Å; V270-L273 VanDerWaalsContact O-N 3.15Å; L273-F276 PolarHBondContact O-N 3Å; L273-I277 WeakPolarHBondContact O-CG1 3.16Å; L273-I277 PolarHBondContact O-N 3.14Å; L273-V305 HydrophobicContact CD1-CG1 4.28Å; L273-V305 HydrophobicContact CD2-CG1 4.34Å; L273-L306 HydrophobicContact CB-CD1 4.02Å; L273-L306 HydrophobicContact CD1-CB 4.19Å; L273-L306 HydrophobicContact CD1-CD1 3.91Å; L273-F309 HydrophobicContact CD1-CD2 3.77Å; L273-F309 HydrophobicContact CD1-CE2 3.71Å; L273-F309 HydrophobicContact CD1-CZ 4.43Å
274	L	97.9	Very high	95.1	Very high	18 Å²	18	44.6 Å²	44.6	9%	0.094	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-48.3	175.9	-68.8	171.6	0	0	0	110.9	V270 E271 F276 I277 S278 L306 D325 F326 N328 I360	V270-L274 HydrophobicContact CG1-CD1 3.84Å; V270-L274 HydrophobicContact CG1-CG 4.37Å; V270-L274 WeakPolarHBondContact O-CG 3.28Å; V270-L274 PolarHBondContact O-N 3.39Å; E271-L274 PolarHBondContact O-N 3.5Å; L274-F276 VanDerWaalsContact C-N 3.33Å; L274-F276 PolarHBondContact O-N 3.29Å; L274-I277 PolarHBondContact O-N 3.02Å; L274-I277 VanDerWaalsContact O-N 3.15Å; L274-S278 PolarHBondContact O-N 3.16Å; L274-S278 PolarHBondContact O-OG 3.14Å; L274-L306 HydrophobicContact CD2-CD2 3.65Å; L274-L306 HydrophobicContact CG-CD2 4.3Å; L274-D325 WeakPolarHBondContact CD1-O 3.39Å; L274-F326 WeakPolarHBondContact CD2-O 3.47Å; L274-N328 HydrophobicContact CD2-CB 3.88Å; L274-N328 PolarHBondContact O-ND2 3.42Å; L274-I360 HydrophobicContact CD2-CD1 4.23Å; L274-I360 HydrophobicContact CD2-CG1 4.03Å
275	Q	96.8	Very high	94.6	Very high	108 Å²	108	42.1 Å²	42.1	51%	0.505	21%	0.214	S	C	.	.	H	α-helix	trans	-60.7	-41	177.3	-174.6	60.3	33.8	0	0	112	E271 R272 S278 T279	E271-Q275 VanDerWaalsContact O-CB 3.3Å; E271-Q275 WeakPolarHBondContact O-CB 3.33Å; E271-Q275 PolarHBondContact O-N 3.46Å; R272-Q275 PolarHBondContact O-N 3.21Å; Q275-S278 PolarHBondContact O-N 3.16Å; Q275-T279 PolarHBondContact NE2-OG1 2.99Å; Q275-T279 WeakPolarHBondContact O-CB 3.48Å; Q275-T279 PolarHBondContact O-N 3.41Å; Q275-T279 PolarHBondContact O-OG1 3.38Å
276	F	97	Very high	93.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-45.4	174.7	175.2	-90.2	0	0	0	111.5	Y233 F236 A237 L240 R272 L273 L274 R280 W298 A302	Y233-F276 AromaticContact CD1-CD2 3.8Å; Y233-F276 HydrophobicContact CD1-CD2 3.8Å; Y233-F276 HydrophobicContact CD1-CE2 4.28Å; Y233-F276 AromaticContact CD2-CD2 3.78Å; Y233-F276 HydrophobicContact CD2-CD2 3.78Å; Y233-F276 HydrophobicContact CD2-CE2 4.06Å; Y233-F276 HydrophobicContact CE1-CD2 4.08Å; Y233-F276 HydrophobicContact CE2-CD2 4.08Å; Y233-F276 AromaticContact CG-CD2 3.63Å; Y233-F276 HydrophobicContact CG-CD2 3.63Å; Y233-F276 AromaticContact CG-CE2 3.77Å; Y233-F276 HydrophobicContact CG-CE2 3.77Å; F236-F276 HydrophobicContact CD1-CB 4.28Å; F236-F276 AromaticContact CD1-CD2 3.55Å; F236-F276 HydrophobicContact CD1-CD2 3.55Å; F236-F276 HydrophobicContact CD1-CE2 4.02Å; F236-F276 AromaticContact CD1-CG 3.95Å; F236-F276 HydrophobicContact CD1-CG 3.95Å; F236-F276 HydrophobicContact CE1-CB 4.01Å; F236-F276 HydrophobicContact CE1-CD2 4.13Å; F236-F276 HydrophobicContact CE1-CG 4.06Å; A237-F276 HydrophobicContact CB-CE2 4.39Å; A237-F276 HydrophobicContact CB-CZ 3.87Å; L240-F276 HydrophobicContact CD1-CD1 4.19Å; L240-F276 HydrophobicContact CD1-CE1 4.06Å; L240-F276 HydrophobicContact CD1-CZ 4.4Å; R272-F276 WeakPolarHBondContact O-CB 3.27Å; R272-F276 PolarHBondContact O-N 3.09Å; L273-F276 PolarHBondContact O-N 3Å; L274-F276 VanDerWaalsContact C-N 3.33Å; L274-F276 PolarHBondContact O-N 3.29Å; F276-R280 VanDerWaalsContact O-CB 3.25Å; F276-R280 WeakPolarHBondContact O-CB 3.47Å; F276-R280 PolarHBondContact O-N 3.11Å; F276-W298 HydrophobicContact CE1-CB 4.38Å; F276-W298 HydrophobicContact CE1-CE3 4.45Å; F276-W298 AromaticContact CE2-CE3 3.99Å; F276-W298 HydrophobicContact CE2-CE3 3.99Å; F276-W298 HydrophobicContact CE2-CZ3 4.18Å; F276-W298 HydrophobicContact CZ-CB 4.31Å; F276-W298 HydrophobicContact CZ-CD2 4.07Å; F276-W298 AromaticContact CZ-CE3 3.53Å; F276-W298 HydrophobicContact CZ-CE3 3.53Å; F276-W298 HydrophobicContact CZ-CG 4.43Å; F276-W298 HydrophobicContact CZ-CZ3 4.18Å; F276-A302 HydrophobicContact CD1-CB 3.68Å; F276-A302 HydrophobicContact CE1-CB 3.77Å
277	I	96.6	Very high	92.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-48.7	176.7	-67.2	165.3	0	0	0	110.5	L273 L274 R280 L281 I299 A302 L306 F354 I360	L273-I277 WeakPolarHBondContact O-CG1 3.16Å; L273-I277 PolarHBondContact O-N 3.14Å; L274-I277 PolarHBondContact O-N 3.02Å; L274-I277 VanDerWaalsContact O-N 3.15Å; I277-R280 PolarHBondContact O-N 2.94Å; I277-L281 HydrophobicContact CG2-CD1 3.91Å; I277-L281 WeakPolarHBondContact O-CG 3.44Å; I277-L281 PolarHBondContact O-N 3.21Å; I277-I299 HydrophobicContact CG2-CG2 4.5Å; I277-A302 HydrophobicContact CD1-CB 4.14Å; I277-A302 HydrophobicContact CG1-CB 3.78Å; I277-L306 HydrophobicContact CD1-CD2 4.27Å; I277-F354 HydrophobicContact CG2-CE1 4.17Å; I277-F354 HydrophobicContact CG2-CZ 4.35Å; I277-I360 HydrophobicContact CD1-CD1 3.87Å
278	S	95.9	Very high	92.1	Very high	14 Å²	14	54.1 Å²	54.1	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-60.9	-48.8	-179	-65.9	0	0	0	0	112.4	L274 Q275 R280 L281 F282 N328 T330	L274-S278 PolarHBondContact O-N 3.16Å; L274-S278 PolarHBondContact O-OG 3.14Å; Q275-S278 PolarHBondContact O-N 3.16Å; S278-R280 PolarHBondContact O-N 3.39Å; S278-L281 PolarHBondContact O-N 3.34Å; S278-F282 PolarHBondContact O-N 3Å; S278-N328 PolarHBondContact OG-ND2 2.92Å; S278-N328 PolarHBondContact OG-OD1 3.37Å; S278-T330 WeakPolarHBondContact CB-OG1 3.32Å; S278-T330 WeakPolarHBondContact OG-CG2 3.34Å; S278-T330 PolarHBondContact OG-OG1 2.98Å
279	T	94.5	Very high	91.7	Very high	16 Å²	16	51.9 Å²	51.9	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-65	-31.5	178.8	-47.1	0	0	0	0	111.3	T230 Y233 Q275 F282 P283	T230-T279 HydrophobicContact CG2-CG2 3.93Å; Y233-T279 HydrophobicContact CE2-CG2 3.79Å; Y233-T279 PolarHBondContact OH-OG1 3.07Å; Q275-T279 PolarHBondContact NE2-OG1 2.99Å; Q275-T279 WeakPolarHBondContact O-CB 3.48Å; Q275-T279 PolarHBondContact O-N 3.41Å; Q275-T279 PolarHBondContact O-OG1 3.38Å; T279-F282 CarbonylContact O-C 3.6Å; T279-P283 VanDerWaalsContact O-CA 3.22Å; T279-P283 WeakPolarHBondContact O-CA 3.37Å
280	R	93.2	Very high	91.2	Very high	26 Å²	26	53.7 Å²	53.7	10%	0.098	29%	0.291	C	S	.	.	H	α-helix	trans	-73.6	-33.8	177.1	-177	53.5	179.3	165.1	-6.7	112.7	F276 I277 S278 P290 C295 W298 I299	F276-R280 VanDerWaalsContact O-CB 3.25Å; F276-R280 WeakPolarHBondContact O-CB 3.47Å; F276-R280 PolarHBondContact O-N 3.11Å; I277-R280 PolarHBondContact O-N 2.94Å; S278-R280 PolarHBondContact O-N 3.39Å; R280-P290 VanDerWaalsContact CZ-O 3.26Å; R280-P290 PolarHBondContact NH1-O 3.03Å; R280-P290 PolarHBondContact NH2-O 3.1Å; R280-C295 VanDerWaalsContact NH2-CB 3.27Å; R280-W298 HydrophobicContact CG-CB 4.44Å; R280-W298 HydrophobicContact CG-CE3 4.26Å; R280-I299 HydrophobicContact CB-CG1 4.26Å; R280-I299 HydrophobicContact CG-CD1 4Å; R280-I299 HydrophobicContact CG-CG1 3.78Å
281	L	91.9	Very high	90.5	Very high	47 Å²	47	57.9 Å²	57.9	25%	0.246	32%	0.318	C	S	.	.	H	α-helix	trans	-72.9	-41.9	174.6	-74.5	167.3	0	0	0	111.6	I277 S278 I299 L331 F354	I277-L281 HydrophobicContact CG2-CD1 3.91Å; I277-L281 WeakPolarHBondContact O-CG 3.44Å; I277-L281 PolarHBondContact O-N 3.21Å; S278-L281 PolarHBondContact O-N 3.34Å; L281-I299 HydrophobicContact CD2-CD1 3.56Å; L281-I299 HydrophobicContact CG-CD1 3.86Å; L281-L331 HydrophobicContact CD1-CD2 3.46Å; L281-L331 VanDerWaalsContact CD1-CD2 3.46Å; L281-F354 HydrophobicContact CD1-CE2 4.44Å; L281-F354 HydrophobicContact CD1-CZ 3.95Å; L281-F354 HydrophobicContact CD2-CE2 4.41Å; L281-F354 HydrophobicContact CD2-CZ 4.31Å
282	F	92	Very high	89.7	Confident	94 Å²	94	57.2 Å²	57.2	41%	0.412	33%	0.325	S	S	.	.	S	Bend	trans	-129.8	74.1	-174.6	-54	-77	0	0	0	109.7	S278 T279 T330 H333 I334	S278-F282 PolarHBondContact O-N 3Å; T279-F282 CarbonylContact O-C 3.6Å; F282-T330 VanDerWaalsContact CE2-O 3.32Å; F282-T330 WeakPolarHBondContact CE2-O 3.41Å; F282-H333 HydrophobicContact CE1-CB 4.28Å; F282-H333 HydrophobicContact CZ-CB 3.82Å; F282-I334 HydrophobicContact CE2-CG2 4.29Å; F282-I334 HydrophobicContact CZ-CG2 3.84Å
283	P	89.4	Confident	88.9	Confident	48 Å²	48	60.5 Å²	60.5	31%	0.312	36%	0.356	S	S	.	.			trans	-66.3	142.7	176.5	27.8	-33.7	0	0	0	110.5	T279 L289	T279-P283 VanDerWaalsContact O-CA 3.22Å; T279-P283 WeakPolarHBondContact O-CA 3.37Å; P283-L289 HydrophobicContact CB-CD1 4.22Å
284	A	85.5	Confident	88.2	Confident	94 Å²	94	68.8 Å²	68.8	78%	0.777	39%	0.392	S	S	*	.	S	Bend	trans	-65.3	-43.1	176.9	0	0	0	0	0	111.2
285	E	83.8	Confident	87.7	Confident	131 Å²	131	68.7 Å²	68.7	61%	0.612	39%	0.392	S	S	*	.	S	Bend	trans	-121.1	129.2	172.6	-65.4	-169.8	170.2	0	0	110.4	D287 E288	E285-D287 PolarHBondContact O-N 2.64Å; E285-E288 HydrophobicContact CB-CB 4.29Å; E285-E288 PolarHBondContact O-N 2.84Å
286	P	75.4	Confident	87.3	Confident	109 Å²	109	67.7 Å²	67.7	71%	0.708	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.9	-176.4	-24.7	33.4	0	0	0	114.7
287	D	78.3	Confident	87.1	Confident	159 Å²	159	70.3 Å²	70.3	85%	0.85	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-9.7	-174.4	-64.9	-36.1	0	0	0	113.6	E285 L289	E285-D287 PolarHBondContact O-N 2.64Å; D287-L289 VanDerWaalsContact C-N 3.28Å; D287-L289 PolarHBondContact O-N 2.97Å
288	E	81.3	Confident	87	Confident	88 Å²	88	70.4 Å²	70.4	41%	0.411	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-29.4	-178.9	-166.6	-174.7	176.8	0	0	112	T230 E285	T230-E288 WeakPolarHBondContact CB-OE1 3.27Å; T230-E288 PolarHBondContact OG1-OE1 3.43Å; E285-E288 HydrophobicContact CB-CB 4.29Å; E285-E288 PolarHBondContact O-N 2.84Å
289	L	86.8	Confident	87	Confident	13 Å²	13	71.1 Å²	71.1	7%	0.068	41%	0.41	C	S	.	.	S	Bend	trans	-115.9	149.8	-178	-63.3	-179.2	0	0	0	111.9	Y233 P283 D287 W298	Y233-L289 HydrophobicContact CD2-CD2 4.13Å; P283-L289 HydrophobicContact CB-CD1 4.22Å; D287-L289 VanDerWaalsContact C-N 3.28Å; D287-L289 PolarHBondContact O-N 2.97Å; L289-W298 HydrophobicContact CD2-CZ3 4.41Å
290	P	86.9	Confident	87	Confident	40 Å²	40	72.1 Å²	72.1	26%	0.26	42%	0.417	S	S	.	.			trans	-56	147.3	176.8	-25.4	33.8	0	0	0	112.8	V234 R280 S292 W298	V234-P290 HydrophobicContact CG2-CG 4.07Å; R280-P290 VanDerWaalsContact CZ-O 3.26Å; R280-P290 PolarHBondContact NH1-O 3.03Å; R280-P290 PolarHBondContact NH2-O 3.1Å; P290-S292 PolarHBondContact O-N 2.97Å; P290-W298 HydrophobicContact CG-CH2 4.15Å; P290-W298 HydrophobicContact CG-CZ2 4.13Å
291	P	84.4	Confident	87.2	Confident	88 Å²	88	71.5 Å²	71.5	57%	0.571	42%	0.416	S	S	*	.			trans	-52.5	137.5	-179	-28.2	34.2	0	0	0	113.4	A293 K294 C295	P291-A293 VanDerWaalsContact C-N 3.26Å; P291-A293 PolarHBondContact O-N 3.4Å; P291-K294 PolarHBondContact O-N 3.37Å; P291-K294 VanDerWaalsContact O-N 3.16Å; P291-C295 PolarHBondContact O-N 2.8Å
292	S	79.5	Confident	87.5	Confident	90 Å²	90	69.2 Å²	69.2	63%	0.629	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-54.3	-39.1	-176.8	60.2	0	0	0	0	113.3	P290 K294 C295 S296	P290-S292 PolarHBondContact O-N 2.97Å; S292-K294 VanDerWaalsContact C-N 3.32Å; S292-K294 PolarHBondContact O-N 2.83Å; S292-C295 CarbonylContact O-C 3.58Å; S292-C295 PolarHBondContact O-N 3.32Å; S292-C295 VanDerWaalsContact O-N 3.16Å; S292-S296 PolarHBondContact O-N 2.88Å
293	A	80.9	Confident	87.8	Confident	86 Å²	86	64.8 Å²	64.8	71%	0.711	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-58.7	-36.7	-179.8	0	0	0	0	0	114	P291	P291-A293 VanDerWaalsContact C-N 3.26Å; P291-A293 PolarHBondContact O-N 3.4Å
294	K	83.4	Confident	88.1	Confident	175 Å²	175	65.3 Å²	65.3	76%	0.761	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-86	-15.5	-179.1	-66.1	-176.1	179	178.6	0	113.1	P291 S292	P291-K294 PolarHBondContact O-N 3.37Å; P291-K294 VanDerWaalsContact O-N 3.16Å; S292-K294 VanDerWaalsContact C-N 3.32Å; S292-K294 PolarHBondContact O-N 2.83Å
295	C	87.6	Confident	88.7	Confident	17 Å²	17	60.9 Å²	60.9	12%	0.115	35%	0.346	C	S	.	.			trans	-129.7	31.6	-170.4	-74.9	0	0	0	0	111.5	R280 P291 S292 W297 W298	R280-C295 VanDerWaalsContact NH2-CB 3.27Å; P291-C295 PolarHBondContact O-N 2.8Å; S292-C295 CarbonylContact O-C 3.58Å; S292-C295 PolarHBondContact O-N 3.32Å; S292-C295 VanDerWaalsContact O-N 3.16Å; C295-W297 PolarHBondContact O-N 3.2Å; C295-W297 VanDerWaalsContact O-N 3.14Å; C295-W298 HydrophobicContact CB-CD2 4.24Å; C295-W298 HydrophobicContact CB-CG 4.09Å; C295-W298 WeakPolarHBondContact O-CB 3.12Å; C295-W298 PolarHBondContact O-N 2.91Å; C295-W298 VanDerWaalsContact O-N 3.14Å; C295-W298 PolarHBondContact SG-NE1 3.13Å; C295-W298 VanDerWaalsContact SG-NE1 3.42Å
296	S	88.6	Confident	89.4	Confident	87 Å²	87	54.6 Å²	54.6	61%	0.608	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.1	178.9	56.6	0	0	0	0	113.1	S292 P300	S292-S296 PolarHBondContact O-N 2.88Å; S296-P300 WeakPolarHBondContact O-CD 3.36Å; S296-P300 WeakPolarHBondContact O-CG 3.3Å
297	W	92.3	Very high	90.5	Very high	54 Å²	54	49.5 Å²	49.5	21%	0.205	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-11.8	178.4	58.4	-96.1	0	0	0	114.3	A237 H238 R241 C295 S301	A237-W297 HydrophobicContact CB-CH2 3.67Å; A237-W297 HydrophobicContact CB-CZ3 3.69Å; A237-W297 VanDerWaalsContact O-CZ3 3.28Å; A237-W297 WeakPolarHBondContact O-CZ3 3.3Å; H238-W297 AromaticContact CE1-CH2 3.95Å; H238-W297 AromaticContact CE1-CZ2 3.87Å; H238-W297 AromaticContact ND1-CH2 3.87Å; R241-W297 HydrophobicContact CB-CE3 3.87Å; R241-W297 HydrophobicContact CB-CH2 4.5Å; R241-W297 HydrophobicContact CB-CZ3 3.68Å; R241-W297 HydrophobicContact CG-CE3 4.01Å; R241-W297 HydrophobicContact CG-CZ3 4.23Å; C295-W297 PolarHBondContact O-N 3.2Å; C295-W297 VanDerWaalsContact O-N 3.14Å; W297-S301 VanDerWaalsContact O-CB 3.27Å; W297-S301 WeakPolarHBondContact O-CB 3.49Å; W297-S301 PolarHBondContact O-N 3.25Å; W297-S301 PolarHBondContact O-OG 3.45Å
298	W	95.6	Very high	91.4	Very high	2 Å²	2	42 Å²	42	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-55.8	-176.7	-77.4	30	0	0	0	112.2	V234 A237 F276 R280 L289 P290 C295 S301 A302	V234-W298 HydrophobicContact CB-CH2 4.36Å; V234-W298 HydrophobicContact CB-CZ2 4.33Å; V234-W298 HydrophobicContact CG2-CH2 3.78Å; V234-W298 HydrophobicContact CG2-CZ2 3.98Å; A237-W298 HydrophobicContact CB-CD2 3.55Å; A237-W298 VanDerWaalsContact CB-CE2 3.42Å; A237-W298 HydrophobicContact CB-CE3 4.11Å; A237-W298 HydrophobicContact CB-CG 3.82Å; A237-W298 HydrophobicContact CB-CH2 4.42Å; A237-W298 HydrophobicContact CB-CZ2 3.89Å; F276-W298 HydrophobicContact CE1-CB 4.38Å; F276-W298 HydrophobicContact CE1-CE3 4.45Å; F276-W298 AromaticContact CE2-CE3 3.99Å; F276-W298 HydrophobicContact CE2-CE3 3.99Å; F276-W298 HydrophobicContact CE2-CZ3 4.18Å; F276-W298 HydrophobicContact CZ-CB 4.31Å; F276-W298 HydrophobicContact CZ-CD2 4.07Å; F276-W298 AromaticContact CZ-CE3 3.53Å; F276-W298 HydrophobicContact CZ-CE3 3.53Å; F276-W298 HydrophobicContact CZ-CG 4.43Å; F276-W298 HydrophobicContact CZ-CZ3 4.18Å; R280-W298 HydrophobicContact CG-CB 4.44Å; R280-W298 HydrophobicContact CG-CE3 4.26Å; L289-W298 HydrophobicContact CD2-CZ3 4.41Å; P290-W298 HydrophobicContact CG-CH2 4.15Å; P290-W298 HydrophobicContact CG-CZ2 4.13Å; C295-W298 HydrophobicContact CB-CD2 4.24Å; C295-W298 HydrophobicContact CB-CG 4.09Å; C295-W298 WeakPolarHBondContact O-CB 3.12Å; C295-W298 PolarHBondContact O-N 2.91Å; C295-W298 VanDerWaalsContact O-N 3.14Å; C295-W298 PolarHBondContact SG-NE1 3.13Å; C295-W298 VanDerWaalsContact SG-NE1 3.42Å; W298-S301 PolarHBondContact O-N 3.38Å; W298-A302 WeakPolarHBondContact O-CB 3.33Å; W298-A302 PolarHBondContact O-N 3.26Å
299	I	95.7	Very high	92.2	Very high	29 Å²	29	37.8 Å²	37.8	15%	0.149	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-48.2	-178.5	-66.7	167.6	0	0	0	111.4	I277 R280 L281 S301 A302 T303 F352 F354	I277-I299 HydrophobicContact CG2-CG2 4.5Å; R280-I299 HydrophobicContact CB-CG1 4.26Å; R280-I299 HydrophobicContact CG-CD1 4Å; R280-I299 HydrophobicContact CG-CG1 3.78Å; L281-I299 HydrophobicContact CD2-CD1 3.56Å; L281-I299 HydrophobicContact CG-CD1 3.86Å; I299-S301 VanDerWaalsContact C-N 3.32Å; I299-S301 PolarHBondContact O-N 3.23Å; I299-A302 PolarHBondContact O-N 2.9Å; I299-T303 WeakPolarHBondContact O-CB 3.41Å; I299-T303 PolarHBondContact O-N 3.43Å; I299-T303 PolarHBondContact O-OG1 3.44Å; I299-F352 HydrophobicContact CG2-CD1 4.33Å; I299-F352 HydrophobicContact CG2-CE1 3.66Å; I299-F352 HydrophobicContact CG2-CZ 4.03Å; I299-F354 HydrophobicContact CG2-CE1 3.76Å; I299-F354 HydrophobicContact CG2-CZ 3.52Å
300	P	95.4	Very high	92.7	Very high	37 Å²	37	37.8 Å²	37.8	24%	0.24	22%	0.223	C	C	.	.	H	α-helix	trans	-57	-42.9	175.4	-25	31.6	0	0	0	113.5	S296 K304 F352	S296-P300 WeakPolarHBondContact O-CD 3.36Å; S296-P300 WeakPolarHBondContact O-CG 3.3Å; P300-K304 WeakPolarHBondContact O-CB 3.36Å; P300-K304 PolarHBondContact O-N 3.35Å; P300-F352 HydrophobicContact CB-CB 4.49Å; P300-F352 HydrophobicContact CB-CD2 3.64Å; P300-F352 HydrophobicContact CB-CE2 4.08Å; P300-F352 HydrophobicContact CB-CG 4.15Å; P300-F352 HydrophobicContact CG-CB 3.81Å; P300-F352 HydrophobicContact CG-CD1 4.34Å; P300-F352 HydrophobicContact CG-CD2 3.73Å; P300-F352 HydrophobicContact CG-CE2 4.38Å; P300-F352 HydrophobicContact CG-CG 3.69Å
301	S	96.4	Very high	93.2	Very high	13 Å²	13	35.9 Å²	35.9	9%	0.091	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-47.1	-180	-57.4	0	0	0	0	111.3	W297 W298 I299 T303 K304 V305	W297-S301 VanDerWaalsContact O-CB 3.27Å; W297-S301 WeakPolarHBondContact O-CB 3.49Å; W297-S301 PolarHBondContact O-N 3.25Å; W297-S301 PolarHBondContact O-OG 3.45Å; W298-S301 PolarHBondContact O-N 3.38Å; I299-S301 VanDerWaalsContact C-N 3.32Å; I299-S301 PolarHBondContact O-N 3.23Å; S301-T303 PolarHBondContact O-N 3.46Å; S301-K304 PolarHBondContact O-N 2.72Å; S301-V305 WeakPolarHBondContact O-CG2 3.23Å; S301-V305 PolarHBondContact O-N 3.01Å
302	A	98	Very high	93.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-44.1	177.7	0	0	0	0	0	112.2	L240 F276 I277 W298 I299 K304 V305 L306	L240-A302 HydrophobicContact CD1-CB 3.81Å; F276-A302 HydrophobicContact CD1-CB 3.68Å; F276-A302 HydrophobicContact CE1-CB 3.77Å; I277-A302 HydrophobicContact CD1-CB 4.14Å; I277-A302 HydrophobicContact CG1-CB 3.78Å; W298-A302 WeakPolarHBondContact O-CB 3.33Å; W298-A302 PolarHBondContact O-N 3.26Å; I299-A302 PolarHBondContact O-N 2.9Å; A302-K304 PolarHBondContact O-N 2.78Å; A302-V305 PolarHBondContact O-N 2.75Å; A302-L306 WeakPolarHBondContact O-CB 3.39Å; A302-L306 PolarHBondContact O-N 3.21Å
303	T	97.8	Very high	94.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.5	-39.9	179.2	-48.9	0	0	0	0	111.2	I299 S301 L306 S307 F352 F357 I360	I299-T303 WeakPolarHBondContact O-CB 3.41Å; I299-T303 PolarHBondContact O-N 3.43Å; I299-T303 PolarHBondContact O-OG1 3.44Å; S301-T303 PolarHBondContact O-N 3.46Å; T303-L306 PolarHBondContact O-N 3.45Å; T303-S307 PolarHBondContact O-N 3.19Å; T303-F352 HydrophobicContact CG2-CE2 4.39Å; T303-F352 HydrophobicContact CG2-CZ 4.08Å; T303-F357 HydrophobicContact CG2-CB 3.69Å; T303-F357 HydrophobicContact CG2-CD1 4.08Å; T303-F357 HydrophobicContact CG2-CD2 3.51Å; T303-F357 HydrophobicContact CG2-CE2 4.14Å; T303-F357 HydrophobicContact CG2-CG 3.47Å; T303-F357 VanDerWaalsContact CG2-CG 3.47Å; T303-I360 HydrophobicContact CG2-CD1 4.43Å
304	K	96.7	Very high	95	Very high	59 Å²	59	25.9 Å²	25.9	26%	0.257	14%	0.138	S	C	.	.	H	α-helix	trans	-64.1	-41.5	174.2	-171.2	173	-178.5	-170.1	0	111.8	A244 P300 S301 A302 S307 L308 F357	A244-K304 HydrophobicContact CB-CB 4.22Å; A244-K304 HydrophobicContact CB-CD 4.06Å; A244-K304 HydrophobicContact CB-CG 4.38Å; A244-K304 WeakPolarHBondContact O-CD 3.26Å; A244-K304 VanDerWaalsContact O-CE 3.31Å; A244-K304 WeakPolarHBondContact O-CE 3.47Å; A244-K304 PolarHBondContact O-NZ 3.09Å; P300-K304 WeakPolarHBondContact O-CB 3.36Å; P300-K304 PolarHBondContact O-N 3.35Å; S301-K304 PolarHBondContact O-N 2.72Å; A302-K304 PolarHBondContact O-N 2.78Å; K304-S307 WeakPolarHBondContact O-CB 3.2Å; K304-S307 PolarHBondContact O-N 3.3Å; K304-S307 PolarHBondContact O-OG 2.88Å; K304-L308 PolarHBondContact O-N 3.07Å; K304-F357 HydrophobicContact CB-CZ 4.41Å
305	V	98.3	Very high	95.3	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-65.9	-42.2	175	174.8	0	0	0	0	111.3	I222 L240 I243 A244 L273 S301 A302 S307 L308 F309	I222-V305 HydrophobicContact CD1-CG1 3.55Å; L240-V305 HydrophobicContact CB-CG2 4.26Å; L240-V305 HydrophobicContact CD2-CB 3.88Å; L240-V305 HydrophobicContact CD2-CG1 3.75Å; L240-V305 HydrophobicContact CD2-CG2 3.87Å; L240-V305 WeakPolarHBondContact O-CG2 3.5Å; I243-V305 HydrophobicContact CB-CG2 3.89Å; I243-V305 HydrophobicContact CG2-CG1 4.39Å; I243-V305 HydrophobicContact CG2-CG2 3.79Å; A244-V305 HydrophobicContact CB-CG2 4.31Å; L273-V305 HydrophobicContact CD1-CG1 4.28Å; L273-V305 HydrophobicContact CD2-CG1 4.34Å; S301-V305 WeakPolarHBondContact O-CG2 3.23Å; S301-V305 PolarHBondContact O-N 3.01Å; A302-V305 PolarHBondContact O-N 2.75Å; V305-S307 PolarHBondContact O-N 2.91Å; V305-L308 VanDerWaalsContact O-CB 3.23Å; V305-L308 WeakPolarHBondContact O-CB 3.41Å; V305-L308 PolarHBondContact O-N 3.21Å; V305-F309 HydrophobicContact CG1-CE2 4.21Å
306	L	98.4	Very high	95.4	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.5	-32.8	174.7	-175.5	64.4	0	0	0	112	V270 L273 L274 I277 A302 T303 L308 F309 N310 F326 F359 I360	V270-L306 HydrophobicContact CB-CD1 4.45Å; V270-L306 HydrophobicContact CG1-CD1 4.07Å; V270-L306 HydrophobicContact CG2-CD1 4.35Å; L273-L306 HydrophobicContact CB-CD1 4.02Å; L273-L306 HydrophobicContact CD1-CB 4.19Å; L273-L306 HydrophobicContact CD1-CD1 3.91Å; L274-L306 HydrophobicContact CD2-CD2 3.65Å; L274-L306 HydrophobicContact CG-CD2 4.3Å; I277-L306 HydrophobicContact CD1-CD2 4.27Å; A302-L306 WeakPolarHBondContact O-CB 3.39Å; A302-L306 PolarHBondContact O-N 3.21Å; T303-L306 PolarHBondContact O-N 3.45Å; L306-L308 PolarHBondContact O-N 3.08Å; L306-F309 WeakPolarHBondContact O-CB 3.42Å; L306-F309 PolarHBondContact O-N 3.28Å; L306-N310 PolarHBondContact O-N 3.37Å; L306-F326 HydrophobicContact CD1-CD1 4.12Å; L306-F326 HydrophobicContact CD1-CE1 4.22Å; L306-F326 HydrophobicContact CG-CD1 4.46Å; L306-F359 HydrophobicContact CB-CE2 4.43Å; L306-F359 HydrophobicContact CB-CZ 4.36Å; L306-F359 HydrophobicContact CD2-CE2 3.73Å; L306-F359 HydrophobicContact CD2-CZ 4.33Å; L306-F359 HydrophobicContact CG-CE2 3.67Å; L306-F359 HydrophobicContact CG-CZ 4.08Å; L306-I360 HydrophobicContact CD2-CD1 3.9Å; L306-I360 HydrophobicContact CD2-CG1 4.21Å
307	S	97.9	Very high	95.2	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.014	11%	0.108	C	C	.	.	H	α-helix	trans	-63.4	-27.4	174.1	81.9	0	0	0	0	113.5	L40 T303 K304 V305 N310 A311	L40-S307 VanDerWaalsContact CD2-OG 3.24Å; L40-S307 WeakPolarHBondContact CD2-OG 3.29Å; T303-S307 PolarHBondContact O-N 3.19Å; K304-S307 WeakPolarHBondContact O-CB 3.2Å; K304-S307 PolarHBondContact O-N 3.3Å; K304-S307 PolarHBondContact O-OG 2.88Å; V305-S307 PolarHBondContact O-N 2.91Å; S307-N310 PolarHBondContact O-N 2.87Å; S307-A311 WeakPolarHBondContact O-CB 3.44Å; S307-A311 PolarHBondContact O-N 3.4Å
308	L	97.9	Very high	94.9	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-67.8	-38.3	171.8	-58.6	168.1	0	0	0	111.4	L40 I243 H251 L254 V255 L258 K304 V305 L306 A311 A312	L40-L308 HydrophobicContact CD1-CD2 4.28Å; L40-L308 HydrophobicContact CD2-CD2 3.53Å; L40-L308 HydrophobicContact CD2-CG 4.21Å; I243-L308 HydrophobicContact CG2-CD1 3.91Å; H251-L308 HydrophobicContact CB-CD2 3.57Å; L254-L308 HydrophobicContact CD1-CD1 4.48Å; V255-L308 HydrophobicContact CG2-CB 4.23Å; V255-L308 HydrophobicContact CG2-CD2 3.91Å; L258-L308 HydrophobicContact CD1-CB 4.15Å; K304-L308 PolarHBondContact O-N 3.07Å; V305-L308 VanDerWaalsContact O-CB 3.23Å; V305-L308 WeakPolarHBondContact O-CB 3.41Å; V305-L308 PolarHBondContact O-N 3.21Å; L306-L308 PolarHBondContact O-N 3.08Å; L308-A311 WeakPolarHBondContact O-CB 3.4Å; L308-A311 PolarHBondContact O-N 3.32Å; L308-A312 WeakPolarHBondContact O-CB 3.33Å; L308-A312 PolarHBondContact O-N 3.41Å
309	F	98.1	Very high	94.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.2	-45.8	173.3	-74.6	-100.8	0	0	0	110.4	I222 L258 F266 L269 V270 L273 V305 L306 A311 A312 N313 F326	I222-F309 HydrophobicContact CD1-CE2 3.78Å; I222-F309 HydrophobicContact CD1-CZ 4.07Å; L258-F309 HydrophobicContact CD1-CD2 4.14Å; L258-F309 HydrophobicContact CD1-CE2 4.07Å; L258-F309 HydrophobicContact CD1-CG 4.39Å; L258-F309 HydrophobicContact CD1-CZ 4.27Å; L258-F309 HydrophobicContact CD2-CD1 4.44Å; L258-F309 HydrophobicContact CD2-CE1 3.74Å; L258-F309 HydrophobicContact CD2-CE2 4.21Å; L258-F309 HydrophobicContact CD2-CZ 3.6Å; F266-F309 HydrophobicContact CD2-CD1 4.02Å; F266-F309 HydrophobicContact CD2-CE1 4.41Å; F266-F309 HydrophobicContact CE1-CB 4.49Å; F266-F309 HydrophobicContact CE1-CD1 4.26Å; F266-F309 HydrophobicContact CE2-CB 4.46Å; F266-F309 AromaticContact CE2-CD1 3.66Å; F266-F309 HydrophobicContact CE2-CD1 3.66Å; F266-F309 HydrophobicContact CE2-CE1 4.41Å; F266-F309 HydrophobicContact CE2-CG 4.46Å; F266-F309 HydrophobicContact CG-CD1 4.46Å; F266-F309 HydrophobicContact CZ-CB 3.93Å; F266-F309 AromaticContact CZ-CD1 3.8Å; F266-F309 HydrophobicContact CZ-CD1 3.8Å; F266-F309 HydrophobicContact CZ-CG 4.35Å; F266-F309 WeakPolarHBondContact CZ-O 3.49Å; L269-F309 HydrophobicContact CB-CE1 3.61Å; L269-F309 HydrophobicContact CB-CZ 3.83Å; L269-F309 HydrophobicContact CD1-CE1 3.86Å; L269-F309 HydrophobicContact CD1-CZ 4.03Å; L269-F309 HydrophobicContact CG-CE1 4.39Å; V270-F309 HydrophobicContact CG2-CB 3.94Å; V270-F309 HydrophobicContact CG2-CD1 3.84Å; V270-F309 HydrophobicContact CG2-CG 4.1Å; L273-F309 HydrophobicContact CD1-CD2 3.77Å; L273-F309 HydrophobicContact CD1-CE2 3.71Å; L273-F309 HydrophobicContact CD1-CZ 4.43Å; V305-F309 HydrophobicContact CG1-CE2 4.21Å; L306-F309 WeakPolarHBondContact O-CB 3.42Å; L306-F309 PolarHBondContact O-N 3.28Å; F309-A311 VanDerWaalsContact C-N 3.27Å; F309-A311 PolarHBondContact O-N 3.09Å; F309-A312 WeakPolarHBondContact O-CB 3.2Å; F309-A312 PolarHBondContact O-N 3.1Å; F309-A312 VanDerWaalsContact O-N 3.1Å; F309-N313 PolarHBondContact O-N 2.9Å; F309-F326 HydrophobicContact CB-CE1 3.91Å; F309-F326 HydrophobicContact CB-CZ 4.32Å
310	N	97.4	Very high	94.6	Very high	12 Å²	12	25.3 Å²	25.3	6%	0.064	16%	0.158	C	C	.	.	H	α-helix	trans	-59.2	-39.9	175.6	179	61.2	0	0	0	112	L306 S307 N313 S314 F326 F359	L306-N310 PolarHBondContact O-N 3.37Å; S307-N310 PolarHBondContact O-N 2.87Å; N310-N313 PolarHBondContact O-N 3.31Å; N310-S314 WeakPolarHBondContact O-CB 3.42Å; N310-S314 PolarHBondContact O-N 3.25Å; N310-S314 PolarHBondContact O-OG 3.38Å; N310-F326 HydrophobicContact CB-CD1 4.09Å; N310-F326 HydrophobicContact CB-CE1 3.86Å; N310-F326 HydrophobicContact CB-CZ 4.36Å; N310-F359 HydrophobicContact CB-CD1 3.99Å; N310-F359 HydrophobicContact CB-CD2 3.91Å; N310-F359 HydrophobicContact CB-CE1 4.2Å; N310-F359 HydrophobicContact CB-CE2 4.17Å; N310-F359 HydrophobicContact CB-CG 3.86Å; N310-F359 HydrophobicContact CB-CZ 4.31Å
311	A	95.9	Very high	94.6	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-47.3	172.9	0	0	0	0	0	111.8	I44 V255 S307 L308 F309 N313 S314 V315	I44-A311 HydrophobicContact CD1-CB 3.84Å; I44-A311 HydrophobicContact CG1-CB 3.61Å; V255-A311 HydrophobicContact CG1-CB 4.02Å; V255-A311 HydrophobicContact CG2-CB 3.8Å; S307-A311 WeakPolarHBondContact O-CB 3.44Å; S307-A311 PolarHBondContact O-N 3.4Å; L308-A311 WeakPolarHBondContact O-CB 3.4Å; L308-A311 PolarHBondContact O-N 3.32Å; F309-A311 VanDerWaalsContact C-N 3.27Å; F309-A311 PolarHBondContact O-N 3.09Å; A311-N313 VanDerWaalsContact C-N 3.31Å; A311-N313 PolarHBondContact O-N 3.42Å; A311-S314 PolarHBondContact O-N 3.25Å; A311-S314 VanDerWaalsContact O-N 3.12Å; A311-V315 WeakPolarHBondContact O-CG2 3.49Å; A311-V315 PolarHBondContact O-N 3.46Å
312	A	96	Very high	94.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.2	-39.8	177.8	0	0	0	0	0	112.3	V255 L258 K259 F266 L308 F309 V315 S316	V255-A312 HydrophobicContact CG1-CB 4.25Å; V255-A312 VanDerWaalsContact O-CB 3.32Å; V255-A312 WeakPolarHBondContact O-CB 3.37Å; L258-A312 HydrophobicContact CB-CB 3.85Å; K259-A312 HydrophobicContact CB-CB 4.36Å; F266-A312 HydrophobicContact CE2-CB 3.96Å; F266-A312 HydrophobicContact CZ-CB 4.28Å; L308-A312 WeakPolarHBondContact O-CB 3.33Å; L308-A312 PolarHBondContact O-N 3.41Å; F309-A312 WeakPolarHBondContact O-CB 3.2Å; F309-A312 PolarHBondContact O-N 3.1Å; F309-A312 VanDerWaalsContact O-N 3.1Å; A312-V315 WeakPolarHBondContact O-CG2 3.43Å; A312-S316 PolarHBondContact O-N 2.88Å; A312-S316 PolarHBondContact O-OG 3.47Å
313	N	96	Very high	94.2	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-42.9	174.1	-165.7	49.8	0	0	0	111.5	F266 F309 N310 A311 S316 I320 M321 F326	F266-N313 HydrophobicContact CE1-CB 4.39Å; F266-N313 HydrophobicContact CZ-CB 4.21Å; F309-N313 PolarHBondContact O-N 2.9Å; N310-N313 PolarHBondContact O-N 3.31Å; A311-N313 VanDerWaalsContact C-N 3.31Å; A311-N313 PolarHBondContact O-N 3.42Å; N313-S316 WeakPolarHBondContact O-CB 3.48Å; N313-S316 PolarHBondContact O-N 3.25Å; N313-I320 WeakPolarHBondContact OD1-CA 3.4Å; N313-I320 WeakPolarHBondContact OD1-CB 3.32Å; N313-I320 PolarHBondContact OD1-N 3.2Å; N313-M321 PolarHBondContact ND2-O 3.16Å; N313-M321 PolarHBondContact OD1-N 3.42Å; N313-M321 PolarHBondContact OD1-O 3.2Å; N313-F326 HydrophobicContact CB-CE2 4.01Å; N313-F326 HydrophobicContact CB-CZ 3.97Å
314	S	91.8	Very high	94	Very high	50 Å²	50	31.7 Å²	31.7	35%	0.35	19%	0.194	S	C	.	.	H	α-helix	trans	-69.5	-33.6	-177.7	-57.7	0	0	0	0	113.5	N310 A311 S316	N310-S314 WeakPolarHBondContact O-CB 3.42Å; N310-S314 PolarHBondContact O-N 3.25Å; N310-S314 PolarHBondContact O-OG 3.38Å; A311-S314 PolarHBondContact O-N 3.25Å; A311-S314 VanDerWaalsContact O-N 3.12Å; S314-S316 PolarHBondContact O-N 3.05Å
315	V	90.2	Very high	93.9	Very high	36 Å²	36	31.7 Å²	31.7	22%	0.218	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.5	175.4	-58.8	0	0	0	0	113.1	L47 V255 K259 A311 A312	L47-V315 HydrophobicContact CB-CG1 4.34Å; L47-V315 HydrophobicContact CD1-CG1 4.19Å; V255-V315 HydrophobicContact CG1-CG2 3.99Å; K259-V315 HydrophobicContact CD-CG2 4.01Å; K259-V315 PolarHBondContact NZ-O 3.17Å; A311-V315 WeakPolarHBondContact O-CG2 3.49Å; A311-V315 PolarHBondContact O-N 3.46Å; A312-V315 WeakPolarHBondContact O-CG2 3.43Å
316	S	88.6	Confident	93.8	Very high	10 Å²	10	31.6 Å²	31.6	7%	0.07	20%	0.196	C	C	.	.	S	Bend	trans	-90.1	140.1	175.7	-59.9	0	0	0	0	110.8	K259 A312 N313 S314 P318 I320	K259-S316 VanDerWaalsContact CD-OG 3.23Å; K259-S316 WeakPolarHBondContact CD-OG 3.4Å; K259-S316 WeakPolarHBondContact CG-OG 3.35Å; A312-S316 PolarHBondContact O-N 2.88Å; A312-S316 PolarHBondContact O-OG 3.47Å; N313-S316 WeakPolarHBondContact O-CB 3.48Å; N313-S316 PolarHBondContact O-N 3.25Å; S314-S316 PolarHBondContact O-N 3.05Å; S316-P318 CarbonylContact C-O 3.34Å; S316-P318 WeakPolarHBondContact CB-O 3.47Å; S316-P318 CarbonylContact O-C 3.6Å; S316-I320 WeakPolarHBondContact OG-CG1 3.49Å
317	S	84.1	Confident	93.7	Very high	80 Å²	80	33.1 Å²	33.1	56%	0.559	20%	0.202	S	C	*	.	S	Bend	trans	-136.6	104.7	178.8	-163.3	0	0	0	0	107.8
318	P	87.3	Confident	93.7	Very high	111 Å²	111	33.3 Å²	33.3	72%	0.721	20%	0.202	S	C	*	.	S	Bend	cis	-67.1	164.7	-2.9	30.8	-36.1	0	0	0	113.1	S316	S316-P318 CarbonylContact C-O 3.34Å; S316-P318 WeakPolarHBondContact CB-O 3.47Å; S316-P318 CarbonylContact O-C 3.6Å
319	P	90.7	Very high	93.4	Very high	84 Å²	84	38.8 Å²	38.8	55%	0.545	23%	0.231	S	C	.	.			trans	-54.5	148	170.1	-24.1	34.2	0	0	0	111.9
320	I	94.9	Very high	93.2	Very high	30 Å²	30	40.4 Å²	40.4	15%	0.154	24%	0.24	C	C	.	.	S	Bend	trans	-71.2	-37.3	-178.2	-54.2	169.3	0	0	0	110.8	K259 A263 F266 N313 S316	K259-I320 HydrophobicContact CB-CD1 4.49Å; A263-I320 HydrophobicContact CB-CG2 4.1Å; F266-I320 HydrophobicContact CB-CG2 3.97Å; F266-I320 HydrophobicContact CD1-CB 4.37Å; F266-I320 HydrophobicContact CD1-CG2 3.91Å; F266-I320 HydrophobicContact CD2-CD1 3.85Å; F266-I320 HydrophobicContact CD2-CG2 4.43Å; F266-I320 HydrophobicContact CE1-CB 4.49Å; F266-I320 HydrophobicContact CE1-CD1 4.43Å; F266-I320 HydrophobicContact CE1-CG2 4.5Å; F266-I320 HydrophobicContact CE2-CD1 3.67Å; F266-I320 HydrophobicContact CG-CD1 4.3Å; F266-I320 HydrophobicContact CG-CG2 3.86Å; F266-I320 HydrophobicContact CZ-CD1 3.97Å; N313-I320 WeakPolarHBondContact OD1-CA 3.4Å; N313-I320 WeakPolarHBondContact OD1-CB 3.32Å; N313-I320 PolarHBondContact OD1-N 3.2Å; S316-I320 WeakPolarHBondContact OG-CG1 3.49Å
321	M	94.9	Very high	93	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.034	24%	0.238	C	C	.	.	S	Bend	trans	-147.9	158.2	176.1	65.6	-164.3	-78.2	0	0	110.9	F266 R267 V270 N313 D325 F326	F266-M321 HydrophobicContact CD1-CG 4.34Å; F266-M321 HydrophobicContact CD1-SD 3.49Å; F266-M321 WeakPolarHBondContact CD1-SD 3.27Å; F266-M321 HydrophobicContact CE1-CG 4.21Å; F266-M321 HydrophobicContact CE1-SD 3.59Å; F266-M321 VanDerWaalsContact CE1-SD 3.59Å; R267-M321 HydrophobicContact CB-CE 4.27Å; R267-M321 HydrophobicContact CB-SD 4.39Å; R267-M321 HydrophobicContact CG-CE 4.02Å; V270-M321 HydrophobicContact CB-CE 4.21Å; V270-M321 HydrophobicContact CB-SD 4.33Å; V270-M321 HydrophobicContact CG1-CE 3.96Å; V270-M321 HydrophobicContact CG1-SD 4.48Å; V270-M321 HydrophobicContact CG2-SD 4.04Å; N313-M321 PolarHBondContact ND2-O 3.16Å; N313-M321 PolarHBondContact OD1-N 3.42Å; N313-M321 PolarHBondContact OD1-O 3.2Å; M321-D325 HydrophobicContact CE-CB 3.1Å; M321-F326 HydrophobicContact CE-CE2 4.48Å; M321-F326 HydrophobicContact CG-CD2 4.44Å; M321-F326 HydrophobicContact CG-CE2 3.72Å; M321-F326 HydrophobicContact CG-CZ 4.48Å; M321-F326 HydrophobicContact SD-CE2 3.93Å; M321-F326 HydrophobicContact SD-CZ 4.25Å
322	P	93.6	Very high	92.8	Very high	67 Å²	67	43.4 Å²	43.4	44%	0.435	25%	0.254	S	S	.	.			trans	-54.2	146.1	172.8	-25.6	35.2	0	0	0	112.4	T324 D325	P322-T324 WeakPolarHBondContact CB-OG1 3.49Å; P322-T324 PolarHBondContact O-N 3.43Å; P322-D325 WeakPolarHBondContact O-CB 3.16Å; P322-D325 PolarHBondContact O-N 3.07Å
323	F	91.9	Very high	92.6	Very high	45 Å²	45	50.4 Å²	50.4	20%	0.197	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-67.7	-25.9	177.8	64.6	-90.4	0	0	0	112.5	D325 F326 Y327 E641	F323-D325 PolarHBondContact O-N 3.31Å; F323-F326 WeakPolarHBondContact O-CB 3.27Å; F323-F326 PolarHBondContact O-N 2.97Å; F323-F326 VanDerWaalsContact O-N 3.08Å; F323-Y327 HydrophobicContact CD2-CE1 4.41Å; F323-Y327 AromaticContact CD2-CZ 3.95Å; F323-Y327 WeakPolarHBondContact CD2-OH 3.29Å; F323-Y327 VanDerWaalsContact CE2-OH 3.25Å; F323-Y327 WeakPolarHBondContact CE2-OH 3.31Å; F323-E641 HydrophobicContact CE1-CB 4.35Å; F323-E641 HydrophobicContact CE1-CG 4.06Å; F323-E641 HydrophobicContact CZ-CB 3.95Å; F323-E641 HydrophobicContact CZ-CG 4.18Å
324	T	92.9	Very high	92.4	Very high	66 Å²	66	51.9 Å²	51.9	41%	0.405	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-61.8	-29.3	175.9	50.2	0	0	0	0	112.3	P322 F326 Y327	P322-T324 WeakPolarHBondContact CB-OG1 3.49Å; P322-T324 PolarHBondContact O-N 3.43Å; T324-F326 PolarHBondContact O-N 3.5Å; T324-Y327 HydrophobicContact CG2-CD2 4.41Å; T324-Y327 HydrophobicContact CG2-CE2 3.87Å; T324-Y327 WeakPolarHBondContact O-CB 3.24Å; T324-Y327 WeakPolarHBondContact O-CD2 3.45Å; T324-Y327 PolarHBondContact O-N 2.98Å; T324-Y327 VanDerWaalsContact O-N 3.09Å
325	D	95.4	Very high	92.5	Very high	58 Å²	58	54.2 Å²	54.2	31%	0.31	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-70.2	-10.5	177.3	-65	5.8	0	0	0	112.3	R267 L274 M321 P322 F323	R267-D325 IonicContact CZ-OD2 2.62Å; R267-D325 IonicContact NE-OD2 3.42Å; R267-D325 PolarHBondContact NE-OD2 3.21Å; R267-D325 IonicContact NH2-OD2 3.88Å; L274-D325 WeakPolarHBondContact CD1-O 3.39Å; M321-D325 HydrophobicContact CE-CB 3.1Å; P322-D325 WeakPolarHBondContact O-CB 3.16Å; P322-D325 PolarHBondContact O-N 3.07Å; F323-D325 PolarHBondContact O-N 3.31Å
326	F	96.8	Very high	92.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-88.1	-9.7	172.3	-76.4	-95.1	0	0	0	113.4	F266 V270 L274 L306 F309 N310 N313 M321 F323 T324 F359	F266-F326 AromaticContact CE1-CZ 3.9Å; F266-F326 HydrophobicContact CE1-CZ 3.9Å; F266-F326 HydrophobicContact CZ-CZ 4.31Å; V270-F326 HydrophobicContact CG1-CD1 4.06Å; V270-F326 HydrophobicContact CG1-CE1 4.14Å; V270-F326 HydrophobicContact CG1-CG 4.45Å; V270-F326 HydrophobicContact CG2-CE1 3.83Å; V270-F326 HydrophobicContact CG2-CZ 3.99Å; L274-F326 WeakPolarHBondContact CD2-O 3.47Å; L306-F326 HydrophobicContact CD1-CD1 4.12Å; L306-F326 HydrophobicContact CD1-CE1 4.22Å; L306-F326 HydrophobicContact CG-CD1 4.46Å; F309-F326 HydrophobicContact CB-CE1 3.91Å; F309-F326 HydrophobicContact CB-CZ 4.32Å; N310-F326 HydrophobicContact CB-CD1 4.09Å; N310-F326 HydrophobicContact CB-CE1 3.86Å; N310-F326 HydrophobicContact CB-CZ 4.36Å; N313-F326 HydrophobicContact CB-CE2 4.01Å; N313-F326 HydrophobicContact CB-CZ 3.97Å; M321-F326 HydrophobicContact CE-CE2 4.48Å; M321-F326 HydrophobicContact CG-CD2 4.44Å; M321-F326 HydrophobicContact CG-CE2 3.72Å; M321-F326 HydrophobicContact CG-CZ 4.48Å; M321-F326 HydrophobicContact SD-CE2 3.93Å; M321-F326 HydrophobicContact SD-CZ 4.25Å; F323-F326 WeakPolarHBondContact O-CB 3.27Å; F323-F326 PolarHBondContact O-N 2.97Å; F323-F326 VanDerWaalsContact O-N 3.08Å; T324-F326 PolarHBondContact O-N 3.5Å; F326-F359 HydrophobicContact CB-CD2 4.05Å; F326-F359 HydrophobicContact CD1-CD2 4.04Å; F326-F359 HydrophobicContact CD1-CE2 4.24Å; F326-F359 HydrophobicContact CG-CD2 4.38Å
327	Y	96.3	Very high	92.7	Very high	32 Å²	32	53.9 Å²	53.9	13%	0.125	30%	0.297	C	S	.	.			trans	-68.6	133.5	179.7	-63.3	-24.3	0	0	0	111.3	F323 T324 F359 I360 L361 T363 E642	F323-Y327 HydrophobicContact CD2-CE1 4.41Å; F323-Y327 AromaticContact CD2-CZ 3.95Å; F323-Y327 WeakPolarHBondContact CD2-OH 3.29Å; F323-Y327 VanDerWaalsContact CE2-OH 3.25Å; F323-Y327 WeakPolarHBondContact CE2-OH 3.31Å; T324-Y327 HydrophobicContact CG2-CD2 4.41Å; T324-Y327 HydrophobicContact CG2-CE2 3.87Å; T324-Y327 WeakPolarHBondContact O-CB 3.24Å; T324-Y327 WeakPolarHBondContact O-CD2 3.45Å; T324-Y327 PolarHBondContact O-N 2.98Å; T324-Y327 VanDerWaalsContact O-N 3.09Å; Y327-F359 WeakPolarHBondContact CD1-O 3.23Å; Y327-I360 WeakPolarHBondContact CA-O 3.49Å; Y327-L361 WeakPolarHBondContact CD1-O 3.45Å; Y327-L361 WeakPolarHBondContact CE1-O 3.44Å; Y327-T363 PolarHBondContact OH-OG1 3.26Å; Y327-E642 PolarHBondContact OH-OE1 3.25Å
328	N	96.3	Very high	93	Very high	5 Å²	5	54 Å²	54	3%	0.027	29%	0.289	C	S	.	.			trans	-99.7	97.1	168.9	-168.5	-33	0	0	0	109.6	L274 S278 T330 L331 I360	L274-N328 HydrophobicContact CD2-CB 3.88Å; L274-N328 PolarHBondContact O-ND2 3.42Å; S278-N328 PolarHBondContact OG-ND2 2.92Å; S278-N328 PolarHBondContact OG-OD1 3.37Å; N328-T330 PolarHBondContact O-N 2.99Å; N328-T330 VanDerWaalsContact O-N 3.15Å; N328-T330 WeakPolarHBondContact OD1-CB 3.37Å; N328-T330 PolarHBondContact OD1-N 2.69Å; N328-T330 PolarHBondContact OD1-OG1 2.8Å; N328-L331 HydrophobicContact CB-CD1 3.86Å; N328-L331 HydrophobicContact CB-CG 3.89Å; N328-L331 VanDerWaalsContact O-CB 3.31Å; N328-L331 WeakPolarHBondContact O-CB 3.41Å; N328-L331 WeakPolarHBondContact O-CG 3.38Å; N328-L331 PolarHBondContact O-N 2.94Å; N328-I360 HydrophobicContact CB-CD1 4.1Å; N328-I360 HydrophobicContact CB-CG1 3.7Å; N328-I360 PolarHBondContact N-O 3.44Å
329	I	93	Very high	93.3	Very high	117 Å²	117	49.8 Å²	49.8	60%	0.6	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-58.8	-26.1	-179.6	60.4	170.5	0	0	0	113.5	L331 E332	I329-L331 PolarHBondContact O-N 3.19Å; I329-L331 VanDerWaalsContact O-N 3.14Å; I329-E332 VanDerWaalsContact O-CB 3.29Å; I329-E332 WeakPolarHBondContact O-CB 3.45Å; I329-E332 WeakPolarHBondContact O-CG 3.1Å; I329-E332 PolarHBondContact O-N 3.49Å
330	T	93.3	Very high	93.4	Very high	33 Å²	33	45.8 Å²	45.8	20%	0.202	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-66.6	-17.9	178.6	68.2	0	0	0	0	112.7	S278 F282 N328 E332 H333	S278-T330 WeakPolarHBondContact CB-OG1 3.32Å; S278-T330 WeakPolarHBondContact OG-CG2 3.34Å; S278-T330 PolarHBondContact OG-OG1 2.98Å; F282-T330 VanDerWaalsContact CE2-O 3.32Å; F282-T330 WeakPolarHBondContact CE2-O 3.41Å; N328-T330 PolarHBondContact O-N 2.99Å; N328-T330 VanDerWaalsContact O-N 3.15Å; N328-T330 WeakPolarHBondContact OD1-CB 3.37Å; N328-T330 PolarHBondContact OD1-N 2.69Å; N328-T330 PolarHBondContact OD1-OG1 2.8Å; T330-E332 PolarHBondContact O-N 3.14Å; T330-H333 PolarHBondContact O-N 2.86Å; T330-H333 VanDerWaalsContact O-N 3.16Å
331	L	93.4	Very high	93.2	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-70.5	-6.9	172.5	-56.4	179.6	0	0	0	112.8	L281 N328 I329 H333 I334 F354 I360 L361	L281-L331 HydrophobicContact CD1-CD2 3.46Å; L281-L331 VanDerWaalsContact CD1-CD2 3.46Å; N328-L331 HydrophobicContact CB-CD1 3.86Å; N328-L331 HydrophobicContact CB-CG 3.89Å; N328-L331 VanDerWaalsContact O-CB 3.31Å; N328-L331 WeakPolarHBondContact O-CB 3.41Å; N328-L331 WeakPolarHBondContact O-CG 3.38Å; N328-L331 PolarHBondContact O-N 2.94Å; I329-L331 PolarHBondContact O-N 3.19Å; I329-L331 VanDerWaalsContact O-N 3.14Å; L331-H333 PolarHBondContact O-N 3.34Å; L331-I334 HydrophobicContact CB-CD1 4.5Å; L331-I334 HydrophobicContact CD2-CD1 4.16Å; L331-I334 HydrophobicContact CD2-CG2 4.48Å; L331-I334 WeakPolarHBondContact O-CG1 3.39Å; L331-F354 HydrophobicContact CD1-CD1 3.98Å; L331-F354 HydrophobicContact CD1-CE1 4.3Å; L331-F354 HydrophobicContact CD1-CG 4.18Å; L331-F354 HydrophobicContact CD2-CD1 4.3Å; L331-F354 HydrophobicContact CD2-CD2 4.11Å; L331-F354 HydrophobicContact CD2-CE1 3.99Å; L331-F354 HydrophobicContact CD2-CE2 3.78Å; L331-F354 HydrophobicContact CD2-CG 4.35Å; L331-F354 HydrophobicContact CD2-CZ 3.71Å; L331-I360 HydrophobicContact CD1-CB 4.48Å; L331-I360 HydrophobicContact CD1-CD1 4.2Å; L331-I360 HydrophobicContact CD1-CG1 4.05Å; L331-I360 HydrophobicContact CD1-CG2 3.78Å; L331-L361 HydrophobicContact CD1-CD2 3.9Å
332	E	91.3	Very high	93	Very high	75 Å²	75	49.5 Å²	49.5	35%	0.35	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-69.8	-18.3	169.3	-69.5	174.9	-166.1	0	0	112.4	I329 T330 S362 V365	I329-E332 VanDerWaalsContact O-CB 3.29Å; I329-E332 WeakPolarHBondContact O-CB 3.45Å; I329-E332 WeakPolarHBondContact O-CG 3.1Å; I329-E332 PolarHBondContact O-N 3.49Å; T330-E332 PolarHBondContact O-N 3.14Å; E332-S362 WeakPolarHBondContact OE1-CB 3.43Å; E332-S362 PolarHBondContact OE1-OG 3.05Å; E332-V365 HydrophobicContact CB-CG2 4.34Å; E332-V365 HydrophobicContact CG-CG2 3.52Å
333	H	91.4	Very high	92.9	Very high	147 Å²	147	48.2 Å²	48.2	68%	0.681	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-95.1	-4.3	-179.4	-55.1	-52.7	0	0	0	114.3	F282 T330 L331	F282-H333 HydrophobicContact CE1-CB 4.28Å; F282-H333 HydrophobicContact CZ-CB 3.82Å; T330-H333 PolarHBondContact O-N 2.86Å; T330-H333 VanDerWaalsContact O-N 3.16Å; L331-H333 PolarHBondContact O-N 3.34Å
334	I	92.7	Very high	92.6	Very high	35 Å²	35	49 Å²	49	18%	0.179	24%	0.239	C	C	.	.	S	Bend	trans	-87.2	163.4	175.7	74.3	171.7	0	0	0	111	F282 L331 F336 F354	F282-I334 HydrophobicContact CE2-CG2 4.29Å; F282-I334 HydrophobicContact CZ-CG2 3.84Å; L331-I334 HydrophobicContact CB-CD1 4.5Å; L331-I334 HydrophobicContact CD2-CD1 4.16Å; L331-I334 HydrophobicContact CD2-CG2 4.48Å; L331-I334 WeakPolarHBondContact O-CG1 3.39Å; I334-F336 VanDerWaalsContact C-N 3.26Å; I334-F336 PolarHBondContact O-N 2.95Å; I334-F354 HydrophobicContact CD1-CD2 3.66Å; I334-F354 HydrophobicContact CD1-CE2 3.97Å
335	D	92.9	Very high	92.1	Very high	100 Å²	100	50.3 Å²	50.3	54%	0.535	24%	0.243	S	C	.	.			trans	-74	83.5	167.5	-168.6	-17.5	0	0	0	110.5	M337 E338 D339	D335-M337 PolarHBondContact O-N 2.98Å; D335-M337 PolarHBondContact OD1-N 3.5Å; D335-M337 VanDerWaalsContact OD1-N 3.12Å; D335-E338 HydrophobicContact CB-CB 4.07Å; D335-E338 PolarHBondContact O-N 2.58Å; D335-E338 PolarHBondContact OD1-N 3.21Å; D335-D339 PolarHBondContact O-N 3.36Å
336	F	91.3	Very high	90.6	Very high	33 Å²	33	52.3 Å²	52.3	15%	0.145	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-21.4	179.4	56.8	-100.3	0	0	0	113.3	I334 Y340 V365 A368 I369 K372	I334-F336 VanDerWaalsContact C-N 3.26Å; I334-F336 PolarHBondContact O-N 2.95Å; F336-Y340 VanDerWaalsContact O-CB 3.24Å; F336-Y340 WeakPolarHBondContact O-CB 3.43Å; F336-Y340 PolarHBondContact O-N 2.83Å; F336-V365 HydrophobicContact CB-CG1 3.73Å; F336-V365 HydrophobicContact CG-CG1 4.11Å; F336-A368 HydrophobicContact CE1-CB 4.38Å; F336-A368 HydrophobicContact CE2-CB 3.64Å; F336-A368 HydrophobicContact CZ-CB 3.53Å; F336-I369 HydrophobicContact CB-CD1 4.48Å; F336-I369 HydrophobicContact CB-CG1 4.41Å; F336-I369 HydrophobicContact CD2-CG1 3.68Å; F336-I369 HydrophobicContact CE2-CG1 4.41Å; F336-I369 HydrophobicContact CG-CG1 4.43Å; F336-K372 HydrophobicContact CE2-CD 3.89Å; F336-K372 HydrophobicContact CZ-CD 4.3Å; F336-K372 VanDerWaalsContact CZ-NZ 3.26Å
337	M	91.9	Very high	88.7	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.03	28%	0.276	C	S	.	.	H	α-helix	trans	-77.9	-35.9	175.3	-74	-52.6	-59.8	0	0	111.7	D335 Y340 R341 K372	D335-M337 PolarHBondContact O-N 2.98Å; D335-M337 PolarHBondContact OD1-N 3.5Å; D335-M337 VanDerWaalsContact OD1-N 3.12Å; M337-Y340 HydrophobicContact CE-CD1 3.9Å; M337-Y340 HydrophobicContact CE-CE1 4.49Å; M337-Y340 PolarHBondContact O-N 2.82Å; M337-R341 WeakPolarHBondContact O-CB 3.48Å; M337-R341 WeakPolarHBondContact O-CD 3.37Å; M337-R341 WeakPolarHBondContact O-CG 3.35Å; M337-R341 PolarHBondContact O-N 3.17Å; M337-K372 HydrophobicContact CE-CB 3.97Å; M337-K372 HydrophobicContact CG-CB 4.3Å; M337-K372 HydrophobicContact CG-CD 3.38Å; M337-K372 HydrophobicContact CG-CG 4.49Å; M337-K372 HydrophobicContact SD-CB 3.6Å; M337-K372 HydrophobicContact SD-CD 3.75Å; M337-K372 HydrophobicContact SD-CG 4.3Å
338	E	91.9	Very high	86.7	Confident	83 Å²	83	61 Å²	61	39%	0.388	31%	0.31	S	S	.	.	H	α-helix	trans	-67.8	-38.9	171.8	-172.5	58.2	-162.5	0	0	111.7	D335 R341 T342	D335-E338 HydrophobicContact CB-CB 4.07Å; D335-E338 PolarHBondContact O-N 2.58Å; D335-E338 PolarHBondContact OD1-N 3.21Å; E338-R341 PolarHBondContact O-N 3.44Å; E338-R341 IonicContact OE2-NH1 3.49Å; E338-T342 WeakPolarHBondContact O-CB 3.46Å; E338-T342 PolarHBondContact O-N 3.29Å; E338-T342 PolarHBondContact O-OG1 3.43Å
339	D	92.1	Very high	85	Confident	21 Å²	21	62.3 Å²	62.3	11%	0.112	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-47.3	171.9	-169.2	84.5	0	0	0	111.4	D335 R341 T342 W343 S353 F354 C355	D335-D339 PolarHBondContact O-N 3.36Å; D339-R341 PolarHBondContact O-N 2.72Å; D339-T342 WeakPolarHBondContact O-CB 3.42Å; D339-T342 PolarHBondContact O-N 2.89Å; D339-W343 PolarHBondContact O-N 3.04Å; D339-S353 VanDerWaalsContact CG-OG 3.24Å; D339-S353 PolarHBondContact O-OG 3.32Å; D339-S353 WeakPolarHBondContact OD1-CA 3.36Å; D339-S353 PolarHBondContact OD1-OG 3.24Å; D339-S353 PolarHBondContact OD2-OG 3.48Å; D339-F354 PolarHBondContact OD1-N 2.98Å; D339-F354 PolarHBondContact OD2-N 3.5Å; D339-C355 PolarHBondContact OD2-N 3.38Å; D339-C355 PolarHBondContact OD2-SG 3.46Å
340	Y	92.9	Very high	84	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-43.5	176.6	176.9	-111.3	0	0	0	112.8	F336 M337 T342 W343 Q344 I369 D373 S632 A634 L637	F336-Y340 VanDerWaalsContact O-CB 3.24Å; F336-Y340 WeakPolarHBondContact O-CB 3.43Å; F336-Y340 PolarHBondContact O-N 2.83Å; M337-Y340 HydrophobicContact CE-CD1 3.9Å; M337-Y340 HydrophobicContact CE-CE1 4.49Å; M337-Y340 PolarHBondContact O-N 2.82Å; Y340-T342 VanDerWaalsContact C-N 3.33Å; Y340-T342 PolarHBondContact O-N 3.16Å; Y340-W343 AromaticContact CD2-CE3 3.78Å; Y340-W343 HydrophobicContact CD2-CE3 3.78Å; Y340-W343 HydrophobicContact CD2-CZ3 4.09Å; Y340-W343 AromaticContact CE2-CE3 3.78Å; Y340-W343 HydrophobicContact CE2-CE3 3.78Å; Y340-W343 AromaticContact CE2-CZ3 3.64Å; Y340-W343 HydrophobicContact CE2-CZ3 3.64Å; Y340-W343 WeakPolarHBondContact O-CB 3.41Å; Y340-W343 PolarHBondContact O-N 3.25Å; Y340-Q344 HydrophobicContact CD1-CG 4.4Å; Y340-Q344 HydrophobicContact CD2-CG 4.47Å; Y340-Q344 HydrophobicContact CE1-CG 4.05Å; Y340-Q344 VanDerWaalsContact CE1-NE2 3.3Å; Y340-Q344 HydrophobicContact CE2-CG 4.12Å; Y340-Q344 VanDerWaalsContact CZ-CD 3.47Å; Y340-Q344 WeakPolarHBondContact O-CG 3.36Å; Y340-Q344 PolarHBondContact O-N 2.74Å; Y340-Q344 PolarHBondContact OH-NE2 3.49Å; Y340-I369 HydrophobicContact CD1-CG2 4.08Å; Y340-I369 HydrophobicContact CD2-CG2 3.55Å; Y340-I369 HydrophobicContact CE1-CG2 4.27Å; Y340-I369 HydrophobicContact CE2-CG2 3.76Å; Y340-I369 HydrophobicContact CG-CG2 3.72Å; Y340-D373 HydrophobicContact CE1-CB 4.16Å; Y340-D373 VanDerWaalsContact CE1-OD1 3.28Å; Y340-D373 WeakPolarHBondContact CE1-OD1 3.37Å; Y340-D373 PolarHBondContact OH-OD1 2.9Å; Y340-S632 PolarHBondContact OH-OG 3.38Å; Y340-A634 HydrophobicContact CE2-CB 4.02Å; Y340-A634 WeakPolarHBondContact OH-CB 3.32Å; Y340-A634 PolarHBondContact OH-N 3.35Å; Y340-L637 HydrophobicContact CD2-CD1 4.16Å; Y340-L637 HydrophobicContact CE2-CD1 4.31Å
341	R	90.9	Very high	83.5	Confident	96 Å²	96	71.3 Å²	71.3	36%	0.362	36%	0.355	S	S	.	.	H	α-helix	trans	-63.8	-38.9	174.6	-72.5	166.5	-173.8	156.8	1.5	112.1	M337 E338 D339 W343 Q344 N345	M337-R341 WeakPolarHBondContact O-CB 3.48Å; M337-R341 WeakPolarHBondContact O-CD 3.37Å; M337-R341 WeakPolarHBondContact O-CG 3.35Å; M337-R341 PolarHBondContact O-N 3.17Å; E338-R341 PolarHBondContact O-N 3.44Å; E338-R341 IonicContact OE2-NH1 3.49Å; D339-R341 PolarHBondContact O-N 2.72Å; R341-W343 VanDerWaalsContact C-N 3.28Å; R341-W343 PolarHBondContact O-N 3.36Å; R341-Q344 PolarHBondContact O-N 3.05Å; R341-N345 WeakPolarHBondContact O-CB 3.47Å; R341-N345 PolarHBondContact O-N 2.7Å; R341-N345 VanDerWaalsContact O-N 3.08Å; R341-N345 PolarHBondContact O-ND2 2.81Å
342	T	90.6	Very high	83.4	Confident	19 Å²	19	74 Å²	74	12%	0.117	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-42.5	175	-63.6	0	0	0	0	110.3	E338 D339 Y340 N345 Y346 R351	E338-T342 WeakPolarHBondContact O-CB 3.46Å; E338-T342 PolarHBondContact O-N 3.29Å; E338-T342 PolarHBondContact O-OG1 3.43Å; D339-T342 WeakPolarHBondContact O-CB 3.42Å; D339-T342 PolarHBondContact O-N 2.89Å; Y340-T342 VanDerWaalsContact C-N 3.33Å; Y340-T342 PolarHBondContact O-N 3.16Å; T342-N345 PolarHBondContact O-N 2.87Å; T342-Y346 PolarHBondContact O-N 2.72Å; T342-R351 HydrophobicContact CG2-CB 3.83Å
343	W	91.2	Very high	83.5	Confident	40 Å²	40	70.4 Å²	70.4	15%	0.152	35%	0.349	C	S	.	.	H	α-helix	trans	-67.9	-41.8	175.4	178.1	71	0	0	0	113.9	D339 Y340 R341 N345 Y346 S353 C355 D633 M636 L637	D339-W343 PolarHBondContact O-N 3.04Å; Y340-W343 AromaticContact CD2-CE3 3.78Å; Y340-W343 HydrophobicContact CD2-CE3 3.78Å; Y340-W343 HydrophobicContact CD2-CZ3 4.09Å; Y340-W343 AromaticContact CE2-CE3 3.78Å; Y340-W343 HydrophobicContact CE2-CE3 3.78Å; Y340-W343 AromaticContact CE2-CZ3 3.64Å; Y340-W343 HydrophobicContact CE2-CZ3 3.64Å; Y340-W343 WeakPolarHBondContact O-CB 3.41Å; Y340-W343 PolarHBondContact O-N 3.25Å; R341-W343 VanDerWaalsContact C-N 3.28Å; R341-W343 PolarHBondContact O-N 3.36Å; W343-N345 PolarHBondContact O-N 3.02Å; W343-Y346 WeakPolarHBondContact O-CB 3.1Å; W343-Y346 PolarHBondContact O-N 3.18Å; W343-Y346 VanDerWaalsContact O-N 3.08Å; W343-S353 WeakPolarHBondContact CB-OG 3.39Å; W343-C355 HydrophobicContact CB-CB 3.66Å; W343-C355 HydrophobicContact CD2-CB 3.8Å; W343-C355 HydrophobicContact CE3-CB 4.21Å; W343-C355 HydrophobicContact CG-CB 3.56Å; W343-D633 HydrophobicContact CH2-CB 3.92Å; W343-D633 VanDerWaalsContact CH2-O 3.25Å; W343-D633 WeakPolarHBondContact CH2-O 3.3Å; W343-D633 HydrophobicContact CZ3-CB 3.66Å; W343-M636 HydrophobicContact CH2-CB 4.24Å; W343-M636 HydrophobicContact CH2-CE 3.52Å; W343-M636 HydrophobicContact CZ2-CE 3.4Å; W343-M636 VanDerWaalsContact CZ2-CE 3.4Å; W343-L637 HydrophobicContact CH2-CD2 3.98Å; W343-L637 HydrophobicContact CH2-CG 4.44Å; W343-L637 HydrophobicContact CZ2-CD2 4.14Å; W343-L637 HydrophobicContact CZ3-CD2 4.22Å
344	Q	86.8	Confident	83.6	Confident	62 Å²	62	63.9 Å²	63.9	29%	0.29	32%	0.319	S	S	.	.	H	α-helix	trans	-62.1	-32.5	176.6	-74.6	-174.6	-47.9	0	0	112.6	Y340 R341 Y346	Y340-Q344 HydrophobicContact CD1-CG 4.4Å; Y340-Q344 HydrophobicContact CD2-CG 4.47Å; Y340-Q344 HydrophobicContact CE1-CG 4.05Å; Y340-Q344 VanDerWaalsContact CE1-NE2 3.3Å; Y340-Q344 HydrophobicContact CE2-CG 4.12Å; Y340-Q344 VanDerWaalsContact CZ-CD 3.47Å; Y340-Q344 WeakPolarHBondContact O-CG 3.36Å; Y340-Q344 PolarHBondContact O-N 2.74Å; Y340-Q344 PolarHBondContact OH-NE2 3.49Å; R341-Q344 PolarHBondContact O-N 3.05Å; Q344-Y346 VanDerWaalsContact C-N 3.32Å
345	N	82.1	Confident	83.7	Confident	93 Å²	93	62.2 Å²	62.2	50%	0.497	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	10.8	177.6	-66.4	-46.9	0	0	0	113.5	R341 T342 W343 G347 N348	R341-N345 WeakPolarHBondContact O-CB 3.47Å; R341-N345 PolarHBondContact O-N 2.7Å; R341-N345 VanDerWaalsContact O-N 3.08Å; R341-N345 PolarHBondContact O-ND2 2.81Å; T342-N345 PolarHBondContact O-N 2.87Å; W343-N345 PolarHBondContact O-N 3.02Å; N345-G347 PolarHBondContact O-N 2.79Å; N345-N348 PolarHBondContact O-N 2.71Å
346	Y	63.4	Low	83.6	Confident	101 Å²	101	59.8 Å²	59.8	40%	0.396	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-63.3	119.8	-177.7	-162	-105.3	0	0	0	110.5	F37 T342 W343 Q344 Q356	F37-Y346 HydrophobicContact CE2-CD1 4.36Å; F37-Y346 HydrophobicContact CE2-CE1 4.41Å; F37-Y346 HydrophobicContact CZ-CE1 4.48Å; T342-Y346 PolarHBondContact O-N 2.72Å; W343-Y346 WeakPolarHBondContact O-CB 3.1Å; W343-Y346 PolarHBondContact O-N 3.18Å; W343-Y346 VanDerWaalsContact O-N 3.08Å; Q344-Y346 VanDerWaalsContact C-N 3.32Å; Y346-Q356 PolarHBondContact OH-NE2 3.05Å
347	G	56.4	Low	83.8	Confident	59 Å²	59	59.8 Å²	59.8	61%	0.608	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	126	-32.7	-164.6	0	0	0	0	0	112.7	N345	N345-G347 PolarHBondContact O-N 2.79Å
348	N	55.5	Low	84	Confident	156 Å²	156	61 Å²	61	83%	0.834	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-7.8	171.3	-66	-17.6	0	0	0	112.6	N345	N345-N348 PolarHBondContact O-N 2.71Å
349	S	61	Low	84.2	Confident	31 Å²	31	58 Å²	58	22%	0.217	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-140.4	130.9	-175.6	174.1	0	0	0	0	110	R351	S349-R351 PolarHBondContact O-N 3.03Å; S349-R351 WeakPolarHBondContact OG-CB 3.44Å; S349-R351 VanDerWaalsContact OG-CG 3.25Å; S349-R351 WeakPolarHBondContact OG-CG 3.05Å; S349-R351 PolarHBondContact OG-N 3.41Å
350	N	70.8	Confident	84.4	Confident	170 Å²	170	57 Å²	57	91%	0.909	29%	0.285	S	S	*	.			trans	-86.3	16.9	171.5	-80.7	-2.3	0	0	0	112.4
351	R	83.9	Confident	84.5	Confident	169 Å²	169	57.1 Å²	57.1	64%	0.638	29%	0.286	S	S	*	.			trans	-78.6	139.2	-179.2	-62.5	-178.1	86	173.1	4.9	110.5	T342 S349	T342-R351 HydrophobicContact CG2-CB 3.83Å; S349-R351 PolarHBondContact O-N 3.03Å; S349-R351 WeakPolarHBondContact OG-CB 3.44Å; S349-R351 VanDerWaalsContact OG-CG 3.25Å; S349-R351 WeakPolarHBondContact OG-CG 3.05Å; S349-R351 PolarHBondContact OG-N 3.41Å
352	F	90.4	Very high	84.6	Confident	57 Å²	57	52.9 Å²	52.9	25%	0.25	27%	0.27	C	S	.	.			trans	-65.1	145.9	172.5	171.7	-96.8	0	0	0	110.8	I299 P300 T303 F354 F357	I299-F352 HydrophobicContact CG2-CD1 4.33Å; I299-F352 HydrophobicContact CG2-CE1 3.66Å; I299-F352 HydrophobicContact CG2-CZ 4.03Å; P300-F352 HydrophobicContact CB-CB 4.49Å; P300-F352 HydrophobicContact CB-CD2 3.64Å; P300-F352 HydrophobicContact CB-CE2 4.08Å; P300-F352 HydrophobicContact CB-CG 4.15Å; P300-F352 HydrophobicContact CG-CB 3.81Å; P300-F352 HydrophobicContact CG-CD1 4.34Å; P300-F352 HydrophobicContact CG-CD2 3.73Å; P300-F352 HydrophobicContact CG-CE2 4.38Å; P300-F352 HydrophobicContact CG-CG 3.69Å; T303-F352 HydrophobicContact CG2-CE2 4.39Å; T303-F352 HydrophobicContact CG2-CZ 4.08Å; F352-F354 AromaticContact CE1-CD1 3.79Å; F352-F354 HydrophobicContact CE1-CD1 3.79Å; F352-F354 HydrophobicContact CE1-CD2 4.05Å; F352-F354 AromaticContact CE1-CE1 3.71Å; F352-F354 HydrophobicContact CE1-CE1 3.71Å; F352-F354 AromaticContact CE1-CE2 3.98Å; F352-F354 HydrophobicContact CE1-CE2 3.98Å; F352-F354 AromaticContact CE1-CG 3.97Å; F352-F354 HydrophobicContact CE1-CG 3.97Å; F352-F354 AromaticContact CE1-CZ 3.82Å; F352-F354 HydrophobicContact CE1-CZ 3.82Å; F352-F354 AromaticContact CZ-CD1 3.83Å; F352-F354 HydrophobicContact CZ-CD1 3.83Å; F352-F354 AromaticContact CZ-CE1 3.91Å; F352-F354 HydrophobicContact CZ-CE1 3.91Å; F352-F354 HydrophobicContact CZ-CG 4.32Å; F352-F354 HydrophobicContact CZ-CZ 4.46Å; F352-F357 HydrophobicContact CD2-CE2 4.39Å; F352-F357 AromaticContact CE2-CD2 3.93Å; F352-F357 HydrophobicContact CE2-CD2 3.93Å; F352-F357 AromaticContact CE2-CE2 3.65Å; F352-F357 HydrophobicContact CE2-CE2 3.65Å; F352-F357 HydrophobicContact CZ-CD2 4.37Å; F352-F357 HydrophobicContact CZ-CE2 4.5Å
353	S	92.8	Very high	84.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.			trans	-142.1	140.9	170.3	154.1	0	0	0	0	110.5	D339 W343 C355 Q356	D339-S353 VanDerWaalsContact CG-OG 3.24Å; D339-S353 PolarHBondContact O-OG 3.32Å; D339-S353 WeakPolarHBondContact OD1-CA 3.36Å; D339-S353 PolarHBondContact OD1-OG 3.24Å; D339-S353 PolarHBondContact OD2-OG 3.48Å; W343-S353 WeakPolarHBondContact CB-OG 3.39Å; S353-C355 VanDerWaalsContact C-N 3.27Å; S353-C355 PolarHBondContact O-N 3.38Å; S353-C355 WeakPolarHBondContact OG-CB 3.48Å; S353-C355 PolarHBondContact OG-N 3.1Å; S353-C355 VanDerWaalsContact OG-N 3.08Å; S353-Q356 VanDerWaalsContact O-CB 3.32Å; S353-Q356 WeakPolarHBondContact O-CB 3.32Å; S353-Q356 WeakPolarHBondContact O-CG 3.47Å; S353-Q356 PolarHBondContact O-N 3.03Å
354	F	95.1	Very high	84.6	Confident	10 Å²	10	53.8 Å²	53.8	4%	0.044	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-67.9	-25.4	174.9	-68.4	-75.7	0	0	0	112.9	I277 L281 I299 L331 I334 D339 F352 Q356 F357 I360 L361	I277-F354 HydrophobicContact CG2-CE1 4.17Å; I277-F354 HydrophobicContact CG2-CZ 4.35Å; L281-F354 HydrophobicContact CD1-CE2 4.44Å; L281-F354 HydrophobicContact CD1-CZ 3.95Å; L281-F354 HydrophobicContact CD2-CE2 4.41Å; L281-F354 HydrophobicContact CD2-CZ 4.31Å; I299-F354 HydrophobicContact CG2-CE1 3.76Å; I299-F354 HydrophobicContact CG2-CZ 3.52Å; L331-F354 HydrophobicContact CD1-CD1 3.98Å; L331-F354 HydrophobicContact CD1-CE1 4.3Å; L331-F354 HydrophobicContact CD1-CG 4.18Å; L331-F354 HydrophobicContact CD2-CD1 4.3Å; L331-F354 HydrophobicContact CD2-CD2 4.11Å; L331-F354 HydrophobicContact CD2-CE1 3.99Å; L331-F354 HydrophobicContact CD2-CE2 3.78Å; L331-F354 HydrophobicContact CD2-CG 4.35Å; L331-F354 HydrophobicContact CD2-CZ 3.71Å; I334-F354 HydrophobicContact CD1-CD2 3.66Å; I334-F354 HydrophobicContact CD1-CE2 3.97Å; D339-F354 PolarHBondContact OD1-N 2.98Å; D339-F354 PolarHBondContact OD2-N 3.5Å; F352-F354 AromaticContact CE1-CD1 3.79Å; F352-F354 HydrophobicContact CE1-CD1 3.79Å; F352-F354 HydrophobicContact CE1-CD2 4.05Å; F352-F354 AromaticContact CE1-CE1 3.71Å; F352-F354 HydrophobicContact CE1-CE1 3.71Å; F352-F354 AromaticContact CE1-CE2 3.98Å; F352-F354 HydrophobicContact CE1-CE2 3.98Å; F352-F354 AromaticContact CE1-CG 3.97Å; F352-F354 HydrophobicContact CE1-CG 3.97Å; F352-F354 AromaticContact CE1-CZ 3.82Å; F352-F354 HydrophobicContact CE1-CZ 3.82Å; F352-F354 AromaticContact CZ-CD1 3.83Å; F352-F354 HydrophobicContact CZ-CD1 3.83Å; F352-F354 AromaticContact CZ-CE1 3.91Å; F352-F354 HydrophobicContact CZ-CE1 3.91Å; F352-F354 HydrophobicContact CZ-CG 4.32Å; F352-F354 HydrophobicContact CZ-CZ 4.46Å; F354-Q356 PolarHBondContact O-N 2.99Å; F354-Q356 VanDerWaalsContact O-N 3.1Å; F354-F357 CarbonylContact O-C 3.43Å; F354-F357 VanDerWaalsContact O-C 3.29Å; F354-F357 WeakPolarHBondContact O-CA 3.44Å; F354-F357 PolarHBondContact O-N 3.5Å; F354-I360 HydrophobicContact CB-CG2 4.41Å; F354-I360 HydrophobicContact CD1-CD1 4.5Å; F354-I360 HydrophobicContact CD1-CG2 4.1Å; F354-L361 HydrophobicContact CB-CD2 3.86Å
355	C	93.4	Very high	84.9	Confident	1 Å²	1	51 Å²	51	1%	0.007	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-60.7	-16.4	172.5	-64.8	0	0	0	0	113.5	D339 W343 S353 F357 P358 L637	D339-C355 PolarHBondContact OD2-N 3.38Å; D339-C355 PolarHBondContact OD2-SG 3.46Å; W343-C355 HydrophobicContact CB-CB 3.66Å; W343-C355 HydrophobicContact CD2-CB 3.8Å; W343-C355 HydrophobicContact CE3-CB 4.21Å; W343-C355 HydrophobicContact CG-CB 3.56Å; S353-C355 VanDerWaalsContact C-N 3.27Å; S353-C355 PolarHBondContact O-N 3.38Å; S353-C355 WeakPolarHBondContact OG-CB 3.48Å; S353-C355 PolarHBondContact OG-N 3.1Å; S353-C355 VanDerWaalsContact OG-N 3.08Å; C355-F357 PolarHBondContact O-N 2.86Å; C355-P358 WeakPolarHBondContact O-CG 3.36Å; C355-L637 HydrophobicContact CB-CD2 3.93Å; C355-L637 WeakPolarHBondContact O-CD2 3.39Å
356	Q	92.2	Very high	85.5	Confident	48 Å²	48	46.6 Å²	46.6	22%	0.224	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-70.6	-19.3	168.9	-61.1	177.8	-26.9	0	0	113.4	Y346 S353 F354 P358	Y346-Q356 PolarHBondContact OH-NE2 3.05Å; S353-Q356 VanDerWaalsContact O-CB 3.32Å; S353-Q356 WeakPolarHBondContact O-CB 3.32Å; S353-Q356 WeakPolarHBondContact O-CG 3.47Å; S353-Q356 PolarHBondContact O-N 3.03Å; F354-Q356 PolarHBondContact O-N 2.99Å; F354-Q356 VanDerWaalsContact O-N 3.1Å; Q356-P358 VanDerWaalsContact C-CD 3.48Å
357	F	95.1	Very high	86.9	Confident	33 Å²	33	43.8 Å²	43.8	15%	0.145	23%	0.234	C	C	.	.	S	Bend	trans	-126.5	64.5	-177.6	-59.4	-84.1	0	0	0	110.2	T303 K304 F352 F354 C355 F359 I360	T303-F357 HydrophobicContact CG2-CB 3.69Å; T303-F357 HydrophobicContact CG2-CD1 4.08Å; T303-F357 HydrophobicContact CG2-CD2 3.51Å; T303-F357 HydrophobicContact CG2-CE2 4.14Å; T303-F357 HydrophobicContact CG2-CG 3.47Å; T303-F357 VanDerWaalsContact CG2-CG 3.47Å; K304-F357 HydrophobicContact CB-CZ 4.41Å; F352-F357 HydrophobicContact CD2-CE2 4.39Å; F352-F357 AromaticContact CE2-CD2 3.93Å; F352-F357 HydrophobicContact CE2-CD2 3.93Å; F352-F357 AromaticContact CE2-CE2 3.65Å; F352-F357 HydrophobicContact CE2-CE2 3.65Å; F352-F357 HydrophobicContact CZ-CD2 4.37Å; F352-F357 HydrophobicContact CZ-CE2 4.5Å; F354-F357 CarbonylContact O-C 3.43Å; F354-F357 VanDerWaalsContact O-C 3.29Å; F354-F357 WeakPolarHBondContact O-CA 3.44Å; F354-F357 PolarHBondContact O-N 3.5Å; C355-F357 PolarHBondContact O-N 2.86Å; F357-F359 HydrophobicContact CB-CD1 4.35Å; F357-F359 HydrophobicContact CB-CE1 3.79Å; F357-F359 HydrophobicContact CB-CZ 4.22Å; F357-F359 AromaticContact CD1-CE1 3.97Å; F357-F359 HydrophobicContact CD1-CE1 3.97Å; F357-F359 HydrophobicContact CG-CE1 4.37Å; F357-F359 PolarHBondContact O-N 3.39Å; F357-I360 VanDerWaalsContact O-CG2 3.24Å; F357-I360 WeakPolarHBondContact O-CG2 3.41Å; F357-I360 PolarHBondContact O-N 2.89Å
358	P	94.9	Very high	88.6	Confident	32 Å²	32	42 Å²	42	21%	0.208	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-59.6	-20	-168.5	-22.1	31.7	0	0	0	115.2	C355 Q356 I360 L361 K366 L637	C355-P358 WeakPolarHBondContact O-CG 3.36Å; Q356-P358 VanDerWaalsContact C-CD 3.48Å; P358-I360 PolarHBondContact O-N 3.43Å; P358-L361 PolarHBondContact O-N 3.01Å; P358-K366 WeakPolarHBondContact O-CE 3.21Å; P358-K366 PolarHBondContact O-NZ 3.16Å; P358-L637 HydrophobicContact CB-CB 4.23Å; P358-L637 HydrophobicContact CB-CD2 4.23Å; P358-L637 VanDerWaalsContact CB-O 3.29Å; P358-L637 WeakPolarHBondContact CB-O 3.31Å; P358-L637 HydrophobicContact CG-CD2 3.79Å
359	F	95.9	Very high	90.4	Very high	20 Å²	20	34.6 Å²	34.6	9%	0.088	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-63	-21.2	177.7	71	-98.5	0	0	0	113.4	L306 N310 F326 Y327 F357	L306-F359 HydrophobicContact CB-CE2 4.43Å; L306-F359 HydrophobicContact CB-CZ 4.36Å; L306-F359 HydrophobicContact CD2-CE2 3.73Å; L306-F359 HydrophobicContact CD2-CZ 4.33Å; L306-F359 HydrophobicContact CG-CE2 3.67Å; L306-F359 HydrophobicContact CG-CZ 4.08Å; N310-F359 HydrophobicContact CB-CD1 3.99Å; N310-F359 HydrophobicContact CB-CD2 3.91Å; N310-F359 HydrophobicContact CB-CE1 4.2Å; N310-F359 HydrophobicContact CB-CE2 4.17Å; N310-F359 HydrophobicContact CB-CG 3.86Å; N310-F359 HydrophobicContact CB-CZ 4.31Å; F326-F359 HydrophobicContact CB-CD2 4.05Å; F326-F359 HydrophobicContact CD1-CD2 4.04Å; F326-F359 HydrophobicContact CD1-CE2 4.24Å; F326-F359 HydrophobicContact CG-CD2 4.38Å; Y327-F359 WeakPolarHBondContact CD1-O 3.23Å; F357-F359 HydrophobicContact CB-CD1 4.35Å; F357-F359 HydrophobicContact CB-CE1 3.79Å; F357-F359 HydrophobicContact CB-CZ 4.22Å; F357-F359 AromaticContact CD1-CE1 3.97Å; F357-F359 HydrophobicContact CD1-CE1 3.97Å; F357-F359 HydrophobicContact CG-CE1 4.37Å; F357-F359 PolarHBondContact O-N 3.39Å
360	I	96.5	Very high	91.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-85.7	-20.3	179.5	-157.1	176.6	0	0	0	112.5	L274 I277 T303 L306 Y327 N328 L331 F354 F357 P358	L274-I360 HydrophobicContact CD2-CD1 4.23Å; L274-I360 HydrophobicContact CD2-CG1 4.03Å; I277-I360 HydrophobicContact CD1-CD1 3.87Å; T303-I360 HydrophobicContact CG2-CD1 4.43Å; L306-I360 HydrophobicContact CD2-CD1 3.9Å; L306-I360 HydrophobicContact CD2-CG1 4.21Å; Y327-I360 WeakPolarHBondContact CA-O 3.49Å; N328-I360 HydrophobicContact CB-CD1 4.1Å; N328-I360 HydrophobicContact CB-CG1 3.7Å; N328-I360 PolarHBondContact N-O 3.44Å; L331-I360 HydrophobicContact CD1-CB 4.48Å; L331-I360 HydrophobicContact CD1-CD1 4.2Å; L331-I360 HydrophobicContact CD1-CG1 4.05Å; L331-I360 HydrophobicContact CD1-CG2 3.78Å; F354-I360 HydrophobicContact CB-CG2 4.41Å; F354-I360 HydrophobicContact CD1-CD1 4.5Å; F354-I360 HydrophobicContact CD1-CG2 4.1Å; F357-I360 VanDerWaalsContact O-CG2 3.24Å; F357-I360 WeakPolarHBondContact O-CG2 3.41Å; F357-I360 PolarHBondContact O-N 2.89Å; P358-I360 PolarHBondContact O-N 3.43Å
361	L	95.9	Very high	92.9	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.016	14%	0.138	C	C	.	.	S	Bend	trans	-81.4	131	-177.9	-59.4	179	0	0	0	109.5	Y327 L331 F354 P358 V365 K366 I369	Y327-L361 WeakPolarHBondContact CD1-O 3.45Å; Y327-L361 WeakPolarHBondContact CE1-O 3.44Å; L331-L361 HydrophobicContact CD1-CD2 3.9Å; F354-L361 HydrophobicContact CB-CD2 3.86Å; P358-L361 PolarHBondContact O-N 3.01Å; L361-V365 HydrophobicContact CD2-CG1 4.34Å; L361-K366 HydrophobicContact CB-CG 4.02Å; L361-K366 WeakPolarHBondContact O-CE 3.5Å; L361-I369 HydrophobicContact CD1-CD1 4.48Å
362	S	93.8	Very high	93.3	Very high	6 Å²	6	24.6 Å²	24.6	4%	0.042	13%	0.125	C	C	.	.			trans	-66	157.4	174.6	75.2	0	0	0	0	111.2	E332 V364 V365 K366	E332-S362 WeakPolarHBondContact OE1-CB 3.43Å; E332-S362 PolarHBondContact OE1-OG 3.05Å; S362-V364 PolarHBondContact O-N 3.29Å; S362-V365 PolarHBondContact O-N 2.88Å; S362-V365 VanDerWaalsContact O-N 3.17Å; S362-V365 PolarHBondContact OG-N 2.91Å; S362-K366 WeakPolarHBondContact O-CG 3.42Å; S362-K366 PolarHBondContact O-N 3.24Å; S362-K366 VanDerWaalsContact O-N 3.09Å
363	T	91.3	Very high	93.4	Very high	17 Å²	17	22.3 Å²	22.3	10%	0.104	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-32.1	174.6	-45.3	0	0	0	0	111.7	Y327 K366 K367 E642 M645 V704	Y327-T363 PolarHBondContact OH-OG1 3.26Å; T363-K366 PolarHBondContact O-N 3.15Å; T363-K367 WeakPolarHBondContact O-CB 3.39Å; T363-K367 PolarHBondContact O-N 2.95Å; T363-E642 HydrophobicContact CG2-CB 4.37Å; T363-E642 HydrophobicContact CG2-CG 4.26Å; T363-M645 HydrophobicContact CG2-CE 3.76Å; T363-M645 HydrophobicContact CG2-SD 4.46Å; T363-V704 HydrophobicContact CG2-CG1 3.77Å
364	V	90.1	Very high	93.4	Very high	61 Å²	61	22.7 Å²	22.7	37%	0.37	12%	0.117	S	C	.	.	H	α-helix	trans	-63	-48.5	176.5	-179.7	0	0	0	0	111	S362 K366 K367 A368	S362-V364 PolarHBondContact O-N 3.29Å; V364-K366 PolarHBondContact O-N 3.24Å; V364-K367 PolarHBondContact O-N 3.12Å; V364-A368 WeakPolarHBondContact O-CB 3.35Å; V364-A368 PolarHBondContact O-N 2.71Å
365	V	93.3	Very high	93.2	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.024	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-46	176.8	176.8	0	0	0	0	110.9	E332 F336 L361 S362 K367 A368 I369	E332-V365 HydrophobicContact CB-CG2 4.34Å; E332-V365 HydrophobicContact CG-CG2 3.52Å; F336-V365 HydrophobicContact CB-CG1 3.73Å; F336-V365 HydrophobicContact CG-CG1 4.11Å; L361-V365 HydrophobicContact CD2-CG1 4.34Å; S362-V365 PolarHBondContact O-N 2.88Å; S362-V365 VanDerWaalsContact O-N 3.17Å; S362-V365 PolarHBondContact OG-N 2.91Å; V365-K367 PolarHBondContact O-N 2.96Å; V365-A368 PolarHBondContact O-N 2.99Å; V365-A368 VanDerWaalsContact O-N 3.17Å; V365-I369 HydrophobicContact CG1-CD1 3.97Å; V365-I369 HydrophobicContact CG1-CG1 4.43Å; V365-I369 WeakPolarHBondContact O-CG1 3.26Å; V365-I369 PolarHBondContact O-N 3.41Å
366	K	94.1	Very high	93.1	Very high	1 Å²	1	30.3 Å²	30.3	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-63.7	-42.6	-179.4	-65	179	-171.9	178.9	0	112.3	P358 L361 S362 T363 V364 A368 I369 I370 L637 L638 E642	P358-K366 WeakPolarHBondContact O-CE 3.21Å; P358-K366 PolarHBondContact O-NZ 3.16Å; L361-K366 HydrophobicContact CB-CG 4.02Å; L361-K366 WeakPolarHBondContact O-CE 3.5Å; S362-K366 WeakPolarHBondContact O-CG 3.42Å; S362-K366 PolarHBondContact O-N 3.24Å; S362-K366 VanDerWaalsContact O-N 3.09Å; T363-K366 PolarHBondContact O-N 3.15Å; V364-K366 PolarHBondContact O-N 3.24Å; K366-A368 VanDerWaalsContact C-N 3.31Å; K366-A368 PolarHBondContact O-N 2.85Å; K366-I369 PolarHBondContact O-N 3.04Å; K366-I370 WeakPolarHBondContact O-CD1 3.35Å; K366-I370 WeakPolarHBondContact O-CG1 3.32Å; K366-I370 PolarHBondContact O-N 2.97Å; K366-L637 HydrophobicContact CD-CB 4.49Å; K366-L637 WeakPolarHBondContact CD-O 3.32Å; K366-L637 WeakPolarHBondContact CE-O 3.32Å; K366-L637 PolarHBondContact NZ-O 2.97Å; K366-L638 HydrophobicContact CB-CD2 3.88Å; K366-L638 HydrophobicContact CD-CD2 4.01Å; K366-E642 WeakPolarHBondContact CD-OE1 3.43Å; K366-E642 WeakPolarHBondContact CE-OE1 3.2Å; K366-E642 IonicContact NZ-OE1 2.93Å; K366-E642 PolarHBondContact NZ-OE1 3.38Å; K366-E642 IonicContact NZ-OE2 3.41Å; K366-E642 PolarHBondContact NZ-OE2 3.14Å
367	K	91.7	Very high	93	Very high	41 Å²	41	30 Å²	30	18%	0.178	15%	0.151	C	C	.	.	H	α-helix	trans	-55.3	-48.6	171.6	-177.7	-153.3	-176.6	-173.9	0	110.4	T363 V364 V365 I369 I370 Q371 L646 V704	T363-K367 WeakPolarHBondContact O-CB 3.39Å; T363-K367 PolarHBondContact O-N 2.95Å; V364-K367 PolarHBondContact O-N 3.12Å; V365-K367 PolarHBondContact O-N 2.96Å; K367-I369 PolarHBondContact O-N 3.21Å; K367-I370 PolarHBondContact O-N 3.16Å; K367-Q371 WeakPolarHBondContact O-CB 3.33Å; K367-Q371 PolarHBondContact O-N 2.78Å; K367-L646 HydrophobicContact CB-CD2 3.77Å; K367-L646 HydrophobicContact CG-CD2 3.67Å; K367-V704 HydrophobicContact CB-CG1 4.2Å; K367-V704 HydrophobicContact CD-CB 3.88Å; K367-V704 HydrophobicContact CD-CG1 3.98Å; K367-V704 WeakPolarHBondContact CD-O 3.37Å; K367-V704 WeakPolarHBondContact CE-O 3.44Å; K367-V704 HydrophobicContact CG-CB 4.47Å; K367-V704 HydrophobicContact CG-CG1 4.38Å; K367-V704 PolarHBondContact NZ-O 3.16Å
368	A	92.4	Very high	92.9	Very high	22 Å²	22	29.3 Å²	29.3	18%	0.182	15%	0.149	C	C	.	.	H	α-helix	trans	-64.2	-38.1	-178.9	0	0	0	0	0	112.7	F336 V364 V365 K366 K372	F336-A368 HydrophobicContact CE1-CB 4.38Å; F336-A368 HydrophobicContact CE2-CB 3.64Å; F336-A368 HydrophobicContact CZ-CB 3.53Å; V364-A368 WeakPolarHBondContact O-CB 3.35Å; V364-A368 PolarHBondContact O-N 2.71Å; V365-A368 PolarHBondContact O-N 2.99Å; V365-A368 VanDerWaalsContact O-N 3.17Å; K366-A368 VanDerWaalsContact C-N 3.31Å; K366-A368 PolarHBondContact O-N 2.85Å; A368-K372 WeakPolarHBondContact O-CB 3.25Å; A368-K372 WeakPolarHBondContact O-CG 3.5Å; A368-K372 PolarHBondContact O-N 3.19Å
369	I	93.9	Very high	92.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-51.1	172.3	-70.6	168.6	0	0	0	110.1	F336 Y340 L361 V365 K366 K367 Q371 K372 D373 A634 L637	F336-I369 HydrophobicContact CB-CD1 4.48Å; F336-I369 HydrophobicContact CB-CG1 4.41Å; F336-I369 HydrophobicContact CD2-CG1 3.68Å; F336-I369 HydrophobicContact CE2-CG1 4.41Å; F336-I369 HydrophobicContact CG-CG1 4.43Å; Y340-I369 HydrophobicContact CD1-CG2 4.08Å; Y340-I369 HydrophobicContact CD2-CG2 3.55Å; Y340-I369 HydrophobicContact CE1-CG2 4.27Å; Y340-I369 HydrophobicContact CE2-CG2 3.76Å; Y340-I369 HydrophobicContact CG-CG2 3.72Å; L361-I369 HydrophobicContact CD1-CD1 4.48Å; V365-I369 HydrophobicContact CG1-CD1 3.97Å; V365-I369 HydrophobicContact CG1-CG1 4.43Å; V365-I369 WeakPolarHBondContact O-CG1 3.26Å; V365-I369 PolarHBondContact O-N 3.41Å; K366-I369 PolarHBondContact O-N 3.04Å; K367-I369 PolarHBondContact O-N 3.21Å; I369-Q371 PolarHBondContact O-N 2.89Å; I369-K372 PolarHBondContact O-N 3.47Å; I369-D373 WeakPolarHBondContact O-CB 3.42Å; I369-D373 PolarHBondContact O-N 3.32Å; I369-A634 HydrophobicContact CG2-CB 4.19Å; I369-L637 HydrophobicContact CD1-CD1 4Å; I369-L637 HydrophobicContact CG2-CD1 4.04Å
370	I	92.5	Very high	92.5	Very high	13 Å²	13	33.9 Å²	33.9	7%	0.067	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-43.8	-178.1	-69.8	162.6	0	0	0	111.5	K366 K367 S374 V499 A634 L638 L646	K366-I370 WeakPolarHBondContact O-CD1 3.35Å; K366-I370 WeakPolarHBondContact O-CG1 3.32Å; K366-I370 PolarHBondContact O-N 2.97Å; K367-I370 PolarHBondContact O-N 3.16Å; I370-S374 VanDerWaalsContact O-CB 3.29Å; I370-S374 WeakPolarHBondContact O-CB 3.38Å; I370-S374 PolarHBondContact O-N 2.55Å; I370-S374 PolarHBondContact O-OG 3.16Å; I370-V499 HydrophobicContact CG2-CG1 4.26Å; I370-A634 HydrophobicContact CG1-CB 3.81Å; I370-L638 HydrophobicContact CD1-CD1 3.5Å; I370-L638 HydrophobicContact CD1-CD2 3.75Å; I370-L638 HydrophobicContact CD1-CG 3.78Å; I370-L646 HydrophobicContact CD1-CD1 3.54Å
371	Q	92	Very high	92.2	Very high	65 Å²	65	37 Å²	37	30%	0.304	19%	0.191	S	C	.	.	H	α-helix	trans	-62.5	-50.5	178.8	-177.5	178.9	-12.2	0	0	110.9	K367 I369 D373 S374 E375	K367-Q371 WeakPolarHBondContact O-CB 3.33Å; K367-Q371 PolarHBondContact O-N 2.78Å; I369-Q371 PolarHBondContact O-N 2.89Å; Q371-D373 PolarHBondContact O-N 3.27Å; Q371-S374 PolarHBondContact O-N 3.05Å; Q371-E375 WeakPolarHBondContact CG-OE1 3.42Å; Q371-E375 PolarHBondContact NE2-OE1 2.74Å; Q371-E375 VanDerWaalsContact NE2-OE1 3.11Å; Q371-E375 WeakPolarHBondContact O-CG 3.18Å; Q371-E375 PolarHBondContact O-N 2.92Å
372	K	92.3	Very high	91.9	Very high	83 Å²	83	37.5 Å²	37.5	36%	0.361	20%	0.196	S	C	.	.	H	α-helix	trans	-66.1	-37.7	179.8	-73.3	-174.5	-176.8	174.8	0	112.6	F336 M337 A368 I369 Q376	F336-K372 HydrophobicContact CE2-CD 3.89Å; F336-K372 HydrophobicContact CZ-CD 4.3Å; F336-K372 VanDerWaalsContact CZ-NZ 3.26Å; M337-K372 HydrophobicContact CE-CB 3.97Å; M337-K372 HydrophobicContact CG-CB 4.3Å; M337-K372 HydrophobicContact CG-CD 3.38Å; M337-K372 HydrophobicContact CG-CG 4.49Å; M337-K372 HydrophobicContact SD-CB 3.6Å; M337-K372 HydrophobicContact SD-CD 3.75Å; M337-K372 HydrophobicContact SD-CG 4.3Å; A368-K372 WeakPolarHBondContact O-CB 3.25Å; A368-K372 WeakPolarHBondContact O-CG 3.5Å; A368-K372 PolarHBondContact O-N 3.19Å; I369-K372 PolarHBondContact O-N 3.47Å; K372-Q376 WeakPolarHBondContact O-CB 3.49Å; K372-Q376 VanDerWaalsContact O-CG 3.27Å; K372-Q376 WeakPolarHBondContact O-CG 3.49Å; K372-Q376 PolarHBondContact O-N 3.07Å
373	D	92.3	Very high	91.7	Very high	9 Å²	9	45.3 Å²	45.3	5%	0.048	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-44.2	174	-175.8	81.9	0	0	0	110.6	Y340 I369 Q371 Q376 Q377 S632	Y340-D373 HydrophobicContact CE1-CB 4.16Å; Y340-D373 VanDerWaalsContact CE1-OD1 3.28Å; Y340-D373 WeakPolarHBondContact CE1-OD1 3.37Å; Y340-D373 PolarHBondContact OH-OD1 2.9Å; I369-D373 WeakPolarHBondContact O-CB 3.42Å; I369-D373 PolarHBondContact O-N 3.32Å; Q371-D373 PolarHBondContact O-N 3.27Å; D373-Q376 PolarHBondContact O-N 2.89Å; D373-Q377 WeakPolarHBondContact O-CG 3.48Å; D373-Q377 PolarHBondContact O-N 3.22Å; D373-Q377 PolarHBondContact OD2-NE2 3.3Å; D373-S632 WeakPolarHBondContact OD2-CB 3.4Å; D373-S632 PolarHBondContact OD2-OG 3.07Å
374	S	91.9	Very high	91.6	Very high	7 Å²	7	49.4 Å²	49.4	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-63	-46.6	176.7	-58.3	0	0	0	0	112.1	I370 Q371 Q376 Q377 M378 Y500	I370-S374 VanDerWaalsContact O-CB 3.29Å; I370-S374 WeakPolarHBondContact O-CB 3.38Å; I370-S374 PolarHBondContact O-N 2.55Å; I370-S374 PolarHBondContact O-OG 3.16Å; Q371-S374 PolarHBondContact O-N 3.05Å; S374-Q376 VanDerWaalsContact C-N 3.33Å; S374-Q376 PolarHBondContact O-N 3.23Å; S374-Q377 PolarHBondContact O-N 2.79Å; S374-M378 WeakPolarHBondContact O-CG 3.45Å; S374-M378 PolarHBondContact O-N 3.09Å; S374-Y500 VanDerWaalsContact CB-CD2 3.41Å; S374-Y500 VanDerWaalsContact CB-CE2 3.47Å; S374-Y500 WeakPolarHBondContact CB-O 3.38Å; S374-Y500 PolarHBondContact O-OH 3.24Å; S374-Y500 WeakPolarHBondContact OG-CD2 3.12Å
375	E	92	Very high	91.6	Very high	89 Å²	89	47.7 Å²	47.7	42%	0.416	24%	0.236	S	C	.	.	H	α-helix	trans	-59.7	-42.3	176.1	-73.1	171.3	-173	0	0	112	Q371 M378 I379	Q371-E375 WeakPolarHBondContact CG-OE1 3.42Å; Q371-E375 PolarHBondContact NE2-OE1 2.74Å; Q371-E375 VanDerWaalsContact NE2-OE1 3.11Å; Q371-E375 WeakPolarHBondContact O-CG 3.18Å; Q371-E375 PolarHBondContact O-N 2.92Å; E375-M378 PolarHBondContact O-N 3.17Å; E375-I379 VanDerWaalsContact O-CG1 3.32Å; E375-I379 WeakPolarHBondContact O-CG1 3.21Å; E375-I379 PolarHBondContact O-N 3.23Å
376	Q	90.9	Very high	91.3	Very high	82 Å²	82	50.4 Å²	50.4	38%	0.383	25%	0.25	S	C	.	.	H	α-helix	trans	-64.1	-42.2	175.5	-75	175	12.3	0	0	111.7	K372 D373 S374 I379 S380	K372-Q376 WeakPolarHBondContact O-CB 3.49Å; K372-Q376 VanDerWaalsContact O-CG 3.27Å; K372-Q376 WeakPolarHBondContact O-CG 3.49Å; K372-Q376 PolarHBondContact O-N 3.07Å; D373-Q376 PolarHBondContact O-N 2.89Å; S374-Q376 VanDerWaalsContact C-N 3.33Å; S374-Q376 PolarHBondContact O-N 3.23Å; Q376-I379 PolarHBondContact O-N 3.45Å; Q376-S380 VanDerWaalsContact O-CB 3.31Å; Q376-S380 WeakPolarHBondContact O-CB 3.31Å; Q376-S380 PolarHBondContact O-N 3.03Å
377	Q	91.3	Very high	91.1	Very high	41 Å²	41	54.7 Å²	54.7	19%	0.192	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-41.8	174.8	-72.3	-174	35.5	0	0	111.7	D373 S374 S380 Q381 Y500	D373-Q377 WeakPolarHBondContact O-CG 3.48Å; D373-Q377 PolarHBondContact O-N 3.22Å; D373-Q377 PolarHBondContact OD2-NE2 3.3Å; S374-Q377 PolarHBondContact O-N 2.79Å; Q377-S380 PolarHBondContact O-N 2.92Å; Q377-Q381 WeakPolarHBondContact O-CB 2.93Å; Q377-Q381 WeakPolarHBondContact O-CG 3.42Å; Q377-Q381 PolarHBondContact O-N 3.05Å; Q377-Y500 HydrophobicContact CB-CE2 4.35Å; Q377-Y500 WeakPolarHBondContact CB-OH 3.25Å
378	M	91.6	Very high	90.9	Very high	20 Å²	20	55.2 Å²	55.2	10%	0.099	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-49.3	174.7	-70.3	178.5	-170.6	0	0	112.2	S374 E375 S380 Q381 A382 K428 K430 Y500 N501	S374-M378 WeakPolarHBondContact O-CG 3.45Å; S374-M378 PolarHBondContact O-N 3.09Å; E375-M378 PolarHBondContact O-N 3.17Å; M378-S380 VanDerWaalsContact C-N 3.34Å; M378-S380 PolarHBondContact O-N 3.24Å; M378-Q381 PolarHBondContact O-N 3.34Å; M378-A382 WeakPolarHBondContact O-CB 3.24Å; M378-A382 PolarHBondContact O-N 2.82Å; M378-K428 WeakPolarHBondContact CA-O 3.34Å; M378-K428 WeakPolarHBondContact CG-O 3.39Å; M378-K430 HydrophobicContact SD-CB 4Å; M378-K430 HydrophobicContact SD-CG 4.46Å; M378-Y500 HydrophobicContact CE-CD1 3.24Å; M378-Y500 HydrophobicContact CE-CE1 3.23Å; M378-Y500 HydrophobicContact CE-CG 4.13Å; M378-Y500 VanDerWaalsContact CE-O 3.3Å; M378-Y500 WeakPolarHBondContact CE-O 3.49Å; M378-Y500 HydrophobicContact CG-CD1 4.43Å; M378-Y500 HydrophobicContact CG-CE1 3.43Å; M378-Y500 VanDerWaalsContact CG-CE1 3.43Å; M378-Y500 WeakPolarHBondContact CG-OH 3.23Å; M378-Y500 PolarHBondContact N-OH 3.14Å; M378-Y500 HydrophobicContact SD-CE1 4.17Å; M378-N501 WeakPolarHBondContact CE-OD1 3.32Å
379	I	91.1	Very high	90.6	Very high	86 Å²	86	57.6 Å²	57.6	44%	0.441	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-44.6	178.8	-68.1	166.1	0	0	0	110.2	E375 Q376 A382 R383	E375-I379 VanDerWaalsContact O-CG1 3.32Å; E375-I379 WeakPolarHBondContact O-CG1 3.21Å; E375-I379 PolarHBondContact O-N 3.23Å; Q376-I379 PolarHBondContact O-N 3.45Å; I379-A382 PolarHBondContact O-N 3.1Å; I379-R383 HydrophobicContact CG2-CG 4.43Å; I379-R383 VanDerWaalsContact CG2-CZ 3.49Å; I379-R383 WeakPolarHBondContact O-CB 3.24Å; I379-R383 VanDerWaalsContact O-CG 3.25Å; I379-R383 WeakPolarHBondContact O-CG 3.42Å; I379-R383 PolarHBondContact O-N 2.87Å
380	S	91	Very high	90.4	Very high	62 Å²	62	61.5 Å²	61.5	43%	0.434	32%	0.315	S	S	.	.	H	α-helix	trans	-60	-47.4	178.7	-173.5	0	0	0	0	111.7	Q376 Q377 M378 R383 L384	Q376-S380 VanDerWaalsContact O-CB 3.31Å; Q376-S380 WeakPolarHBondContact O-CB 3.31Å; Q376-S380 PolarHBondContact O-N 3.03Å; Q377-S380 PolarHBondContact O-N 2.92Å; M378-S380 VanDerWaalsContact C-N 3.34Å; M378-S380 PolarHBondContact O-N 3.24Å; S380-R383 PolarHBondContact O-N 2.89Å; S380-L384 WeakPolarHBondContact O-CG 3.3Å; S380-L384 PolarHBondContact O-N 3.25Å
381	Q	90.6	Very high	90.2	Very high	65 Å²	65	65.4 Å²	65.4	30%	0.304	34%	0.343	S	S	.	.	H	α-helix	trans	-67.9	-38.1	-179.9	-72.2	-67.1	11	0	0	113.5	Q377 M378 L384 S385 K428 K429	Q377-Q381 WeakPolarHBondContact O-CB 2.93Å; Q377-Q381 WeakPolarHBondContact O-CG 3.42Å; Q377-Q381 PolarHBondContact O-N 3.05Å; M378-Q381 PolarHBondContact O-N 3.34Å; Q381-L384 PolarHBondContact O-N 3.07Å; Q381-S385 WeakPolarHBondContact O-CB 3.39Å; Q381-S385 PolarHBondContact O-N 2.93Å; Q381-S385 PolarHBondContact O-OG 3.41Å; Q381-K428 HydrophobicContact CG-CB 3.99Å; Q381-K429 HydrophobicContact CB-CG 4.36Å
382	A	89.1	Confident	90.2	Very high	13 Å²	13	70.8 Å²	70.8	11%	0.107	36%	0.36	C	S	.	.	H	α-helix	trans	-62.7	-43.3	173.5	0	0	0	0	0	111.2	M378 I379 S385 L386 L401	M378-A382 WeakPolarHBondContact O-CB 3.24Å; M378-A382 PolarHBondContact O-N 2.82Å; I379-A382 PolarHBondContact O-N 3.1Å; A382-S385 PolarHBondContact O-N 3.23Å; A382-L386 WeakPolarHBondContact O-CB 3.32Å; A382-L386 PolarHBondContact O-N 3.44Å; A382-L401 HydrophobicContact CB-CB 4.27Å; A382-L401 HydrophobicContact CB-CD2 4.03Å
383	R	90.1	Very high	89.9	Confident	171 Å²	171	78.2 Å²	78.2	65%	0.645	39%	0.386	S	S	*	.	H	α-helix	trans	-62.5	-46.5	175.2	-74.3	173.1	-179.8	175.9	2	112	I379 S380 S385 L386 V387	I379-R383 HydrophobicContact CG2-CG 4.43Å; I379-R383 VanDerWaalsContact CG2-CZ 3.49Å; I379-R383 WeakPolarHBondContact O-CB 3.24Å; I379-R383 VanDerWaalsContact O-CG 3.25Å; I379-R383 WeakPolarHBondContact O-CG 3.42Å; I379-R383 PolarHBondContact O-N 2.87Å; S380-R383 PolarHBondContact O-N 2.89Å; R383-S385 VanDerWaalsContact C-N 3.31Å; R383-S385 PolarHBondContact O-N 3.05Å; R383-L386 PolarHBondContact O-N 3.39Å; R383-V387 WeakPolarHBondContact O-CB 3.18Å; R383-V387 VanDerWaalsContact O-CG2 3.32Å; R383-V387 WeakPolarHBondContact O-CG2 3.15Å; R383-V387 PolarHBondContact O-N 3.21Å
384	L	89.3	Confident	89.6	Confident	102 Å²	102	82.6 Å²	82.6	53%	0.534	41%	0.406	S	S	.	.	H	α-helix	trans	-59	-43.5	177.4	-73.7	172.1	0	0	0	111.7	S380 Q381 S388	S380-L384 WeakPolarHBondContact O-CG 3.3Å; S380-L384 PolarHBondContact O-N 3.25Å; Q381-L384 PolarHBondContact O-N 3.07Å; L384-S388 VanDerWaalsContact O-CB 3.32Å; L384-S388 WeakPolarHBondContact O-CB 3.44Å; L384-S388 PolarHBondContact O-N 2.55Å
385	S	89.4	Confident	89.1	Confident	26 Å²	26	94 Å²	94	18%	0.182	45%	0.448	C	S	.	.	H	α-helix	trans	-62.9	-42.6	176.4	-64.8	0	0	0	0	112.3	Q381 A382 R383 K389 K429	Q381-S385 WeakPolarHBondContact O-CB 3.39Å; Q381-S385 PolarHBondContact O-N 2.93Å; Q381-S385 PolarHBondContact O-OG 3.41Å; A382-S385 PolarHBondContact O-N 3.23Å; R383-S385 VanDerWaalsContact C-N 3.31Å; R383-S385 PolarHBondContact O-N 3.05Å; S385-K389 PolarHBondContact O-N 3.29Å; S385-K429 WeakPolarHBondContact OG-CE 3.43Å; S385-K429 PolarHBondContact OG-NZ 3.43Å
386	L	88.3	Confident	88.6	Confident	61 Å²	61	93 Å²	93	32%	0.319	45%	0.448	S	S	.	.	H	α-helix	trans	-63	-53	177.1	180	62.7	0	0	0	111	A382 R383 S388 K389 V390 V396 L400 L401	A382-L386 WeakPolarHBondContact O-CB 3.32Å; A382-L386 PolarHBondContact O-N 3.44Å; R383-L386 PolarHBondContact O-N 3.39Å; L386-S388 VanDerWaalsContact C-N 3.3Å; L386-S388 PolarHBondContact O-N 2.92Å; L386-K389 PolarHBondContact O-N 3.28Å; L386-V390 HydrophobicContact CD1-CG2 4.24Å; L386-V390 HydrophobicContact CG-CG2 4.48Å; L386-V390 WeakPolarHBondContact O-CG2 3.46Å; L386-V390 PolarHBondContact O-N 3.03Å; L386-V396 HydrophobicContact CD1-CB 4.47Å; L386-V396 HydrophobicContact CD1-CG1 3.37Å; L386-V396 HydrophobicContact CD1-CG2 4.2Å; L386-L400 HydrophobicContact CB-CD1 4.09Å; L386-L400 HydrophobicContact CD1-CD1 4.37Å; L386-L400 HydrophobicContact CD1-CD2 4.41Å; L386-L401 HydrophobicContact CB-CD2 4.29Å
387	V	89.1	Confident	88.2	Confident	90 Å²	90	93 Å²	93	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-56.7	-45.8	179.1	171.6	0	0	0	0	110.5	R383 K389 V390 S391	R383-V387 WeakPolarHBondContact O-CB 3.18Å; R383-V387 VanDerWaalsContact O-CG2 3.32Å; R383-V387 WeakPolarHBondContact O-CG2 3.15Å; R383-V387 PolarHBondContact O-N 3.21Å; V387-K389 VanDerWaalsContact C-N 3.35Å; V387-K389 PolarHBondContact O-N 3.05Å; V387-V390 PolarHBondContact O-N 3.26Å; V387-S391 WeakPolarHBondContact O-CB 3.3Å; V387-S391 PolarHBondContact O-N 2.83Å; V387-S391 PolarHBondContact O-OG 3.07Å; V387-S391 VanDerWaalsContact O-OG 3.04Å
388	S	87.3	Confident	87.8	Confident	52 Å²	52	97.5 Å²	97.5	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-58	-43.3	178.5	-167	0	0	0	0	112.9	L384 L386 R392	L384-S388 VanDerWaalsContact O-CB 3.32Å; L384-S388 WeakPolarHBondContact O-CB 3.44Å; L384-S388 PolarHBondContact O-N 2.55Å; L386-S388 VanDerWaalsContact C-N 3.3Å; L386-S388 PolarHBondContact O-N 2.92Å; S388-R392 VanDerWaalsContact O-CG 3.31Å; S388-R392 WeakPolarHBondContact O-CG 3.41Å; S388-R392 PolarHBondContact O-N 2.86Å
389	K	86.9	Confident	87.4	Confident	73 Å²	73	100.1 Å²	100.1	32%	0.317	49%	0.488	S	S	.	.	H	α-helix	trans	-70.3	-40.7	177.4	-79.9	-168	172.3	-174.3	0	112.9	S385 L386 V387 R392 R393 Q394 L400	S385-K389 PolarHBondContact O-N 3.29Å; L386-K389 PolarHBondContact O-N 3.28Å; V387-K389 VanDerWaalsContact C-N 3.35Å; V387-K389 PolarHBondContact O-N 3.05Å; K389-R392 CarbonylContact O-C 3.4Å; K389-R392 PolarHBondContact O-N 2.68Å; K389-R393 PolarHBondContact O-N 3.45Å; K389-Q394 PolarHBondContact O-N 2.98Å; K389-Q394 VanDerWaalsContact O-N 3.13Å; K389-L400 HydrophobicContact CD-CD2 3.91Å
390	V	88.8	Confident	87.2	Confident	82 Å²	82	96.8 Å²	96.8	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-62.8	-44.7	176.3	175	0	0	0	0	110.7	L386 V387 R392 R393 V396	L386-V390 HydrophobicContact CD1-CG2 4.24Å; L386-V390 HydrophobicContact CG-CG2 4.48Å; L386-V390 WeakPolarHBondContact O-CG2 3.46Å; L386-V390 PolarHBondContact O-N 3.03Å; V387-V390 PolarHBondContact O-N 3.26Å; V390-R392 PolarHBondContact O-N 2.84Å; V390-R393 WeakPolarHBondContact O-CA 3.4Å; V390-R393 PolarHBondContact O-N 3.39Å; V390-V396 HydrophobicContact CG2-CG2 3.87Å
391	S	89.7	Confident	87	Confident	94 Å²	94	96 Å²	96	66%	0.657	46%	0.462	S	S	*	.	H	α-helix	trans	-59.9	-30.5	176.1	-62.5	0	0	0	0	112.7	V387 R393	V387-S391 WeakPolarHBondContact O-CB 3.3Å; V387-S391 PolarHBondContact O-N 2.83Å; V387-S391 PolarHBondContact O-OG 3.07Å; V387-S391 VanDerWaalsContact O-OG 3.04Å; S391-R393 VanDerWaalsContact C-N 3.3Å
392	R	90.8	Very high	87	Confident	178 Å²	178	94.6 Å²	94.6	67%	0.672	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	5	174.6	-65.4	175.7	-170.5	-145.6	0.8	113.9	S388 K389 V390 Q394	S388-R392 VanDerWaalsContact O-CG 3.31Å; S388-R392 WeakPolarHBondContact O-CG 3.41Å; S388-R392 PolarHBondContact O-N 2.86Å; K389-R392 CarbonylContact O-C 3.4Å; K389-R392 PolarHBondContact O-N 2.68Å; V390-R392 PolarHBondContact O-N 2.84Å; R392-Q394 HydrophobicContact CB-CG 3.98Å; R392-Q394 PolarHBondContact O-N 2.89Å; R392-Q394 VanDerWaalsContact O-N 3.15Å
393	R	86.3	Confident	87.2	Confident	239 Å²	239	94 Å²	94	90%	0.902	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	30.4	-176.5	-57.5	-177.4	179.6	-179.9	-0.4	113.8	K389 V390 S391	K389-R393 PolarHBondContact O-N 3.45Å; V390-R393 WeakPolarHBondContact O-CA 3.4Å; V390-R393 PolarHBondContact O-N 3.39Å; S391-R393 VanDerWaalsContact C-N 3.3Å
394	Q	86.6	Confident	87.3	Confident	102 Å²	102	87.2 Å²	87.2	48%	0.477	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-84.4	153	178	-67.7	-179	-17.7	0	0	110.6	K389 R392 V396	K389-Q394 PolarHBondContact O-N 2.98Å; K389-Q394 VanDerWaalsContact O-N 3.13Å; R392-Q394 HydrophobicContact CB-CG 3.98Å; R392-Q394 PolarHBondContact O-N 2.89Å; R392-Q394 VanDerWaalsContact O-N 3.15Å; Q394-V396 PolarHBondContact O-N 3.3Å
395	R	80.2	Confident	87.5	Confident	245 Å²	245	82.3 Å²	82.3	93%	0.925	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-61.4	131.2	171.5	-74	-172.5	-176.8	175.2	1.6	110
396	V	81.7	Confident	87.7	Confident	68 Å²	68	87.2 Å²	87.2	41%	0.412	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-92.1	123.4	-179.7	179.5	0	0	0	0	108.3	L386 V390 Q394 L400	L386-V396 HydrophobicContact CD1-CB 4.47Å; L386-V396 HydrophobicContact CD1-CG1 3.37Å; L386-V396 HydrophobicContact CD1-CG2 4.2Å; V390-V396 HydrophobicContact CG2-CG2 3.87Å; Q394-V396 PolarHBondContact O-N 3.3Å; V396-L400 HydrophobicContact CB-CD2 4.36Å; V396-L400 HydrophobicContact CG1-CD2 3.55Å
397	D	82.8	Confident	88	Confident	84 Å²	84	84.3 Å²	84.3	45%	0.449	40%	0.403	S	S	.	.			trans	-111.1	128.3	170.9	175.3	2.3	0	0	0	108.3	N399 L400	D397-N399 PolarHBondContact O-N 3.38Å; D397-N399 PolarHBondContact OD1-N 3.28Å; D397-N399 PolarHBondContact OD1-ND2 3.5Å; D397-N399 VanDerWaalsContact OD1-ND2 3.14Å; D397-N399 PolarHBondContact OD2-ND2 3.01Å; D397-L400 WeakPolarHBondContact O-CB 3.45Å; D397-L400 WeakPolarHBondContact O-CD2 3.19Å; D397-L400 WeakPolarHBondContact O-CG 3.3Å; D397-L400 PolarHBondContact O-N 2.91Å
398	M	82.5	Confident	88.3	Confident	135 Å²	135	85.3 Å²	85.3	67%	0.665	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-55.8	-22.8	179.9	-67	-60.1	-179.6	0	0	113.4	L400 L401 F402	M398-L400 PolarHBondContact O-N 3.32Å; M398-L400 VanDerWaalsContact O-N 3.16Å; M398-L401 WeakPolarHBondContact O-CB 3.47Å; M398-L401 PolarHBondContact O-N 3.46Å; M398-L401 HydrophobicContact SD-CD1 4.1Å; M398-F402 WeakPolarHBondContact O-CD2 3.45Å
399	N	84.4	Confident	88.4	Confident	75 Å²	75	87.9 Å²	87.9	40%	0.401	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-58.2	-25.5	172.9	-65.8	-38.6	0	0	0	113.3	D397 L401 F402 N404	D397-N399 PolarHBondContact O-N 3.38Å; D397-N399 PolarHBondContact OD1-N 3.28Å; D397-N399 PolarHBondContact OD1-ND2 3.5Å; D397-N399 VanDerWaalsContact OD1-ND2 3.14Å; D397-N399 PolarHBondContact OD2-ND2 3.01Å; N399-L401 PolarHBondContact O-N 3.27Å; N399-L401 VanDerWaalsContact O-N 3.15Å; N399-F402 PolarHBondContact O-N 3.04Å; N399-F402 VanDerWaalsContact O-N 3.16Å; N399-N404 PolarHBondContact O-ND2 3.25Å
400	L	85.5	Confident	88.6	Confident	16 Å²	16	89.2 Å²	89.2	8%	0.084	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-65.2	-17.3	-179.3	76.2	97.1	0	0	0	114.1	L386 K389 V396 D397 M398 F402 K429	L386-L400 HydrophobicContact CB-CD1 4.09Å; L386-L400 HydrophobicContact CD1-CD1 4.37Å; L386-L400 HydrophobicContact CD1-CD2 4.41Å; K389-L400 HydrophobicContact CD-CD2 3.91Å; V396-L400 HydrophobicContact CB-CD2 4.36Å; V396-L400 HydrophobicContact CG1-CD2 3.55Å; D397-L400 WeakPolarHBondContact O-CB 3.45Å; D397-L400 WeakPolarHBondContact O-CD2 3.19Å; D397-L400 WeakPolarHBondContact O-CG 3.3Å; D397-L400 PolarHBondContact O-N 2.91Å; M398-L400 PolarHBondContact O-N 3.32Å; M398-L400 VanDerWaalsContact O-N 3.16Å; L400-F402 VanDerWaalsContact C-N 3.27Å; L400-K429 PolarHBondContact O-NZ 2.92Å
401	L	87	Confident	88.7	Confident	46 Å²	46	89.8 Å²	89.8	24%	0.241	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-78.8	-12.7	179.1	-57.1	177.7	0	0	0	112.7	A382 L386 M398 N399	A382-L401 HydrophobicContact CB-CB 4.27Å; A382-L401 HydrophobicContact CB-CD2 4.03Å; L386-L401 HydrophobicContact CB-CD2 4.29Å; M398-L401 WeakPolarHBondContact O-CB 3.47Å; M398-L401 PolarHBondContact O-N 3.46Å; M398-L401 HydrophobicContact SD-CD1 4.1Å; N399-L401 PolarHBondContact O-N 3.27Å; N399-L401 VanDerWaalsContact O-N 3.15Å
402	F	90.6	Very high	88.8	Confident	34 Å²	34	85.5 Å²	85.5	15%	0.149	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	152.6	-173.7	-55.8	-83.3	0	0	0	111	M398 N399 L400 N404 K430 R432	M398-F402 WeakPolarHBondContact O-CD2 3.45Å; N399-F402 PolarHBondContact O-N 3.04Å; N399-F402 VanDerWaalsContact O-N 3.16Å; L400-F402 VanDerWaalsContact C-N 3.27Å; F402-N404 PolarHBondContact O-N 2.81Å; F402-N404 PolarHBondContact O-ND2 3.31Å; F402-K430 CarbonylContact C-O 3.11Å; F402-K430 VanDerWaalsContact CA-O 3.29Å; F402-K430 WeakPolarHBondContact CA-O 3.29Å; F402-K430 WeakPolarHBondContact CB-O 3.48Å; F402-K430 HydrophobicContact CD1-CB 3.95Å; F402-K430 HydrophobicContact CD1-CD 4.5Å; F402-K430 HydrophobicContact CD1-CG 4.13Å; F402-K430 HydrophobicContact CE1-CB 4.37Å; F402-K430 HydrophobicContact CE1-CD 4.23Å; F402-K430 HydrophobicContact CE1-CG 4.37Å; F402-R432 HydrophobicContact CB-CG 4.27Å; F402-R432 HydrophobicContact CD1-CG 3.95Å; F402-R432 VanDerWaalsContact CE2-NH1 3.26Å; F402-R432 HydrophobicContact CG-CG 4.22Å
403	L	93.2	Very high	88.6	Confident	1 Å²	1	78.2 Å²	78.2	1%	0.005	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	94.5	160.3	175.5	65.2	0	0	0	107.2	I405 K423 D426 L427 K429 K430 L431 R432 L497	L403-I405 HydrophobicContact CD1-CD1 4.08Å; L403-I405 HydrophobicContact CG-CD1 4.07Å; L403-I405 HydrophobicContact CG-CG1 4.29Å; L403-K423 HydrophobicContact CD1-CB 3.79Å; L403-K423 HydrophobicContact CD1-CD 4.12Å; L403-D426 HydrophobicContact CD1-CB 3.99Å; L403-L427 HydrophobicContact CD2-CD2 4.24Å; L403-K429 HydrophobicContact CB-CB 4.16Å; L403-K430 PolarHBondContact N-O 3.42Å; L403-L431 HydrophobicContact CD2-CD1 3.95Å; L403-L431 HydrophobicContact CG-CD1 4.14Å; L403-R432 PolarHBondContact O-N 2.83Å; L403-L497 HydrophobicContact CD2-CD2 4.07Å
404	N	92.6	Very high	88.8	Confident	28 Å²	28	69.9 Å²	69.9	15%	0.15	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.6	178.4	-55.1	-75.3	0	0	0	109.3	N399 F402 K423 R432	N399-N404 PolarHBondContact O-ND2 3.25Å; F402-N404 PolarHBondContact O-N 2.81Å; F402-N404 PolarHBondContact O-ND2 3.31Å; N404-K423 PolarHBondContact O-NZ 3.14Å; N404-R432 CarbonylContact C-O 3.58Å; N404-R432 WeakPolarHBondContact CA-O 3.38Å
405	I	94.3	Very high	89.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	115.6	176.1	-59.5	-61.1	0	0	0	108.1	L403 V407 E419 L420 L431 R432 V433 T434 W450	L403-I405 HydrophobicContact CD1-CD1 4.08Å; L403-I405 HydrophobicContact CG-CD1 4.07Å; L403-I405 HydrophobicContact CG-CG1 4.29Å; I405-V407 HydrophobicContact CG2-CG1 3.7Å; I405-E419 HydrophobicContact CD1-CB 3.94Å; I405-E419 HydrophobicContact CG2-CB 4.34Å; I405-L420 HydrophobicContact CD1-CD2 4Å; I405-L431 HydrophobicContact CB-CD1 4.45Å; I405-L431 HydrophobicContact CG1-CD1 3.55Å; I405-R432 PolarHBondContact N-O 2.87Å; I405-V433 HydrophobicContact CB-CG2 4.31Å; I405-V433 CarbonylContact O-C 3.31Å; I405-V433 WeakPolarHBondContact O-CA 3.47Å; I405-T434 PolarHBondContact O-N 3.15Å; I405-W450 HydrophobicContact CG2-CZ2 4.03Å
406	K	93.7	Very high	89.8	Confident	128 Å²	128	54 Å²	54	56%	0.557	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.6	179.8	-66.1	-175.5	178.8	-176.1	0	109.8	E419 T434	K406-E419 PolarHBondContact N-OE2 3.41Å; K406-T434 WeakPolarHBondContact CA-O 3.49Å
407	V	95.3	Very high	90.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.3	-171.5	-66.3	0	0	0	0	111.5	I405 L412 D415 V433 T434 F435 V436	I405-V407 HydrophobicContact CG2-CG1 3.7Å; V407-L412 HydrophobicContact CB-CD1 4.35Å; V407-L412 HydrophobicContact CG2-CD1 4.02Å; V407-D415 HydrophobicContact CB-CB 4.05Å; V407-D415 HydrophobicContact CG1-CB 3.81Å; V407-V433 HydrophobicContact CG2-CG1 4.2Å; V407-T434 PolarHBondContact N-O 3.36Å; V407-F435 HydrophobicContact CG2-CD1 3.87Å; V407-F435 HydrophobicContact CG2-CE1 3.84Å; V407-F435 CarbonylContact O-C 3.55Å; V407-F435 VanDerWaalsContact O-CA 3.31Å; V407-F435 WeakPolarHBondContact O-CA 3.4Å; V407-V436 PolarHBondContact O-N 3.2Å
408	R	94.3	Very high	90.5	Very high	112 Å²	112	51 Å²	51	42%	0.423	26%	0.262	S	S	.	.			trans	-95.9	136.4	170.3	-66.9	164.2	-70.5	173	0.4	109.2	A410 Q411 L412 D415 V436	R408-A410 PolarHBondContact O-N 3.16Å; R408-Q411 CarbonylContact O-C 3.6Å; R408-Q411 VanDerWaalsContact O-C 3.31Å; R408-Q411 PolarHBondContact O-N 3.28Å; R408-L412 WeakPolarHBondContact O-CA 3.25Å; R408-L412 PolarHBondContact O-N 3.26Å; R408-D415 WeakPolarHBondContact CB-OD2 3.45Å; R408-D415 IonicContact CZ-OD1 3.49Å; R408-D415 IonicContact CZ-OD2 2.82Å; R408-D415 PolarHBondContact N-OD2 3.43Å; R408-D415 IonicContact NE-OD1 3.74Å; R408-D415 IonicContact NE-OD2 3.12Å; R408-D415 PolarHBondContact NE-OD2 3.45Å; R408-D415 IonicContact NH2-OD1 2.86Å; R408-D415 PolarHBondContact NH2-OD1 3.44Å; R408-D415 IonicContact NH2-OD2 2.82Å; R408-D415 PolarHBondContact NH2-OD2 2.88Å; R408-V436 HydrophobicContact CG-CB 3.82Å; R408-V436 HydrophobicContact CG-CG1 4.34Å; R408-V436 HydrophobicContact CG-CG2 4.06Å
409	R	90.4	Very high	91	Very high	105 Å²	105	45.8 Å²	45.8	40%	0.396	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-53.5	-42.1	178.1	-73	-169	-178.3	-101.5	-7.3	112.7	Q411 F435 E438 E449	R409-Q411 VanDerWaalsContact C-N 3.29Å; R409-Q411 PolarHBondContact O-N 3.47Å; R409-F435 HydrophobicContact CG-CD1 3.69Å; R409-F435 HydrophobicContact CG-CE1 4.05Å; R409-F435 HydrophobicContact CG-CG 4.44Å; R409-E438 VanDerWaalsContact CD-OE1 3.24Å; R409-E438 WeakPolarHBondContact CD-OE1 3.38Å; R409-E438 IonicContact CZ-OE1 4Å; R409-E438 IonicContact CZ-OE2 2.8Å; R409-E438 VanDerWaalsContact NE-CD 3.33Å; R409-E438 IonicContact NE-OE1 2.71Å; R409-E438 PolarHBondContact NE-OE1 3.19Å; R409-E438 IonicContact NE-OE2 2.79Å; R409-E438 PolarHBondContact NE-OE2 3.08Å; R409-E438 IonicContact NH2-OE1 3.51Å; R409-E438 IonicContact NH2-OE2 3.59Å; R409-E438 PolarHBondContact NH2-OE2 3.42Å; R409-E449 IonicContact CZ-OE1 2.7Å; R409-E449 VanDerWaalsContact CZ-OE1 3.25Å; R409-E449 IonicContact NH1-OE1 3.52Å; R409-E449 PolarHBondContact NH1-OE1 2.77Å; R409-E449 IonicContact NH2-OE1 3.57Å; R409-E449 PolarHBondContact NH2-OE1 3.27Å; R409-E449 IonicContact NH2-OE2 2.71Å; R409-E449 PolarHBondContact NH2-OE2 2.94Å
410	A	89.9	Confident	91.4	Very high	101 Å²	101	42.6 Å²	42.6	84%	0.835	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-69	-21.7	-179.5	0	0	0	0	0	114.4	R408	R408-A410 PolarHBondContact O-N 3.16Å
411	Q	91.3	Very high	91.5	Very high	95 Å²	95	45.4 Å²	45.4	44%	0.444	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-127.7	37	-178.8	-65.4	-166.6	-37.6	0	0	111.1	R408 R409 L413 S414 D415	R408-Q411 CarbonylContact O-C 3.6Å; R408-Q411 VanDerWaalsContact O-C 3.31Å; R408-Q411 PolarHBondContact O-N 3.28Å; R409-Q411 VanDerWaalsContact C-N 3.29Å; R409-Q411 PolarHBondContact O-N 3.47Å; Q411-L413 PolarHBondContact O-N 3.35Å; Q411-S414 PolarHBondContact O-N 3.35Å; Q411-D415 WeakPolarHBondContact O-CB 3.49Å; Q411-D415 PolarHBondContact O-N 3.19Å
412	L	91.1	Very high	91.6	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-52.5	-52.8	-170.5	-178.2	70.7	0	0	0	112.7	V407 R408 S416 F435 L453 L454	V407-L412 HydrophobicContact CB-CD1 4.35Å; V407-L412 HydrophobicContact CG2-CD1 4.02Å; R408-L412 WeakPolarHBondContact O-CA 3.25Å; R408-L412 PolarHBondContact O-N 3.26Å; L412-S416 VanDerWaalsContact O-CB 3.22Å; L412-S416 WeakPolarHBondContact O-CB 3.23Å; L412-S416 PolarHBondContact O-N 3.32Å; L412-S416 PolarHBondContact O-OG 3.16Å; L412-F435 HydrophobicContact CD1-CE1 3.95Å; L412-L453 HydrophobicContact CD2-CB 3.34Å; L412-L453 HydrophobicContact CD2-CD1 4.39Å; L412-L453 HydrophobicContact CD2-CG 4.5Å; L412-L454 HydrophobicContact CD2-CD2 4.02Å; L412-L454 HydrophobicContact CD2-CG 4.05Å; L412-L454 HydrophobicContact CG-CD2 3.77Å; L412-L454 HydrophobicContact CG-CG 4.08Å
413	L	87.9	Confident	91.7	Very high	26 Å²	26	52.3 Å²	52.3	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-50.9	-176.3	-173.4	67.8	0	0	0	112.2	Q411 S416 L417 L454 I458 Y463 M490	Q411-L413 PolarHBondContact O-N 3.35Å; L413-S416 PolarHBondContact O-N 3.41Å; L413-L417 HydrophobicContact CG-CD1 4.43Å; L413-L417 PolarHBondContact O-N 2.66Å; L413-L454 HydrophobicContact CD1-CD2 4.01Å; L413-I458 HydrophobicContact CD1-CD1 4.02Å; L413-I458 HydrophobicContact CD1-CG1 3.61Å; L413-Y463 HydrophobicContact CD2-CD2 4.2Å; L413-Y463 HydrophobicContact CD2-CE1 4.06Å; L413-Y463 HydrophobicContact CD2-CE2 3.54Å; L413-Y463 VanDerWaalsContact CD2-CZ 3.49Å; L413-M490 HydrophobicContact CD1-CE 3.88Å
414	S	89.9	Confident	91.4	Very high	63 Å²	63	58 Å²	58	44%	0.441	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-45.1	-179.5	-173.7	0	0	0	0	112	Q411 S416 L417 D418	Q411-S414 PolarHBondContact O-N 3.35Å; S414-S416 VanDerWaalsContact C-N 3.31Å; S414-S416 PolarHBondContact O-N 3.13Å; S414-L417 PolarHBondContact O-N 3.07Å; S414-D418 WeakPolarHBondContact O-CB 3.39Å; S414-D418 PolarHBondContact O-N 3.35Å
415	D	94.1	Very high	91	Very high	15 Å²	15	62.3 Å²	62.3	8%	0.08	31%	0.308	C	S	.	.	H	α-helix	trans	-65.2	-38.2	178.7	-73.3	-9.3	0	0	0	110.8	V407 R408 Q411 D418 E419	V407-D415 HydrophobicContact CB-CB 4.05Å; V407-D415 HydrophobicContact CG1-CB 3.81Å; R408-D415 WeakPolarHBondContact CB-OD2 3.45Å; R408-D415 IonicContact CZ-OD1 3.49Å; R408-D415 IonicContact CZ-OD2 2.82Å; R408-D415 PolarHBondContact N-OD2 3.43Å; R408-D415 IonicContact NE-OD1 3.74Å; R408-D415 IonicContact NE-OD2 3.12Å; R408-D415 PolarHBondContact NE-OD2 3.45Å; R408-D415 IonicContact NH2-OD1 2.86Å; R408-D415 PolarHBondContact NH2-OD1 3.44Å; R408-D415 IonicContact NH2-OD2 2.82Å; R408-D415 PolarHBondContact NH2-OD2 2.88Å; Q411-D415 WeakPolarHBondContact O-CB 3.49Å; Q411-D415 PolarHBondContact O-N 3.19Å; D415-D418 PolarHBondContact O-N 2.84Å; D415-E419 VanDerWaalsContact O-CB 3.31Å; D415-E419 WeakPolarHBondContact O-CB 3.38Å; D415-E419 WeakPolarHBondContact O-CG 3.44Å; D415-E419 PolarHBondContact O-N 3.47Å
416	S	93.3	Very high	90.8	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-43.7	178.1	-59.7	0	0	0	0	112.2	L412 L413 S414 E419 L420 W450	L412-S416 VanDerWaalsContact O-CB 3.22Å; L412-S416 WeakPolarHBondContact O-CB 3.23Å; L412-S416 PolarHBondContact O-N 3.32Å; L412-S416 PolarHBondContact O-OG 3.16Å; L413-S416 PolarHBondContact O-N 3.41Å; S414-S416 VanDerWaalsContact C-N 3.31Å; S414-S416 PolarHBondContact O-N 3.13Å; S416-E419 PolarHBondContact O-N 2.86Å; S416-L420 WeakPolarHBondContact O-CB 3.33Å; S416-L420 VanDerWaalsContact O-CG 3.24Å; S416-L420 WeakPolarHBondContact O-CG 3.46Å; S416-L420 PolarHBondContact O-N 2.95Å; S416-W450 PolarHBondContact OG-NE1 2.88Å
417	L	88.6	Confident	90.8	Very high	25 Å²	25	58.8 Å²	58.8	13%	0.131	30%	0.295	C	S	.	.	H	α-helix	trans	-54.4	-53.9	172.8	-84.2	166.5	0	0	0	110.4	L413 S414 E419 L420 M421 E487 M490	L413-L417 HydrophobicContact CG-CD1 4.43Å; L413-L417 PolarHBondContact O-N 2.66Å; S414-L417 PolarHBondContact O-N 3.07Å; L417-E419 PolarHBondContact O-N 2.96Å; L417-L420 PolarHBondContact O-N 2.83Å; L417-M421 VanDerWaalsContact O-CB 3.23Å; L417-M421 WeakPolarHBondContact O-CB 3.33Å; L417-M421 WeakPolarHBondContact O-CG 3.23Å; L417-M421 PolarHBondContact O-N 2.85Å; L417-E487 HydrophobicContact CD1-CG 4.26Å; L417-E487 HydrophobicContact CD2-CG 4.39Å; L417-M490 HydrophobicContact CB-SD 4.15Å; L417-M490 HydrophobicContact CD2-CB 3.45Å; L417-M490 VanDerWaalsContact CD2-CB 3.45Å; L417-M490 HydrophobicContact CD2-CE 3.74Å; L417-M490 HydrophobicContact CD2-CG 3.66Å; L417-M490 HydrophobicContact CD2-SD 3.22Å; L417-M490 WeakPolarHBondContact CD2-SD 3.4Å; L417-M490 HydrophobicContact CG-CE 3.96Å; L417-M490 HydrophobicContact CG-CG 4.38Å; L417-M490 HydrophobicContact CG-SD 3.33Å; L417-M490 WeakPolarHBondContact CG-SD 3.44Å
418	D	91	Very high	90.6	Very high	64 Å²	64	60.8 Å²	60.8	34%	0.342	30%	0.304	S	S	.	.	H	α-helix	trans	-58.8	-46.8	-179.1	-92.2	7.2	0	0	0	112.6	S414 D415 M421 R422	S414-D418 WeakPolarHBondContact O-CB 3.39Å; S414-D418 PolarHBondContact O-N 3.35Å; D415-D418 PolarHBondContact O-N 2.84Å; D418-M421 PolarHBondContact O-N 3.17Å; D418-R422 WeakPolarHBondContact O-CB 3.45Å; D418-R422 VanDerWaalsContact O-CG 3.23Å; D418-R422 WeakPolarHBondContact O-CG 3.37Å; D418-R422 PolarHBondContact O-N 3.11Å; D418-R422 IonicContact OD2-CZ 3.55Å; D418-R422 IonicContact OD2-NH1 3.32Å; D418-R422 IonicContact OD2-NH2 2.76Å; D418-R422 PolarHBondContact OD2-NH2 3.1Å
419	E	93.8	Very high	90.5	Very high	24 Å²	24	55.9 Å²	55.9	11%	0.112	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-45.9	-178.8	-75.6	-81.9	93	0	0	111.8	I405 K406 D415 S416 L417 R422 K423	I405-E419 HydrophobicContact CD1-CB 3.94Å; I405-E419 HydrophobicContact CG2-CB 4.34Å; K406-E419 PolarHBondContact N-OE2 3.41Å; D415-E419 VanDerWaalsContact O-CB 3.31Å; D415-E419 WeakPolarHBondContact O-CB 3.38Å; D415-E419 WeakPolarHBondContact O-CG 3.44Å; D415-E419 PolarHBondContact O-N 3.47Å; S416-E419 PolarHBondContact O-N 2.86Å; L417-E419 PolarHBondContact O-N 2.96Å; E419-R422 PolarHBondContact O-N 2.82Å; E419-K423 VanDerWaalsContact O-CB 3.26Å; E419-K423 WeakPolarHBondContact O-CB 3.42Å; E419-K423 WeakPolarHBondContact O-CG 3.37Å; E419-K423 PolarHBondContact O-N 2.82Å; E419-K423 IonicContact OE1-NZ 3.45Å; E419-K423 PolarHBondContact OE1-NZ 2.98Å; E419-K423 VanDerWaalsContact OE1-NZ 3.17Å; E419-K423 IonicContact OE2-NZ 3.41Å; E419-K423 PolarHBondContact OE2-NZ 2.8Å
420	L	92	Very high	90.5	Very high	8 Å²	8	56.7 Å²	56.7	4%	0.042	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-38.6	178.8	-68.7	174	0	0	0	111.8	I405 S416 L417 K423 R424 L427 W450 M490 T493 L494 L497	I405-L420 HydrophobicContact CD1-CD2 4Å; S416-L420 WeakPolarHBondContact O-CB 3.33Å; S416-L420 VanDerWaalsContact O-CG 3.24Å; S416-L420 WeakPolarHBondContact O-CG 3.46Å; S416-L420 PolarHBondContact O-N 2.95Å; L417-L420 PolarHBondContact O-N 2.83Å; L420-K423 PolarHBondContact O-N 2.74Å; L420-R424 PolarHBondContact O-N 3.14Å; L420-L427 HydrophobicContact CD2-CD2 3.79Å; L420-W450 HydrophobicContact CD1-CH2 4.45Å; L420-M490 HydrophobicContact CD1-CG 3.7Å; L420-M490 HydrophobicContact CD1-SD 4.31Å; L420-T493 HydrophobicContact CD2-CG2 4.46Å; L420-L494 HydrophobicContact CD1-CD2 3.77Å; L420-L494 HydrophobicContact CD1-CG 4.22Å; L420-L497 HydrophobicContact CD2-CD1 3.65Å
421	M	87	Confident	90.6	Very high	75 Å²	75	52.3 Å²	52.3	37%	0.369	25%	0.254	S	S	.	.	H	α-helix	trans	-66.8	-43.2	177.3	-73.4	-69.1	-74	0	0	112.4	L417 D418 K423 R424	L417-M421 VanDerWaalsContact O-CB 3.23Å; L417-M421 WeakPolarHBondContact O-CB 3.33Å; L417-M421 WeakPolarHBondContact O-CG 3.23Å; L417-M421 PolarHBondContact O-N 2.85Å; D418-M421 PolarHBondContact O-N 3.17Å; M421-K423 VanDerWaalsContact C-N 3.34Å; M421-R424 WeakPolarHBondContact O-CD 3.27Å; M421-R424 VanDerWaalsContact O-CG 3.29Å; M421-R424 WeakPolarHBondContact O-CG 3.23Å; M421-R424 PolarHBondContact SD-NE 3.49Å; M421-R424 PolarHBondContact SD-NH2 2.9Å
422	R	90.6	Very high	90.7	Very high	173 Å²	173	51.5 Å²	51.5	65%	0.653	25%	0.247	S	C	*	.	H	α-helix	trans	-69.3	-32	177.4	-71.4	174.2	-168.2	136	11.9	112.3	D418 E419	D418-R422 WeakPolarHBondContact O-CB 3.45Å; D418-R422 VanDerWaalsContact O-CG 3.23Å; D418-R422 WeakPolarHBondContact O-CG 3.37Å; D418-R422 PolarHBondContact O-N 3.11Å; D418-R422 IonicContact OD2-CZ 3.55Å; D418-R422 IonicContact OD2-NH1 3.32Å; D418-R422 IonicContact OD2-NH2 2.76Å; D418-R422 PolarHBondContact OD2-NH2 3.1Å; E419-R422 PolarHBondContact O-N 2.82Å
423	K	90.9	Very high	90.8	Very high	53 Å²	53	51.4 Å²	51.4	23%	0.23	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	27.6	-172.2	-63.8	171.5	-178.7	163.7	0	113.9	L403 N404 E419 L420 M421 C425 D426 L427	L403-K423 HydrophobicContact CD1-CB 3.79Å; L403-K423 HydrophobicContact CD1-CD 4.12Å; N404-K423 PolarHBondContact O-NZ 3.14Å; E419-K423 VanDerWaalsContact O-CB 3.26Å; E419-K423 WeakPolarHBondContact O-CB 3.42Å; E419-K423 WeakPolarHBondContact O-CG 3.37Å; E419-K423 PolarHBondContact O-N 2.82Å; E419-K423 IonicContact OE1-NZ 3.45Å; E419-K423 PolarHBondContact OE1-NZ 2.98Å; E419-K423 VanDerWaalsContact OE1-NZ 3.17Å; E419-K423 IonicContact OE2-NZ 3.41Å; E419-K423 PolarHBondContact OE2-NZ 2.8Å; L420-K423 PolarHBondContact O-N 2.74Å; M421-K423 VanDerWaalsContact C-N 3.34Å; K423-C425 PolarHBondContact O-N 3.05Å; K423-C425 VanDerWaalsContact O-N 3.11Å; K423-D426 HydrophobicContact CB-CB 4.32Å; K423-D426 WeakPolarHBondContact O-CA 3.39Å; K423-D426 PolarHBondContact O-N 3.12Å; K423-L427 PolarHBondContact O-N 3.09Å
424	R	87	Confident	91	Very high	119 Å²	119	52.7 Å²	52.7	45%	0.449	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-49.6	-38.1	179.3	-76.1	169	171.8	-150.3	-9.1	114.4	L420 M421 D426 L427	L420-R424 PolarHBondContact O-N 3.14Å; M421-R424 WeakPolarHBondContact O-CD 3.27Å; M421-R424 VanDerWaalsContact O-CG 3.29Å; M421-R424 WeakPolarHBondContact O-CG 3.23Å; M421-R424 PolarHBondContact SD-NE 3.49Å; M421-R424 PolarHBondContact SD-NH2 2.9Å; R424-D426 VanDerWaalsContact C-N 3.28Å; R424-D426 PolarHBondContact O-N 3.32Å; R424-L427 WeakPolarHBondContact O-CG 3.43Å
425	C	85.8	Confident	91.2	Very high	119 Å²	119	49.8 Å²	49.8	80%	0.804	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-74	-18.4	178.8	-59.1	0	0	0	0	113.8	K423	K423-C425 PolarHBondContact O-N 3.05Å; K423-C425 VanDerWaalsContact O-N 3.11Å
426	D	89.9	Confident	91.1	Very high	49 Å²	49	53.3 Å²	53.3	26%	0.262	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-100.6	-1.4	-176.3	-73.8	-17.8	0	0	0	112.6	L403 K423 R424 K428 K429	L403-D426 HydrophobicContact CD1-CB 3.99Å; K423-D426 HydrophobicContact CB-CB 4.32Å; K423-D426 WeakPolarHBondContact O-CA 3.39Å; K423-D426 PolarHBondContact O-N 3.12Å; R424-D426 VanDerWaalsContact C-N 3.28Å; R424-D426 PolarHBondContact O-N 3.32Å; D426-K428 PolarHBondContact O-N 3.22Å; D426-K429 HydrophobicContact CB-CD 4Å; D426-K429 VanDerWaalsContact CG-NZ 3.28Å; D426-K429 WeakPolarHBondContact O-CB 3.21Å; D426-K429 PolarHBondContact O-N 3.47Å; D426-K429 WeakPolarHBondContact OD1-CE 3.14Å; D426-K429 IonicContact OD1-NZ 3.1Å; D426-K429 PolarHBondContact OD1-NZ 3.37Å; D426-K429 IonicContact OD2-NZ 3.6Å
427	L	92	Very high	90.8	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.031	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.6	-177	-69.6	176.7	0	0	0	114	L403 L420 K423 R424 T493 L497 V629	L403-L427 HydrophobicContact CD2-CD2 4.24Å; L420-L427 HydrophobicContact CD2-CD2 3.79Å; K423-L427 PolarHBondContact O-N 3.09Å; R424-L427 WeakPolarHBondContact O-CG 3.43Å; L427-T493 HydrophobicContact CD1-CG2 3.88Å; L427-T493 HydrophobicContact CD2-CG2 3.87Å; L427-L497 HydrophobicContact CD2-CD1 4.49Å; L427-L497 WeakPolarHBondContact O-CD2 3.17Å; L427-V629 HydrophobicContact CB-CG2 4.26Å; L427-V629 HydrophobicContact CD1-CG2 4.33Å
428	K	91.9	Very high	90.7	Very high	42 Å²	42	60 Å²	60	18%	0.183	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	5	179.1	-70	-166.6	171.4	-155.4	0	114.1	M378 Q381 D426 Y500 V629 A631	M378-K428 WeakPolarHBondContact CA-O 3.34Å; M378-K428 WeakPolarHBondContact CG-O 3.39Å; Q381-K428 HydrophobicContact CG-CB 3.99Å; D426-K428 PolarHBondContact O-N 3.22Å; K428-Y500 HydrophobicContact CB-CE1 4.43Å; K428-Y500 WeakPolarHBondContact O-CE1 3.46Å; K428-Y500 PolarHBondContact O-OH 3.11Å; K428-V629 VanDerWaalsContact CE-O 3.26Å; K428-V629 WeakPolarHBondContact CE-O 3.07Å; K428-A631 PolarHBondContact NZ-O 2.98Å; K428-A631 VanDerWaalsContact NZ-O 3.14Å
429	K	92.3	Very high	90.1	Very high	8 Å²	8	62.4 Å²	62.4	4%	0.035	34%	0.339	C	S	.	.	S	Bend	trans	-84.9	165.6	171.5	-64.9	177.7	-179.2	172.2	0	110.9	Q381 S385 L400 L403 D426 L431	Q381-K429 HydrophobicContact CB-CG 4.36Å; S385-K429 WeakPolarHBondContact OG-CE 3.43Å; S385-K429 PolarHBondContact OG-NZ 3.43Å; L400-K429 PolarHBondContact O-NZ 2.92Å; L403-K429 HydrophobicContact CB-CB 4.16Å; D426-K429 HydrophobicContact CB-CD 4Å; D426-K429 VanDerWaalsContact CG-NZ 3.28Å; D426-K429 WeakPolarHBondContact O-CB 3.21Å; D426-K429 PolarHBondContact O-N 3.47Å; D426-K429 WeakPolarHBondContact OD1-CE 3.14Å; D426-K429 IonicContact OD1-NZ 3.1Å; D426-K429 PolarHBondContact OD1-NZ 3.37Å; D426-K429 IonicContact OD2-NZ 3.6Å; K429-L431 PolarHBondContact O-N 2.86Å
430	K	90.4	Very high	89.3	Confident	123 Å²	123	63.4 Å²	63.4	54%	0.535	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	124.6	175.9	-178.5	162	-175.7	165.2	0	110.4	M378 F402 L403	M378-K430 HydrophobicContact SD-CB 4Å; M378-K430 HydrophobicContact SD-CG 4.46Å; F402-K430 CarbonylContact C-O 3.11Å; F402-K430 VanDerWaalsContact CA-O 3.29Å; F402-K430 WeakPolarHBondContact CA-O 3.29Å; F402-K430 WeakPolarHBondContact CB-O 3.48Å; F402-K430 HydrophobicContact CD1-CB 3.95Å; F402-K430 HydrophobicContact CD1-CD 4.5Å; F402-K430 HydrophobicContact CD1-CG 4.13Å; F402-K430 HydrophobicContact CE1-CB 4.37Å; F402-K430 HydrophobicContact CE1-CD 4.23Å; F402-K430 HydrophobicContact CE1-CG 4.37Å; L403-K430 PolarHBondContact N-O 3.42Å
431	L	92.7	Very high	88.7	Confident	9 Å²	9	69.4 Å²	69.4	5%	0.047	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	139.9	-178.1	179.6	61.4	0	0	0	111.4	L403 I405 K429 V433 T447 W450 F451	L403-L431 HydrophobicContact CD2-CD1 3.95Å; L403-L431 HydrophobicContact CG-CD1 4.14Å; I405-L431 HydrophobicContact CB-CD1 4.45Å; I405-L431 HydrophobicContact CG1-CD1 3.55Å; K429-L431 PolarHBondContact O-N 2.86Å; L431-V433 HydrophobicContact CD1-CG2 4.32Å; L431-V433 HydrophobicContact CG-CG2 4.41Å; L431-T447 HydrophobicContact CD2-CG2 3.58Å; L431-T447 HydrophobicContact CG-CG2 4.12Å; L431-W450 HydrophobicContact CD2-CE3 4.45Å; L431-W450 HydrophobicContact CD2-CZ3 4.01Å; L431-F451 HydrophobicContact CD2-CE2 3.71Å; L431-F451 HydrophobicContact CD2-CZ 4.03Å
432	R	92	Very high	88.5	Confident	78 Å²	78	66.7 Å²	66.7	29%	0.294	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	130.6	168.8	-75.3	-173.6	170	176.9	-3.2	109.4	F402 L403 N404 I405	F402-R432 HydrophobicContact CB-CG 4.27Å; F402-R432 HydrophobicContact CD1-CG 3.95Å; F402-R432 VanDerWaalsContact CE2-NH1 3.26Å; F402-R432 HydrophobicContact CG-CG 4.22Å; L403-R432 PolarHBondContact O-N 2.83Å; N404-R432 CarbonylContact C-O 3.58Å; N404-R432 WeakPolarHBondContact CA-O 3.38Å; I405-R432 PolarHBondContact N-O 2.87Å
433	V	93.4	Very high	87.9	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	144.1	178.5	-177.1	0	0	0	0	110.9	I405 V407 L431 F435 D442 W450	I405-V433 HydrophobicContact CB-CG2 4.31Å; I405-V433 CarbonylContact O-C 3.31Å; I405-V433 WeakPolarHBondContact O-CA 3.47Å; V407-V433 HydrophobicContact CG2-CG1 4.2Å; L431-V433 HydrophobicContact CD1-CG2 4.32Å; L431-V433 HydrophobicContact CG-CG2 4.41Å; V433-F435 HydrophobicContact CG1-CE2 4.47Å; V433-D442 PolarHBondContact N-OD2 2.86Å; V433-D442 WeakPolarHBondContact O-CB 3.42Å; V433-W450 HydrophobicContact CB-CB 4.35Å; V433-W450 HydrophobicContact CG1-CB 3.85Å; V433-W450 HydrophobicContact CG1-CG 3.91Å; V433-W450 HydrophobicContact CG2-CB 4.03Å; V433-W450 HydrophobicContact CG2-CD2 3.94Å; V433-W450 HydrophobicContact CG2-CE3 4.01Å; V433-W450 HydrophobicContact CG2-CG 3.97Å
434	T	93	Very high	87.5	Confident	53 Å²	53	65.7 Å²	65.7	33%	0.325	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	123.7	173.1	-53.1	0	0	0	0	109.9	I405 K406 V407	I405-T434 PolarHBondContact O-N 3.15Å; K406-T434 WeakPolarHBondContact CA-O 3.49Å; V407-T434 PolarHBondContact N-O 3.36Å
435	F	93	Very high	87.3	Confident	3 Å²	3	60.6 Å²	60.6	1%	0.013	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.1	170.2	-69.9	-79.2	0	0	0	109.9	V407 R409 L412 V433 G437 E438 L446 W450 L453	V407-F435 HydrophobicContact CG2-CD1 3.87Å; V407-F435 HydrophobicContact CG2-CE1 3.84Å; V407-F435 CarbonylContact O-C 3.55Å; V407-F435 VanDerWaalsContact O-CA 3.31Å; V407-F435 WeakPolarHBondContact O-CA 3.4Å; R409-F435 HydrophobicContact CG-CD1 3.69Å; R409-F435 HydrophobicContact CG-CE1 4.05Å; R409-F435 HydrophobicContact CG-CG 4.44Å; L412-F435 HydrophobicContact CD1-CE1 3.95Å; V433-F435 HydrophobicContact CG1-CE2 4.47Å; F435-G437 PolarHBondContact O-N 3.31Å; F435-E438 HydrophobicContact CB-CB 4.06Å; F435-E438 HydrophobicContact CB-CG 4.2Å; F435-E438 PolarHBondContact O-N 3.25Å; F435-L446 HydrophobicContact CD2-CD2 4.33Å; F435-W450 HydrophobicContact CZ-CB 4.29Å; F435-L453 HydrophobicContact CZ-CD1 4.33Å
436	V	92.1	Very high	87.4	Confident	88 Å²	88	56.5 Å²	56.5	53%	0.533	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	125.1	-177.1	177.9	0	0	0	0	109.7	V407 R408	V407-V436 PolarHBondContact O-N 3.2Å; R408-V436 HydrophobicContact CG-CB 3.82Å; R408-V436 HydrophobicContact CG-CG1 4.34Å; R408-V436 HydrophobicContact CG-CG2 4.06Å
437	G	87.4	Confident	87.5	Confident	86 Å²	86	54.5 Å²	54.5	89%	0.887	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	-2.3	-179	0	0	0	0	0	114.6	F435	F435-G437 PolarHBondContact O-N 3.31Å
438	E	86.6	Confident	87.2	Confident	79 Å²	79	57 Å²	57	37%	0.369	35%	0.345	S	S	.	.			trans	-106.6	135.6	178.4	-71.6	169.5	-134.2	0	0	111.2	R409 F435 G440	R409-E438 VanDerWaalsContact CD-OE1 3.24Å; R409-E438 WeakPolarHBondContact CD-OE1 3.38Å; R409-E438 IonicContact CZ-OE1 4Å; R409-E438 IonicContact CZ-OE2 2.8Å; R409-E438 VanDerWaalsContact NE-CD 3.33Å; R409-E438 IonicContact NE-OE1 2.71Å; R409-E438 PolarHBondContact NE-OE1 3.19Å; R409-E438 IonicContact NE-OE2 2.79Å; R409-E438 PolarHBondContact NE-OE2 3.08Å; R409-E438 IonicContact NH2-OE1 3.51Å; R409-E438 IonicContact NH2-OE2 3.59Å; R409-E438 PolarHBondContact NH2-OE2 3.42Å; F435-E438 HydrophobicContact CB-CB 4.06Å; F435-E438 HydrophobicContact CB-CG 4.2Å; F435-E438 PolarHBondContact O-N 3.25Å; E438-G440 PolarHBondContact O-N 2.98Å
439	A	78.1	Confident	87	Confident	115 Å²	115	56.7 Å²	56.7	95%	0.95	34%	0.344	S	S	*	.			trans	-81	116.4	172.6	0	0	0	0	0	109.4
440	G	76.1	Confident	87	Confident	46 Å²	46	56.3 Å²	56.3	47%	0.474	34%	0.343	S	S	.	.			trans	-174.5	135.5	176.4	0	0	0	0	0	112.7	E438	E438-G440 PolarHBondContact O-N 2.98Å
441	L	80.1	Confident	87	Confident	133 Å²	133	50.7 Å²	50.7	70%	0.696	32%	0.318	S	S	*	.			trans	-95	123.7	167.5	-177.1	69.6	0	0	0	108.3	M443	L441-M443 HydrophobicContact CD2-SD 4.04Å; L441-M443 HydrophobicContact CG-SD 4.41Å; L441-M443 PolarHBondContact O-N 3.46Å
442	D	82.1	Confident	86.7	Confident	18 Å²	18	51.6 Å²	51.6	10%	0.096	32%	0.323	C	S	.	.			trans	-73.5	101.3	-179.8	-170	13.6	0	0	0	111.7	V433 G444 L446 T447	V433-D442 PolarHBondContact N-OD2 2.86Å; V433-D442 WeakPolarHBondContact O-CB 3.42Å; D442-G444 VanDerWaalsContact C-N 3.33Å; D442-G444 WeakPolarHBondContact OD1-CA 3.15Å; D442-G444 PolarHBondContact OD1-N 2.75Å; D442-L446 HydrophobicContact CB-CB 4.17Å; D442-L446 HydrophobicContact CB-CD1 4.17Å; D442-L446 HydrophobicContact CB-CG 4.42Å; D442-L446 PolarHBondContact OD1-N 2.97Å; D442-T447 PolarHBondContact OD1-N 3.05Å; D442-T447 PolarHBondContact OD2-OG1 2.75Å
443	M	79.6	Confident	86.5	Confident	168 Å²	168	50.1 Å²	50.1	83%	0.828	32%	0.32	S	S	*	.	S	Bend	trans	-97.3	17.6	170	-62.6	-60.3	-66.6	0	0	111.9	L441	L441-M443 HydrophobicContact CD2-SD 4.04Å; L441-M443 HydrophobicContact CG-SD 4.41Å; L441-M443 PolarHBondContact O-N 3.46Å
444	G	81.5	Confident	86.4	Confident	38 Å²	38	50.1 Å²	50.1	39%	0.392	32%	0.32	S	S	.	.	S	Bend	trans	113.7	-26.5	-178.6	0	0	0	0	0	113.4	D442 T447 K448	D442-G444 VanDerWaalsContact C-N 3.33Å; D442-G444 WeakPolarHBondContact OD1-CA 3.15Å; D442-G444 PolarHBondContact OD1-N 2.75Å; G444-T447 PolarHBondContact O-N 3.36Å; G444-K448 WeakPolarHBondContact O-CB 3.07Å; G444-K448 PolarHBondContact O-N 2.87Å
445	G	82.7	Confident	86.2	Confident	11 Å²	11	48.2 Å²	48.2	11%	0.113	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-44.4	-178.7	0	0	0	0	0	113.5	K448 E449	G445-K448 PolarHBondContact O-N 3.43Å; G445-E449 WeakPolarHBondContact O-CB 3.11Å; G445-E449 PolarHBondContact O-N 2.96Å
446	L	89.4	Confident	85.9	Confident	34 Å²	34	54.1 Å²	54.1	18%	0.178	33%	0.331	C	S	.	.	H	α-helix	trans	-69.8	-37.7	179.2	-58	-177.1	0	0	0	111	F435 D442 E449 W450	F435-L446 HydrophobicContact CD2-CD2 4.33Å; D442-L446 HydrophobicContact CB-CB 4.17Å; D442-L446 HydrophobicContact CB-CD1 4.17Å; D442-L446 HydrophobicContact CB-CG 4.42Å; D442-L446 PolarHBondContact OD1-N 2.97Å; L446-E449 PolarHBondContact O-N 3.38Å; L446-W450 WeakPolarHBondContact O-CB 3.3Å; L446-W450 PolarHBondContact O-N 3.33Å
447	T	90.6	Very high	85.7	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.043	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-45.8	172.1	-71.6	0	0	0	0	111.4	L431 D442 G444 W450 F451 I503	L431-T447 HydrophobicContact CD2-CG2 3.58Å; L431-T447 HydrophobicContact CG-CG2 4.12Å; D442-T447 PolarHBondContact OD1-N 3.05Å; D442-T447 PolarHBondContact OD2-OG1 2.75Å; G444-T447 PolarHBondContact O-N 3.36Å; T447-W450 PolarHBondContact O-N 2.7Å; T447-F451 HydrophobicContact CG2-CD2 3.92Å; T447-F451 HydrophobicContact CG2-CE2 3.79Å; T447-F451 VanDerWaalsContact O-CD2 3.32Å; T447-F451 WeakPolarHBondContact O-CD2 3.22Å; T447-F451 PolarHBondContact O-N 3.44Å; T447-F451 VanDerWaalsContact O-N 3.13Å; T447-I503 HydrophobicContact CG2-CD1 3.47Å; T447-I503 VanDerWaalsContact CG2-CD1 3.47Å
448	K	85.9	Confident	85.8	Confident	57 Å²	57	49.7 Å²	49.7	25%	0.248	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-44	178.2	-170.6	-178	177.2	-161.1	0	111.5	G444 G445 F451 L452 T697 T729 N732	G444-K448 WeakPolarHBondContact O-CB 3.07Å; G444-K448 PolarHBondContact O-N 2.87Å; G445-K448 PolarHBondContact O-N 3.43Å; K448-F451 PolarHBondContact O-N 2.73Å; K448-L452 PolarHBondContact O-N 2.81Å; K448-T697 PolarHBondContact NZ-O 2.87Å; K448-T729 PolarHBondContact NZ-O 3.48Å; K448-N732 PolarHBondContact NZ-OD1 2.95Å
449	E	86.9	Confident	85.8	Confident	37 Å²	37	46.9 Å²	46.9	17%	0.173	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-45.1	176.3	-171.8	178.2	-174.5	0	0	111.7	R409 G445 L446 F451 L452 L453	R409-E449 IonicContact CZ-OE1 2.7Å; R409-E449 VanDerWaalsContact CZ-OE1 3.25Å; R409-E449 IonicContact NH1-OE1 3.52Å; R409-E449 PolarHBondContact NH1-OE1 2.77Å; R409-E449 IonicContact NH2-OE1 3.57Å; R409-E449 PolarHBondContact NH2-OE1 3.27Å; R409-E449 IonicContact NH2-OE2 2.71Å; R409-E449 PolarHBondContact NH2-OE2 2.94Å; G445-E449 WeakPolarHBondContact O-CB 3.11Å; G445-E449 PolarHBondContact O-N 2.96Å; L446-E449 PolarHBondContact O-N 3.38Å; E449-F451 PolarHBondContact O-N 2.57Å; E449-L452 PolarHBondContact O-N 3.45Å; E449-L453 HydrophobicContact CG-CD1 3.94Å; E449-L453 HydrophobicContact CG-CG 4.26Å; E449-L453 WeakPolarHBondContact O-CG 3.4Å; E449-L453 PolarHBondContact O-N 2.94Å
450	W	92.3	Very high	86.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-46	178.3	174	74.8	0	0	0	112.8	I405 S416 L420 L431 V433 F435 L446 T447 L454 L494 L497	I405-W450 HydrophobicContact CG2-CZ2 4.03Å; S416-W450 PolarHBondContact OG-NE1 2.88Å; L420-W450 HydrophobicContact CD1-CH2 4.45Å; L431-W450 HydrophobicContact CD2-CE3 4.45Å; L431-W450 HydrophobicContact CD2-CZ3 4.01Å; V433-W450 HydrophobicContact CB-CB 4.35Å; V433-W450 HydrophobicContact CG1-CB 3.85Å; V433-W450 HydrophobicContact CG1-CG 3.91Å; V433-W450 HydrophobicContact CG2-CB 4.03Å; V433-W450 HydrophobicContact CG2-CD2 3.94Å; V433-W450 HydrophobicContact CG2-CE3 4.01Å; V433-W450 HydrophobicContact CG2-CG 3.97Å; F435-W450 HydrophobicContact CZ-CB 4.29Å; L446-W450 WeakPolarHBondContact O-CB 3.3Å; L446-W450 PolarHBondContact O-N 3.33Å; T447-W450 PolarHBondContact O-N 2.7Å; W450-L454 HydrophobicContact CD2-CD1 3.85Å; W450-L454 HydrophobicContact CE3-CD1 4.44Å; W450-L454 HydrophobicContact CG-CD1 4.34Å; W450-L454 HydrophobicContact CH2-CD1 4.07Å; W450-L454 HydrophobicContact CZ2-CD1 3.38Å; W450-L454 WeakPolarHBondContact O-CB 3.45Å; W450-L454 WeakPolarHBondContact O-CG 3.5Å; W450-L454 PolarHBondContact O-N 2.83Å; W450-L494 HydrophobicContact CH2-CD2 3.28Å; W450-L494 HydrophobicContact CZ2-CD2 3.82Å; W450-L494 HydrophobicContact CZ3-CD2 3.93Å; W450-L497 HydrophobicContact CH2-CD1 4.48Å
451	F	91.2	Very high	86.1	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.018	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-46.4	174	-83.8	-67.8	0	0	0	112.1	L431 T447 K448 E449 L453 L454 V455 L494 L497 A498 I503 L505	L431-F451 HydrophobicContact CD2-CE2 3.71Å; L431-F451 HydrophobicContact CD2-CZ 4.03Å; T447-F451 HydrophobicContact CG2-CD2 3.92Å; T447-F451 HydrophobicContact CG2-CE2 3.79Å; T447-F451 VanDerWaalsContact O-CD2 3.32Å; T447-F451 WeakPolarHBondContact O-CD2 3.22Å; T447-F451 PolarHBondContact O-N 3.44Å; T447-F451 VanDerWaalsContact O-N 3.13Å; K448-F451 PolarHBondContact O-N 2.73Å; E449-F451 PolarHBondContact O-N 2.57Å; F451-L453 PolarHBondContact O-N 3.36Å; F451-L454 PolarHBondContact O-N 3.28Å; F451-V455 WeakPolarHBondContact O-CB 3.33Å; F451-V455 VanDerWaalsContact O-CG2 3.3Å; F451-V455 WeakPolarHBondContact O-CG2 3.25Å; F451-V455 PolarHBondContact O-N 2.74Å; F451-L494 HydrophobicContact CE1-CB 4.44Å; F451-L494 HydrophobicContact CE1-CD2 4.22Å; F451-L494 WeakPolarHBondContact CE1-O 3.25Å; F451-L497 HydrophobicContact CE1-CB 4.38Å; F451-L497 HydrophobicContact CZ-CB 3.86Å; F451-A498 HydrophobicContact CE1-CB 4.08Å; F451-A498 HydrophobicContact CZ-CB 4.24Å; F451-I503 HydrophobicContact CD2-CD1 3.84Å; F451-I503 HydrophobicContact CD2-CG2 4.01Å; F451-I503 HydrophobicContact CE2-CD1 3.62Å; F451-I503 HydrophobicContact CE2-CG2 4.49Å; F451-I503 HydrophobicContact CG-CG2 4.45Å; F451-L505 HydrophobicContact CB-CD2 3.95Å; F451-L505 HydrophobicContact CD1-CD2 3.62Å; F451-L505 HydrophobicContact CE1-CD2 4.34Å; F451-L505 HydrophobicContact CG-CD2 3.95Å
452	L	86.3	Confident	86.1	Confident	29 Å²	29	49.1 Å²	49.1	15%	0.152	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-47.3	-179.4	-178.6	66.7	0	0	0	111.7	K448 E449 R456	K448-L452 PolarHBondContact O-N 2.81Å; E449-L452 PolarHBondContact O-N 3.45Å; L452-R456 VanDerWaalsContact O-CG 3.3Å; L452-R456 WeakPolarHBondContact O-CG 3.22Å; L452-R456 PolarHBondContact O-N 3.45Å; L452-R456 VanDerWaalsContact O-N 3.14Å
453	L	88.9	Confident	86.1	Confident	46 Å²	46	51.1 Å²	51.1	24%	0.241	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-41.1	-179.6	-66.1	176.1	0	0	0	112	L412 F435 E449 F451 R456 Q457	L412-L453 HydrophobicContact CD2-CB 3.34Å; L412-L453 HydrophobicContact CD2-CD1 4.39Å; L412-L453 HydrophobicContact CD2-CG 4.5Å; F435-L453 HydrophobicContact CZ-CD1 4.33Å; E449-L453 HydrophobicContact CG-CD1 3.94Å; E449-L453 HydrophobicContact CG-CG 4.26Å; E449-L453 WeakPolarHBondContact O-CG 3.4Å; E449-L453 PolarHBondContact O-N 2.94Å; F451-L453 PolarHBondContact O-N 3.36Å; L453-R456 PolarHBondContact O-N 3.3Å; L453-Q457 WeakPolarHBondContact O-CG 3.27Å; L453-Q457 PolarHBondContact O-N 3.45Å; L453-Q457 VanDerWaalsContact O-N 3.11Å
454	L	90.4	Very high	86.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.3	-47.7	177.7	-83.4	179.2	0	0	0	112.1	L412 L413 W450 F451 R456 Q457 I458 L494	L412-L454 HydrophobicContact CD2-CD2 4.02Å; L412-L454 HydrophobicContact CD2-CG 4.05Å; L412-L454 HydrophobicContact CG-CD2 3.77Å; L412-L454 HydrophobicContact CG-CG 4.08Å; L413-L454 HydrophobicContact CD1-CD2 4.01Å; W450-L454 HydrophobicContact CD2-CD1 3.85Å; W450-L454 HydrophobicContact CE3-CD1 4.44Å; W450-L454 HydrophobicContact CG-CD1 4.34Å; W450-L454 HydrophobicContact CH2-CD1 4.07Å; W450-L454 HydrophobicContact CZ2-CD1 3.38Å; W450-L454 WeakPolarHBondContact O-CB 3.45Å; W450-L454 WeakPolarHBondContact O-CG 3.5Å; W450-L454 PolarHBondContact O-N 2.83Å; F451-L454 PolarHBondContact O-N 3.28Å; L454-R456 VanDerWaalsContact C-N 3.31Å; L454-R456 PolarHBondContact O-N 2.9Å; L454-Q457 PolarHBondContact O-N 3.17Å; L454-I458 HydrophobicContact CB-CD1 4.29Å; L454-I458 WeakPolarHBondContact O-CB 3.35Å; L454-I458 WeakPolarHBondContact O-CD1 3.38Å; L454-I458 VanDerWaalsContact O-CG1 3.24Å; L454-I458 WeakPolarHBondContact O-CG1 3.32Å; L454-I458 PolarHBondContact O-N 3.28Å; L454-L494 HydrophobicContact CD1-CD1 4.04Å; L454-L494 HydrophobicContact CD1-CD2 3.81Å
455	V	88.8	Confident	86.5	Confident	13 Å²	13	42.4 Å²	42.4	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-46.5	178.3	167.1	0	0	0	0	110	F451 Q457 I458 F459 L505 D506 I507	F451-V455 WeakPolarHBondContact O-CB 3.33Å; F451-V455 VanDerWaalsContact O-CG2 3.3Å; F451-V455 WeakPolarHBondContact O-CG2 3.25Å; F451-V455 PolarHBondContact O-N 2.74Å; V455-Q457 VanDerWaalsContact C-N 3.33Å; V455-Q457 PolarHBondContact O-N 3.43Å; V455-I458 PolarHBondContact O-N 2.86Å; V455-F459 HydrophobicContact CG1-CD2 3.86Å; V455-F459 HydrophobicContact CG1-CE2 4.23Å; V455-F459 VanDerWaalsContact O-CD2 3.29Å; V455-F459 WeakPolarHBondContact O-CD2 3.29Å; V455-F459 PolarHBondContact O-N 3.49Å; V455-L505 HydrophobicContact CG2-CD2 4.18Å; V455-D506 WeakPolarHBondContact CG1-O 3.18Å; V455-I507 HydrophobicContact CG1-CG2 3.52Å; V455-I507 HydrophobicContact CG2-CG2 4.18Å
456	R	86.4	Confident	86.9	Confident	127 Å²	127	42.1 Å²	42.1	48%	0.479	21%	0.21	S	C	.	.	H	α-helix	trans	-58.5	-41.1	177.1	-74.2	174.1	177.5	-175.1	-3.6	113.3	L452 L453 L454 H460	L452-R456 VanDerWaalsContact O-CG 3.3Å; L452-R456 WeakPolarHBondContact O-CG 3.22Å; L452-R456 PolarHBondContact O-N 3.45Å; L452-R456 VanDerWaalsContact O-N 3.14Å; L453-R456 PolarHBondContact O-N 3.3Å; L454-R456 VanDerWaalsContact C-N 3.31Å; L454-R456 PolarHBondContact O-N 2.9Å; R456-H460 PolarHBondContact O-N 3Å
457	Q	88.7	Confident	86.9	Confident	80 Å²	80	43.2 Å²	43.2	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-70.8	-42.2	178.2	-72.3	-177.1	-1.3	0	0	112.5	L453 L454 V455 H460	L453-Q457 WeakPolarHBondContact O-CG 3.27Å; L453-Q457 PolarHBondContact O-N 3.45Å; L453-Q457 VanDerWaalsContact O-N 3.11Å; L454-Q457 PolarHBondContact O-N 3.17Å; V455-Q457 VanDerWaalsContact C-N 3.33Å; V455-Q457 PolarHBondContact O-N 3.43Å; Q457-H460 WeakPolarHBondContact O-CB 3.32Å; Q457-H460 PolarHBondContact O-N 3.49Å
458	I	88.6	Confident	86.9	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-68.9	-38.3	-176.2	-70.7	160.9	0	0	0	112.1	L413 L454 V455 H460 Y463 F466 M490 V491 L494	L413-I458 HydrophobicContact CD1-CD1 4.02Å; L413-I458 HydrophobicContact CD1-CG1 3.61Å; L454-I458 HydrophobicContact CB-CD1 4.29Å; L454-I458 WeakPolarHBondContact O-CB 3.35Å; L454-I458 WeakPolarHBondContact O-CD1 3.38Å; L454-I458 VanDerWaalsContact O-CG1 3.24Å; L454-I458 WeakPolarHBondContact O-CG1 3.32Å; L454-I458 PolarHBondContact O-N 3.28Å; V455-I458 PolarHBondContact O-N 2.86Å; I458-H460 VanDerWaalsContact C-N 3.33Å; I458-Y463 HydrophobicContact CG1-CE1 4.48Å; I458-Y463 WeakPolarHBondContact O-CD1 3.47Å; I458-F466 HydrophobicContact CG2-CD2 4.12Å; I458-F466 HydrophobicContact CG2-CE2 3.75Å; I458-M490 HydrophobicContact CD1-CE 3.88Å; I458-M490 HydrophobicContact CG1-CE 4.48Å; I458-V491 HydrophobicContact CD1-CG2 4.2Å; I458-V491 HydrophobicContact CG2-CG1 4.34Å; I458-V491 HydrophobicContact CG2-CG2 3.67Å; I458-L494 HydrophobicContact CD1-CD1 3.61Å
459	F	86.8	Confident	87	Confident	20 Å²	20	46.6 Å²	46.6	9%	0.088	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.3	-177.9	-71.4	-87	0	0	0	113.1	V455 F466 H475 I507 F509	V455-F459 HydrophobicContact CG1-CD2 3.86Å; V455-F459 HydrophobicContact CG1-CE2 4.23Å; V455-F459 VanDerWaalsContact O-CD2 3.29Å; V455-F459 WeakPolarHBondContact O-CD2 3.29Å; V455-F459 PolarHBondContact O-N 3.49Å; F459-F466 HydrophobicContact CD1-CB 4.11Å; F459-F466 AromaticContact CD1-CD2 3.78Å; F459-F466 HydrophobicContact CD1-CD2 3.78Å; F459-F466 HydrophobicContact CD1-CE2 4.41Å; F459-F466 AromaticContact CD1-CG 3.95Å; F459-F466 HydrophobicContact CD1-CG 3.95Å; F459-F466 HydrophobicContact CE1-CB 4.38Å; F459-F466 HydrophobicContact CE1-CD1 4.16Å; F459-F466 AromaticContact CE1-CD2 3.66Å; F459-F466 HydrophobicContact CE1-CD2 3.66Å; F459-F466 HydrophobicContact CE1-CE1 4.37Å; F459-F466 AromaticContact CE1-CE2 3.92Å; F459-F466 HydrophobicContact CE1-CE2 3.92Å; F459-F466 AromaticContact CE1-CG 3.8Å; F459-F466 HydrophobicContact CE1-CG 3.8Å; F459-F466 HydrophobicContact CE1-CZ 4.27Å; F459-F466 HydrophobicContact CG-CD2 4.43Å; F459-F466 HydrophobicContact CZ-CD2 4.22Å; F459-F466 HydrophobicContact CZ-CE2 4.03Å; F459-F466 HydrophobicContact CZ-CZ 4.33Å; F459-H475 HydrophobicContact CD1-CB 3.82Å; F459-H475 AromaticContact CD1-CD2 3.56Å; F459-H475 AromaticContact CD1-CG 3.53Å; F459-H475 HydrophobicContact CE1-CB 3.93Å; F459-I507 HydrophobicContact CD2-CG2 4.12Å; F459-I507 HydrophobicContact CE2-CB 4.47Å; F459-I507 HydrophobicContact CE2-CG2 3.51Å; F459-I507 HydrophobicContact CZ-CB 4.33Å; F459-I507 HydrophobicContact CZ-CG2 3.81Å; F459-F509 AromaticContact CE1-CE1 3.77Å; F459-F509 HydrophobicContact CE1-CE1 3.77Å; F459-F509 HydrophobicContact CE1-CE2 4.2Å; F459-F509 AromaticContact CE1-CZ 3.44Å; F459-F509 HydrophobicContact CE1-CZ 3.44Å; F459-F509 VanDerWaalsContact CE1-CZ 3.44Å; F459-F509 HydrophobicContact CZ-CE1 4.24Å; F459-F509 AromaticContact CZ-CE2 3.87Å; F459-F509 HydrophobicContact CZ-CE2 3.87Å; F459-F509 AromaticContact CZ-CZ 3.44Å; F459-F509 HydrophobicContact CZ-CZ 3.44Å; F459-F509 VanDerWaalsContact CZ-CZ 3.44Å
460	H	84.1	Confident	87	Confident	99 Å²	99	53 Å²	53	46%	0.458	26%	0.262	S	S	.	.	S	Bend	trans	-65.8	137.9	171.6	-161.2	-93.8	0	0	0	110.6	R456 Q457 I458 D462 Y463	R456-H460 PolarHBondContact O-N 3Å; Q457-H460 WeakPolarHBondContact O-CB 3.32Å; Q457-H460 PolarHBondContact O-N 3.49Å; I458-H460 VanDerWaalsContact C-N 3.33Å; H460-D462 VanDerWaalsContact CE1-CG 3.48Å; H460-D462 IonicContact CE1-OD1 3.31Å; H460-D462 IonicContact CE1-OD2 3.93Å; H460-D462 PolarHBondContact CE1-OD2 2.89Å; H460-D462 WeakPolarHBondContact ND1-CB 3.5Å; H460-D462 PolarHBondContact ND1-N 2.99Å; H460-D462 IonicContact ND1-OD2 3.62Å; H460-D462 PolarHBondContact ND1-OD2 2.98Å; H460-D462 PolarHBondContact O-N 3.17Å; H460-Y463 PolarHBondContact O-N 2.66Å; H460-Y463 VanDerWaalsContact O-N 3.08Å
461	T	77.6	Confident	86.6	Confident	99 Å²	99	58.2 Å²	58.2	61%	0.607	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-58.2	-36.4	-176.3	-53	0	0	0	0	112.2	Y463 G464	T461-Y463 PolarHBondContact O-N 3.01Å; T461-G464 PolarHBondContact O-N 2.94Å
462	D	78.9	Confident	86.3	Confident	142 Å²	142	59.7 Å²	59.7	76%	0.759	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-66.4	-22.2	-179.2	-60	-13.1	0	0	0	114	H460	H460-D462 VanDerWaalsContact CE1-CG 3.48Å; H460-D462 IonicContact CE1-OD1 3.31Å; H460-D462 IonicContact CE1-OD2 3.93Å; H460-D462 PolarHBondContact CE1-OD2 2.89Å; H460-D462 WeakPolarHBondContact ND1-CB 3.5Å; H460-D462 PolarHBondContact ND1-N 2.99Å; H460-D462 IonicContact ND1-OD2 3.62Å; H460-D462 PolarHBondContact ND1-OD2 2.98Å; H460-D462 PolarHBondContact O-N 3.17Å
463	Y	82.1	Confident	86.3	Confident	60 Å²	60	67.2 Å²	67.2	24%	0.235	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-78.1	-25.8	178.6	-171.4	-126.5	0	0	0	112.2	L413 I458 H460 T461 M465 E487	L413-Y463 HydrophobicContact CD2-CD2 4.2Å; L413-Y463 HydrophobicContact CD2-CE1 4.06Å; L413-Y463 HydrophobicContact CD2-CE2 3.54Å; L413-Y463 VanDerWaalsContact CD2-CZ 3.49Å; I458-Y463 HydrophobicContact CG1-CE1 4.48Å; I458-Y463 WeakPolarHBondContact O-CD1 3.47Å; H460-Y463 PolarHBondContact O-N 2.66Å; H460-Y463 VanDerWaalsContact O-N 3.08Å; T461-Y463 PolarHBondContact O-N 3.01Å; Y463-M465 VanDerWaalsContact C-N 3.34Å; Y463-M465 HydrophobicContact CD1-CB 4.21Å; Y463-M465 HydrophobicContact CD1-CG 3.77Å; Y463-M465 HydrophobicContact CD1-SD 3.92Å; Y463-M465 HydrophobicContact CE1-CB 4.39Å; Y463-M465 HydrophobicContact CE1-CG 3.56Å; Y463-M465 HydrophobicContact CE1-SD 3.18Å; Y463-M465 WeakPolarHBondContact CE1-SD 3.34Å; Y463-M465 PolarHBondContact O-N 3.18Å; Y463-E487 PolarHBondContact OH-OE1 3.27Å
464	G	83.6	Confident	86.4	Confident	22 Å²	22	65.4 Å²	65.4	23%	0.227	32%	0.319	C	S	.	.			trans	81.4	-6.6	166.4	0	0	0	0	0	116.9	T461 F466 S478 W480	T461-G464 PolarHBondContact O-N 2.94Å; G464-F466 PolarHBondContact O-N 3.39Å; G464-S478 VanDerWaalsContact O-CB 3.26Å; G464-S478 WeakPolarHBondContact O-CB 3.4Å; G464-S478 PolarHBondContact O-OG 3.08Å; G464-S478 VanDerWaalsContact O-OG 3.12Å; G464-W480 PolarHBondContact O-NE1 3.26Å
465	M	87.1	Confident	86.4	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	33%	0.325	C	S	.	.	S	Bend	trans	-68.2	-31.4	178.4	-74.9	-170	69.7	0	0	114.4	Y463 S478 E487 F488 V491	Y463-M465 VanDerWaalsContact C-N 3.34Å; Y463-M465 HydrophobicContact CD1-CB 4.21Å; Y463-M465 HydrophobicContact CD1-CG 3.77Å; Y463-M465 HydrophobicContact CD1-SD 3.92Å; Y463-M465 HydrophobicContact CE1-CB 4.39Å; Y463-M465 HydrophobicContact CE1-CG 3.56Å; Y463-M465 HydrophobicContact CE1-SD 3.18Å; Y463-M465 WeakPolarHBondContact CE1-SD 3.34Å; Y463-M465 PolarHBondContact O-N 3.18Å; M465-S478 WeakPolarHBondContact O-CB 3.37Å; M465-S478 PolarHBondContact O-N 3.22Å; M465-S478 PolarHBondContact O-OG 3.39Å; M465-E487 VanDerWaalsContact CE-C 3.5Å; M465-E487 HydrophobicContact CE-CB 3.8Å; M465-E487 HydrophobicContact SD-CB 3.73Å; M465-F488 HydrophobicContact CB-CE1 4.22Å; M465-F488 HydrophobicContact CB-CZ 4.16Å; M465-F488 HydrophobicContact CE-CB 4.11Å; M465-F488 HydrophobicContact CE-CD1 3.36Å; M465-F488 HydrophobicContact CE-CD2 3.84Å; M465-F488 HydrophobicContact CE-CE1 3.57Å; M465-F488 HydrophobicContact CE-CE2 4.02Å; M465-F488 HydrophobicContact CE-CG 3.5Å; M465-F488 HydrophobicContact CE-CZ 3.89Å; M465-F488 VanDerWaalsContact CE-N 3.32Å; M465-F488 HydrophobicContact CG-CZ 4.33Å; M465-F488 WeakPolarHBondContact O-CE1 3.36Å; M465-V491 HydrophobicContact CE-CG2 3.75Å; M465-V491 HydrophobicContact SD-CG2 4.24Å
466	F	90.8	Very high	86.6	Confident	5 Å²	5	67 Å²	67	2%	0.022	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	141.6	-178.8	-59.9	-80.6	0	0	0	109.7	I458 F459 G464 H475 W476 F477 F488 V491 F509	I458-F466 HydrophobicContact CG2-CD2 4.12Å; I458-F466 HydrophobicContact CG2-CE2 3.75Å; F459-F466 HydrophobicContact CD1-CB 4.11Å; F459-F466 AromaticContact CD1-CD2 3.78Å; F459-F466 HydrophobicContact CD1-CD2 3.78Å; F459-F466 HydrophobicContact CD1-CE2 4.41Å; F459-F466 AromaticContact CD1-CG 3.95Å; F459-F466 HydrophobicContact CD1-CG 3.95Å; F459-F466 HydrophobicContact CE1-CB 4.38Å; F459-F466 HydrophobicContact CE1-CD1 4.16Å; F459-F466 AromaticContact CE1-CD2 3.66Å; F459-F466 HydrophobicContact CE1-CD2 3.66Å; F459-F466 HydrophobicContact CE1-CE1 4.37Å; F459-F466 AromaticContact CE1-CE2 3.92Å; F459-F466 HydrophobicContact CE1-CE2 3.92Å; F459-F466 AromaticContact CE1-CG 3.8Å; F459-F466 HydrophobicContact CE1-CG 3.8Å; F459-F466 HydrophobicContact CE1-CZ 4.27Å; F459-F466 HydrophobicContact CG-CD2 4.43Å; F459-F466 HydrophobicContact CZ-CD2 4.22Å; F459-F466 HydrophobicContact CZ-CE2 4.03Å; F459-F466 HydrophobicContact CZ-CZ 4.33Å; G464-F466 PolarHBondContact O-N 3.39Å; F466-H475 HydrophobicContact CB-CB 4.33Å; F466-W476 CarbonylContact C-O 3.59Å; F466-W476 VanDerWaalsContact CA-O 3.23Å; F466-W476 WeakPolarHBondContact CA-O 3.49Å; F466-F477 HydrophobicContact CD1-CG 4.44Å; F466-F477 AromaticContact CE1-CD1 3.86Å; F466-F477 HydrophobicContact CE1-CD1 3.86Å; F466-F477 HydrophobicContact CE1-CD2 4.29Å; F466-F477 AromaticContact CE1-CE1 3.75Å; F466-F477 HydrophobicContact CE1-CE1 3.75Å; F466-F477 HydrophobicContact CE1-CE2 4.16Å; F466-F477 HydrophobicContact CE1-CG 4.13Å; F466-F477 AromaticContact CE1-CZ 3.9Å; F466-F477 HydrophobicContact CE1-CZ 3.9Å; F466-F477 HydrophobicContact CZ-CE1 4.31Å; F466-F488 HydrophobicContact CE1-CE1 4.39Å; F466-F488 HydrophobicContact CZ-CD1 4.37Å; F466-F488 HydrophobicContact CZ-CE1 4.3Å; F466-V491 HydrophobicContact CE2-CG1 4.14Å; F466-V491 HydrophobicContact CE2-CG2 4.29Å; F466-V491 HydrophobicContact CZ-CG1 4.05Å; F466-F509 AromaticContact CD1-CE1 3.89Å; F466-F509 HydrophobicContact CD1-CE1 3.89Å; F466-F509 HydrophobicContact CD1-CZ 4.23Å; F466-F509 AromaticContact CE1-CE1 3.78Å; F466-F509 HydrophobicContact CE1-CE1 3.78Å; F466-F509 AromaticContact CE1-CZ 3.74Å; F466-F509 HydrophobicContact CE1-CZ 3.74Å; F466-F509 HydrophobicContact CZ-CZ 4.1Å
467	S	89.1	Confident	86.9	Confident	56 Å²	56	61.1 Å²	61.1	39%	0.392	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.7	173.8	-57.4	0	0	0	0	109.2	M469 H475 W476	S467-M469 PolarHBondContact O-N 3.47Å; S467-H475 WeakPolarHBondContact O-CA 3.38Å; S467-W476 PolarHBondContact N-O 3.02Å; S467-W476 PolarHBondContact O-N 2.91Å
468	F	89.9	Confident	86.8	Confident	93 Å²	93	57.4 Å²	57.4	41%	0.408	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	114.6	173.3	-178.1	-105.6	0	0	0	110	K470 R473 H475	F468-K470 HydrophobicContact CD1-CG 4.17Å; F468-K470 HydrophobicContact CE1-CG 4.27Å; F468-K470 PolarHBondContact O-N 3.21Å; F468-R473 HydrophobicContact CZ-CB 4.27Å; F468-H475 AromaticContact CD2-CE1 3.86Å; F468-H475 AromaticContact CD2-NE2 3.68Å
469	M	88.6	Confident	86.3	Confident	43 Å²	43	58.3 Å²	58.3	21%	0.212	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	105.8	177.5	-58	-58.1	-62.2	0	0	108.6	S467 D471 S472 R473 C474 W476 V544 M545	S467-M469 PolarHBondContact O-N 3.47Å; M469-D471 PolarHBondContact O-N 3.48Å; M469-S472 WeakPolarHBondContact CB-OG 3.4Å; M469-R473 VanDerWaalsContact O-CA 3.25Å; M469-R473 WeakPolarHBondContact O-CA 3.45Å; M469-R473 PolarHBondContact O-N 3.43Å; M469-C474 WeakPolarHBondContact CB-O 3.38Å; M469-C474 PolarHBondContact N-O 3.12Å; M469-C474 PolarHBondContact O-N 2.85Å; M469-W476 HydrophobicContact CG-CB 4.13Å; M469-V544 WeakPolarHBondContact CE-O 3.5Å; M469-V544 HydrophobicContact CG-CG1 4.37Å; M469-M545 HydrophobicContact CE-CB 4.45Å; M469-M545 HydrophobicContact CE-CG 3.43Å; M469-M545 VanDerWaalsContact CE-CG 3.43Å
470	K	86.1	Confident	85.7	Confident	170 Å²	170	61.5 Å²	61.5	74%	0.739	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-42.5	-172.9	-66.4	-175.8	-178.3	178.3	0	112.7	F468 R473	F468-K470 HydrophobicContact CD1-CG 4.17Å; F468-K470 HydrophobicContact CE1-CG 4.27Å; F468-K470 PolarHBondContact O-N 3.21Å; K470-R473 WeakPolarHBondContact O-CG 3.43Å; K470-R473 PolarHBondContact O-N 3.44Å
471	D	84.8	Confident	84.9	Confident	110 Å²	110	63.7 Å²	63.7	59%	0.588	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-36.8	-173	-48.7	-46.2	0	0	0	112.2	M469 P546	M469-D471 PolarHBondContact O-N 3.48Å; D471-P546 HydrophobicContact CB-CG 3.58Å
472	S	85.1	Confident	84.5	Confident	35 Å²	35	59.5 Å²	59.5	25%	0.245	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.8	178	53	0	0	0	0	113.7	M469 C474 Q543 V544	M469-S472 WeakPolarHBondContact CB-OG 3.4Å; S472-C474 PolarHBondContact O-N 2.96Å; S472-C474 PolarHBondContact OG-SG 2.9Å; S472-Q543 WeakPolarHBondContact CB-O 3.24Å; S472-V544 PolarHBondContact OG-O 3.2Å
473	R	86.4	Confident	83.9	Confident	187 Å²	187	60.9 Å²	60.9	71%	0.706	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	39.7	-175	-57.6	-173.7	-63	160.9	-0.1	113	F468 M469 K470	F468-R473 HydrophobicContact CZ-CB 4.27Å; M469-R473 VanDerWaalsContact O-CA 3.25Å; M469-R473 WeakPolarHBondContact O-CA 3.45Å; M469-R473 PolarHBondContact O-N 3.43Å; K470-R473 WeakPolarHBondContact O-CG 3.43Å; K470-R473 PolarHBondContact O-N 3.44Å
474	C	89.8	Confident	83.6	Confident	8 Å²	8	62.3 Å²	62.3	5%	0.054	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	162.5	178.5	77.1	0	0	0	0	111.5	M469 S472 H508	M469-C474 WeakPolarHBondContact CB-O 3.38Å; M469-C474 PolarHBondContact N-O 3.12Å; M469-C474 PolarHBondContact O-N 2.85Å; S472-C474 PolarHBondContact O-N 2.96Å; S472-C474 PolarHBondContact OG-SG 2.9Å; C474-H508 WeakPolarHBondContact CA-O 3.5Å
475	H	91.6	Very high	83.8	Confident	31 Å²	31	64 Å²	64	14%	0.144	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.2	172.4	-62.1	85.6	0	0	0	109.3	F459 F466 S467 F468 H508 F509	F459-H475 HydrophobicContact CD1-CB 3.82Å; F459-H475 AromaticContact CD1-CD2 3.56Å; F459-H475 AromaticContact CD1-CG 3.53Å; F459-H475 HydrophobicContact CE1-CB 3.93Å; F466-H475 HydrophobicContact CB-CB 4.33Å; S467-H475 WeakPolarHBondContact O-CA 3.38Å; F468-H475 AromaticContact CD2-CE1 3.86Å; F468-H475 AromaticContact CD2-NE2 3.68Å; H475-H508 PolarHBondContact N-O 2.63Å; H475-F509 HydrophobicContact CB-CD1 4.32Å; H475-F509 HydrophobicContact CB-CE1 4.16Å; H475-F509 VanDerWaalsContact O-CD1 3.3Å; H475-F509 WeakPolarHBondContact O-CD1 3.21Å
476	W	93.6	Very high	83.7	Confident	15 Å²	15	65.1 Å²	65.1	6%	0.057	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	154.9	173.4	-167	-112.1	0	0	0	111.2	F466 S467 M469 S478 P510 Y512 C513 K516 V544 L611 I615	F466-W476 CarbonylContact C-O 3.59Å; F466-W476 VanDerWaalsContact CA-O 3.23Å; F466-W476 WeakPolarHBondContact CA-O 3.49Å; S467-W476 PolarHBondContact N-O 3.02Å; S467-W476 PolarHBondContact O-N 2.91Å; M469-W476 HydrophobicContact CG-CB 4.13Å; W476-S478 PolarHBondContact O-N 2.87Å; W476-P510 HydrophobicContact CE3-CG 3.52Å; W476-P510 HydrophobicContact CZ3-CG 3.51Å; W476-Y512 AromaticContact CH2-CD1 3.95Å; W476-Y512 HydrophobicContact CH2-CD1 3.95Å; W476-C513 HydrophobicContact CZ3-CB 4.29Å; W476-K516 HydrophobicContact CH2-CD 4.34Å; W476-V544 HydrophobicContact CB-CG1 3.98Å; W476-V544 HydrophobicContact CD2-CG1 3.74Å; W476-V544 HydrophobicContact CE3-CG1 4.1Å; W476-V544 HydrophobicContact CE3-CG2 4.27Å; W476-V544 HydrophobicContact CG-CG1 3.68Å; W476-V544 HydrophobicContact CZ3-CG2 4.41Å; W476-L611 HydrophobicContact CH2-CD2 4.16Å; W476-L611 HydrophobicContact CZ2-CB 4.36Å; W476-L611 HydrophobicContact CZ2-CD2 3.6Å; W476-I615 HydrophobicContact CH2-CD1 4.14Å; W476-I615 HydrophobicContact CZ2-CD1 3.46Å; W476-I615 VanDerWaalsContact CZ2-CD1 3.46Å
477	F	92.3	Very high	83.6	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.018	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	131.3	179.9	-71.4	-102.9	0	0	0	109.9	F466 F488 F509 I615 Q618 F619 F622	F466-F477 HydrophobicContact CD1-CG 4.44Å; F466-F477 AromaticContact CE1-CD1 3.86Å; F466-F477 HydrophobicContact CE1-CD1 3.86Å; F466-F477 HydrophobicContact CE1-CD2 4.29Å; F466-F477 AromaticContact CE1-CE1 3.75Å; F466-F477 HydrophobicContact CE1-CE1 3.75Å; F466-F477 HydrophobicContact CE1-CE2 4.16Å; F466-F477 HydrophobicContact CE1-CG 4.13Å; F466-F477 AromaticContact CE1-CZ 3.9Å; F466-F477 HydrophobicContact CE1-CZ 3.9Å; F466-F477 HydrophobicContact CZ-CE1 4.31Å; F477-F488 AromaticContact CD1-CD1 3.83Å; F477-F488 HydrophobicContact CD1-CD1 3.83Å; F477-F488 AromaticContact CD1-CE1 3.68Å; F477-F488 HydrophobicContact CD1-CE1 3.68Å; F477-F488 AromaticContact CE1-CD1 3.83Å; F477-F488 HydrophobicContact CE1-CD1 3.83Å; F477-F488 HydrophobicContact CE1-CE1 4.13Å; F477-F509 HydrophobicContact CE2-CE1 4.4Å; F477-I615 HydrophobicContact CB-CB 3.98Å; F477-I615 HydrophobicContact CB-CD1 3.92Å; F477-I615 HydrophobicContact CB-CG2 3.77Å; F477-I615 HydrophobicContact CD2-CD1 4.08Å; F477-I615 HydrophobicContact CG-CD1 4.1Å; F477-Q618 HydrophobicContact CD1-CB 4.09Å; F477-F619 HydrophobicContact CD2-CD2 4Å; F477-F619 HydrophobicContact CE1-CD2 4.11Å; F477-F619 AromaticContact CE2-CD2 3.48Å; F477-F619 HydrophobicContact CE2-CD2 3.48Å; F477-F619 VanDerWaalsContact CE2-CD2 3.48Å; F477-F619 AromaticContact CE2-CE2 3.69Å; F477-F619 HydrophobicContact CE2-CE2 3.69Å; F477-F619 AromaticContact CZ-CD2 3.54Å; F477-F619 HydrophobicContact CZ-CD2 3.54Å; F477-F619 AromaticContact CZ-CE2 3.86Å; F477-F619 HydrophobicContact CZ-CE2 3.86Å; F477-F622 HydrophobicContact CE1-CB 3.97Å; F477-F622 HydrophobicContact CE1-CD1 4.29Å; F477-F622 HydrophobicContact CE1-CD2 4.46Å; F477-F622 HydrophobicContact CE1-CG 4.01Å; F477-F622 HydrophobicContact CZ-CB 4.22Å; F477-F622 AromaticContact CZ-CD1 3.67Å; F477-F622 HydrophobicContact CZ-CD1 3.67Å; F477-F622 HydrophobicContact CZ-CD2 4.27Å; F477-F622 AromaticContact CZ-CE1 3.97Å; F477-F622 HydrophobicContact CZ-CE1 3.97Å; F477-F622 AromaticContact CZ-CG 3.81Å; F477-F622 HydrophobicContact CZ-CG 3.81Å; F477-F622 HydrophobicContact CZ-CZ 4.4Å
478	S	86.6	Confident	83.7	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	31%	0.306	C	S	.	.			trans	-69.5	130.7	174.7	68.4	0	0	0	0	110.2	G464 M465 W476 W480	G464-S478 VanDerWaalsContact O-CB 3.26Å; G464-S478 WeakPolarHBondContact O-CB 3.4Å; G464-S478 PolarHBondContact O-OG 3.08Å; G464-S478 VanDerWaalsContact O-OG 3.12Å; M465-S478 WeakPolarHBondContact O-CB 3.37Å; M465-S478 PolarHBondContact O-N 3.22Å; M465-S478 PolarHBondContact O-OG 3.39Å; W476-S478 PolarHBondContact O-N 2.87Å; S478-W480 VanDerWaalsContact C-N 3.33Å; S478-W480 PolarHBondContact O-N 3.3Å; S478-W480 VanDerWaalsContact OG-CD1 3.26Å; S478-W480 PolarHBondContact OG-NE1 2.84Å
479	S	77.1	Confident	83.9	Confident	22 Å²	22	62.9 Å²	62.9	15%	0.154	30%	0.298	C	S	.	.			trans	-82.2	-6.6	-175.7	78.2	0	0	0	0	114.6	Q574	S479-Q574 PolarHBondContact OG-NE2 3.37Å; S479-Q574 PolarHBondContact OG-OE1 3.48Å
480	W	75.3	Confident	83.9	Confident	87 Å²	87	61.1 Å²	61.1	33%	0.33	29%	0.29	S	S	.	.	S	Bend	trans	-62.1	143.3	178.9	60.8	-76.6	0	0	0	110.7	G464 S478 S482 Q618	G464-W480 PolarHBondContact O-NE1 3.26Å; S478-W480 VanDerWaalsContact C-N 3.33Å; S478-W480 PolarHBondContact O-N 3.3Å; S478-W480 VanDerWaalsContact OG-CD1 3.26Å; S478-W480 PolarHBondContact OG-NE1 2.84Å; W480-S482 PolarHBondContact O-N 3.39Å; W480-S482 VanDerWaalsContact O-N 3.12Å; W480-Q618 PolarHBondContact O-NE2 3.46Å
481	K	66.5	Low	84.3	Confident	144 Å²	144	53.4 Å²	53.4	63%	0.626	26%	0.257	S	S	*	.			trans	-69.8	111.2	177.6	-66.4	-176.8	-177.8	177.2	0	108.4
482	S	68.9	Low	84.7	Confident	12 Å²	12	48.2 Å²	48.2	8%	0.084	23%	0.229	C	C	.	.			trans	-85.6	140.3	163.2	178.3	0	0	0	0	109.5	W480 N484 Y485	W480-S482 PolarHBondContact O-N 3.39Å; W480-S482 VanDerWaalsContact O-N 3.12Å; S482-N484 VanDerWaalsContact C-N 3.25Å; S482-N484 PolarHBondContact OG-N 3.19Å; S482-N484 VanDerWaalsContact OG-N 3.16Å; S482-N484 PolarHBondContact OG-O 3.13Å; S482-Y485 WeakPolarHBondContact O-CE2 3.46Å; S482-Y485 PolarHBondContact O-OH 3.15Å
483	D	66.9	Low	85.2	Confident	171 Å²	171	47 Å²	47	91%	0.914	22%	0.22	S	C	*	.	S	Bend	trans	-74.5	-20.2	172.3	-69.5	-31.3	0	0	0	111.7
484	N	75.7	Confident	85.5	Confident	89 Å²	89	38.4 Å²	38.4	48%	0.476	19%	0.188	S	C	.	.			trans	-133.5	113	-177.9	-173.6	4	0	0	0	111.7	S482 S486	S482-N484 VanDerWaalsContact C-N 3.25Å; S482-N484 PolarHBondContact OG-N 3.19Å; S482-N484 VanDerWaalsContact OG-N 3.16Å; S482-N484 PolarHBondContact OG-O 3.13Å; N484-S486 VanDerWaalsContact C-N 3.34Å; N484-S486 PolarHBondContact ND2-OG 3.49Å; N484-S486 WeakPolarHBondContact OD1-CB 3.37Å; N484-S486 PolarHBondContact OD1-N 3.26Å; N484-S486 PolarHBondContact OD1-OG 3.46Å
485	Y	87.7	Confident	85.7	Confident	57 Å²	57	38.1 Å²	38.1	22%	0.224	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3.5	178.8	-54.9	-82.6	0	0	0	113.6	S482 E487 F488 Q489 K617 Q618 A621	S482-Y485 WeakPolarHBondContact O-CE2 3.46Å; S482-Y485 PolarHBondContact O-OH 3.15Å; Y485-E487 PolarHBondContact O-N 3.49Å; Y485-F488 HydrophobicContact CD1-CD2 4.38Å; Y485-F488 PolarHBondContact O-N 3.29Å; Y485-Q489 PolarHBondContact O-N 2.9Å; Y485-Q489 VanDerWaalsContact O-N 3.08Å; Y485-K617 HydrophobicContact CD1-CB 3.98Å; Y485-K617 HydrophobicContact CE1-CB 3.44Å; Y485-K617 VanDerWaalsContact CE1-CB 3.44Å; Y485-K617 HydrophobicContact CE1-CD 4.39Å; Y485-K617 HydrophobicContact CE2-CB 4.18Å; Y485-K617 HydrophobicContact CE2-CD 4.07Å; Y485-K617 WeakPolarHBondContact OH-CD 3.38Å; Y485-Q618 HydrophobicContact CD1-CG 4.1Å; Y485-Q618 HydrophobicContact CE1-CG 3.97Å; Y485-A621 WeakPolarHBondContact O-CB 3.23Å
486	S	85.9	Confident	85.8	Confident	26 Å²	26	36.7 Å²	36.7	18%	0.182	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-29.7	-178.9	60.1	0	0	0	0	113.3	N484 Q489 M490	N484-S486 VanDerWaalsContact C-N 3.34Å; N484-S486 PolarHBondContact ND2-OG 3.49Å; N484-S486 WeakPolarHBondContact OD1-CB 3.37Å; N484-S486 PolarHBondContact OD1-N 3.26Å; N484-S486 PolarHBondContact OD1-OG 3.46Å; S486-Q489 WeakPolarHBondContact O-CB 3.25Å; S486-Q489 PolarHBondContact O-N 3.2Å; S486-M490 PolarHBondContact O-N 3.42Å
487	E	88.2	Confident	85.9	Confident	52 Å²	52	36 Å²	36	24%	0.243	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-45.5	174.7	-62	178.2	137.3	0	0	110.5	L417 Y463 M465 Y485 Q489 M490 V491	L417-E487 HydrophobicContact CD1-CG 4.26Å; L417-E487 HydrophobicContact CD2-CG 4.39Å; Y463-E487 PolarHBondContact OH-OE1 3.27Å; M465-E487 VanDerWaalsContact CE-C 3.5Å; M465-E487 HydrophobicContact CE-CB 3.8Å; M465-E487 HydrophobicContact SD-CB 3.73Å; Y485-E487 PolarHBondContact O-N 3.49Å; E487-Q489 VanDerWaalsContact C-N 3.29Å; E487-Q489 PolarHBondContact O-N 3.44Å; E487-M490 WeakPolarHBondContact O-CA 3.24Å; E487-M490 WeakPolarHBondContact O-CB 2.83Å; E487-M490 PolarHBondContact O-N 3.02Å; E487-V491 WeakPolarHBondContact O-CG2 3.37Å; E487-V491 PolarHBondContact O-N 3.47Å
488	F	91.9	Very high	85.8	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-41.3	173.8	-72.8	-76.4	0	0	0	111.7	M465 F466 F477 Y485 M490 V491 G492 Q618 A621 F622	M465-F488 HydrophobicContact CB-CE1 4.22Å; M465-F488 HydrophobicContact CB-CZ 4.16Å; M465-F488 HydrophobicContact CE-CB 4.11Å; M465-F488 HydrophobicContact CE-CD1 3.36Å; M465-F488 HydrophobicContact CE-CD2 3.84Å; M465-F488 HydrophobicContact CE-CE1 3.57Å; M465-F488 HydrophobicContact CE-CE2 4.02Å; M465-F488 HydrophobicContact CE-CG 3.5Å; M465-F488 HydrophobicContact CE-CZ 3.89Å; M465-F488 VanDerWaalsContact CE-N 3.32Å; M465-F488 HydrophobicContact CG-CZ 4.33Å; M465-F488 WeakPolarHBondContact O-CE1 3.36Å; F466-F488 HydrophobicContact CE1-CE1 4.39Å; F466-F488 HydrophobicContact CZ-CD1 4.37Å; F466-F488 HydrophobicContact CZ-CE1 4.3Å; F477-F488 AromaticContact CD1-CD1 3.83Å; F477-F488 HydrophobicContact CD1-CD1 3.83Å; F477-F488 AromaticContact CD1-CE1 3.68Å; F477-F488 HydrophobicContact CD1-CE1 3.68Å; F477-F488 AromaticContact CE1-CD1 3.83Å; F477-F488 HydrophobicContact CE1-CD1 3.83Å; F477-F488 HydrophobicContact CE1-CE1 4.13Å; Y485-F488 HydrophobicContact CD1-CD2 4.38Å; Y485-F488 PolarHBondContact O-N 3.29Å; F488-M490 VanDerWaalsContact C-N 3.32Å; F488-M490 PolarHBondContact O-N 3.46Å; F488-V491 PolarHBondContact O-N 2.96Å; F488-G492 PolarHBondContact O-N 3.12Å; F488-Q618 WeakPolarHBondContact CB-O 3.37Å; F488-Q618 HydrophobicContact CD1-CB 4Å; F488-Q618 HydrophobicContact CD2-CB 3.93Å; F488-Q618 HydrophobicContact CD2-CG 3.97Å; F488-Q618 HydrophobicContact CE1-CB 3.95Å; F488-Q618 HydrophobicContact CE1-CG 4.27Å; F488-Q618 HydrophobicContact CE2-CB 3.87Å; F488-Q618 HydrophobicContact CE2-CG 3.51Å; F488-Q618 HydrophobicContact CG-CB 4Å; F488-Q618 HydrophobicContact CZ-CB 3.89Å; F488-Q618 HydrophobicContact CZ-CG 3.69Å; F488-A621 HydrophobicContact CB-CB 4.1Å; F488-F622 HydrophobicContact CB-CB 4.39Å; F488-F622 VanDerWaalsContact O-CA 3.29Å; F488-F622 WeakPolarHBondContact O-CA 3.42Å
489	Q	92.4	Very high	86.1	Confident	53 Å²	53	36 Å²	36	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-42.2	172.9	-172.9	177.6	5.9	0	0	111.8	Y485 S486 E487 G492 T493 A621 G625	Y485-Q489 PolarHBondContact O-N 2.9Å; Y485-Q489 VanDerWaalsContact O-N 3.08Å; S486-Q489 WeakPolarHBondContact O-CB 3.25Å; S486-Q489 PolarHBondContact O-N 3.2Å; E487-Q489 VanDerWaalsContact C-N 3.29Å; E487-Q489 PolarHBondContact O-N 3.44Å; Q489-G492 PolarHBondContact O-N 3.33Å; Q489-T493 PolarHBondContact O-N 3.05Å; Q489-T493 PolarHBondContact O-OG1 3.41Å; Q489-A621 VanDerWaalsContact CA-O 3.29Å; Q489-A621 WeakPolarHBondContact CA-O 3.46Å; Q489-A621 HydrophobicContact CB-CB 4.29Å; Q489-G625 WeakPolarHBondContact O-CA 3.33Å
490	M	90.1	Very high	86.7	Confident	7 Å²	7	35.2 Å²	35.2	3%	0.034	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-47.3	175.4	-175.9	-152	49.6	0	0	111.5	L413 L417 L420 I458 S486 E487 F488 G492 T493 L494	L413-M490 HydrophobicContact CD1-CE 3.88Å; L417-M490 HydrophobicContact CB-SD 4.15Å; L417-M490 HydrophobicContact CD2-CB 3.45Å; L417-M490 VanDerWaalsContact CD2-CB 3.45Å; L417-M490 HydrophobicContact CD2-CE 3.74Å; L417-M490 HydrophobicContact CD2-CG 3.66Å; L417-M490 HydrophobicContact CD2-SD 3.22Å; L417-M490 WeakPolarHBondContact CD2-SD 3.4Å; L417-M490 HydrophobicContact CG-CE 3.96Å; L417-M490 HydrophobicContact CG-CG 4.38Å; L417-M490 HydrophobicContact CG-SD 3.33Å; L417-M490 WeakPolarHBondContact CG-SD 3.44Å; L420-M490 HydrophobicContact CD1-CG 3.7Å; L420-M490 HydrophobicContact CD1-SD 4.31Å; I458-M490 HydrophobicContact CD1-CE 3.88Å; I458-M490 HydrophobicContact CG1-CE 4.48Å; S486-M490 PolarHBondContact O-N 3.42Å; E487-M490 WeakPolarHBondContact O-CA 3.24Å; E487-M490 WeakPolarHBondContact O-CB 2.83Å; E487-M490 PolarHBondContact O-N 3.02Å; F488-M490 VanDerWaalsContact C-N 3.32Å; F488-M490 PolarHBondContact O-N 3.46Å; M490-G492 PolarHBondContact O-N 3.03Å; M490-T493 CarbonylContact O-C 3.54Å; M490-T493 WeakPolarHBondContact O-CA 3.47Å; M490-T493 WeakPolarHBondContact O-CB 3.3Å; M490-T493 PolarHBondContact O-N 3.42Å; M490-L494 HydrophobicContact CE-CD1 3.96Å; M490-L494 HydrophobicContact CG-CD1 4.3Å; M490-L494 HydrophobicContact CG-CG 4.31Å; M490-L494 WeakPolarHBondContact O-CG 3.46Å; M490-L494 PolarHBondContact O-N 2.95Å; M490-L494 HydrophobicContact SD-CD1 4.13Å
491	V	92.7	Very high	87.3	Confident	8 Å²	8	32.9 Å²	32.9	5%	0.048	17%	0.165	C	C	.	.	H	α-helix	trans	-58.2	-39.8	178	-174.2	0	0	0	0	110.5	I458 M465 F466 E487 F488 L494 M495 F622	I458-V491 HydrophobicContact CD1-CG2 4.2Å; I458-V491 HydrophobicContact CG2-CG1 4.34Å; I458-V491 HydrophobicContact CG2-CG2 3.67Å; M465-V491 HydrophobicContact CE-CG2 3.75Å; M465-V491 HydrophobicContact SD-CG2 4.24Å; F466-V491 HydrophobicContact CE2-CG1 4.14Å; F466-V491 HydrophobicContact CE2-CG2 4.29Å; F466-V491 HydrophobicContact CZ-CG1 4.05Å; E487-V491 WeakPolarHBondContact O-CG2 3.37Å; E487-V491 PolarHBondContact O-N 3.47Å; F488-V491 PolarHBondContact O-N 2.96Å; V491-L494 PolarHBondContact O-N 3.48Å; V491-M495 PolarHBondContact O-N 2.94Å; V491-F622 HydrophobicContact CB-CD2 4.21Å; V491-F622 HydrophobicContact CB-CE2 4.36Å; V491-F622 HydrophobicContact CG1-CD2 4.28Å; V491-F622 HydrophobicContact CG1-CE2 3.96Å
492	G	94.9	Very high	88.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-50.7	170.6	0	0	0	0	0	112.1	F488 Q489 M490 L494 M495 G496 F622 F626	F488-G492 PolarHBondContact O-N 3.12Å; Q489-G492 PolarHBondContact O-N 3.33Å; M490-G492 PolarHBondContact O-N 3.03Å; G492-L494 VanDerWaalsContact C-N 3.31Å; G492-L494 PolarHBondContact O-N 3.26Å; G492-M495 PolarHBondContact O-N 3.33Å; G492-G496 PolarHBondContact O-N 3.08Å; G492-F622 VanDerWaalsContact CA-CD2 3.46Å; G492-F622 VanDerWaalsContact CA-O 3.32Å; G492-F622 WeakPolarHBondContact CA-O 3.35Å; G492-F622 VanDerWaalsContact N-CD2 3.3Å; G492-F626 WeakPolarHBondContact O-CA 3.4Å; G492-F626 PolarHBondContact O-N 2.93Å
493	T	94.7	Very high	89.2	Confident	9 Å²	9	29.7 Å²	29.7	6%	0.055	16%	0.158	C	C	.	.	H	α-helix	trans	-59.6	-39.4	177.1	-63.3	0	0	0	0	112.1	L420 L427 Q489 M490 G496 L497 G625 S628 V629	L420-T493 HydrophobicContact CD2-CG2 4.46Å; L427-T493 HydrophobicContact CD1-CG2 3.88Å; L427-T493 HydrophobicContact CD2-CG2 3.87Å; Q489-T493 PolarHBondContact O-N 3.05Å; Q489-T493 PolarHBondContact O-OG1 3.41Å; M490-T493 CarbonylContact O-C 3.54Å; M490-T493 WeakPolarHBondContact O-CA 3.47Å; M490-T493 WeakPolarHBondContact O-CB 3.3Å; M490-T493 PolarHBondContact O-N 3.42Å; T493-G496 PolarHBondContact O-N 2.91Å; T493-L497 HydrophobicContact CG2-CD1 4.19Å; T493-L497 HydrophobicContact CG2-CG 4.35Å; T493-L497 WeakPolarHBondContact O-CB 3.26Å; T493-L497 WeakPolarHBondContact O-CG 3.45Å; T493-L497 PolarHBondContact O-N 3.22Å; T493-G625 WeakPolarHBondContact CA-O 3.35Å; T493-G625 VanDerWaalsContact N-C 3.26Å; T493-G625 PolarHBondContact N-O 2.83Å; T493-G625 WeakPolarHBondContact OG1-CA 3.47Å; T493-G625 PolarHBondContact OG1-O 3.4Å; T493-S628 PolarHBondContact OG1-OG 2.83Å; T493-V629 HydrophobicContact CG2-CG2 3.95Å
494	L	93.4	Very high	90.1	Very high	7 Å²	7	24 Å²	24	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-62.4	-48.1	175.9	-71.3	173.2	0	0	0	111.1	L420 W450 F451 L454 I458 M490 V491 G492 G496 L497 A498	L420-L494 HydrophobicContact CD1-CD2 3.77Å; L420-L494 HydrophobicContact CD1-CG 4.22Å; W450-L494 HydrophobicContact CH2-CD2 3.28Å; W450-L494 HydrophobicContact CZ2-CD2 3.82Å; W450-L494 HydrophobicContact CZ3-CD2 3.93Å; F451-L494 HydrophobicContact CE1-CB 4.44Å; F451-L494 HydrophobicContact CE1-CD2 4.22Å; F451-L494 WeakPolarHBondContact CE1-O 3.25Å; L454-L494 HydrophobicContact CD1-CD1 4.04Å; L454-L494 HydrophobicContact CD1-CD2 3.81Å; I458-L494 HydrophobicContact CD1-CD1 3.61Å; M490-L494 HydrophobicContact CE-CD1 3.96Å; M490-L494 HydrophobicContact CG-CD1 4.3Å; M490-L494 HydrophobicContact CG-CG 4.31Å; M490-L494 WeakPolarHBondContact O-CG 3.46Å; M490-L494 PolarHBondContact O-N 2.95Å; M490-L494 HydrophobicContact SD-CD1 4.13Å; V491-L494 PolarHBondContact O-N 3.48Å; G492-L494 VanDerWaalsContact C-N 3.31Å; G492-L494 PolarHBondContact O-N 3.26Å; L494-G496 VanDerWaalsContact C-N 3.29Å; L494-G496 PolarHBondContact O-N 2.76Å; L494-L497 PolarHBondContact O-N 3.47Å; L494-A498 WeakPolarHBondContact O-CB 3.22Å; L494-A498 PolarHBondContact O-N 2.88Å
495	M	94.2	Very high	90.7	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.015	12%	0.115	C	C	.	.	H	α-helix	trans	-61	-40.1	175.5	-173.3	178.3	168.3	0	0	111.6	V491 G492 A498 V499 L505 I507 Y514 L517 F622 F626 V647	V491-M495 PolarHBondContact O-N 2.94Å; G492-M495 PolarHBondContact O-N 3.33Å; M495-A498 PolarHBondContact O-N 3.07Å; M495-V499 PolarHBondContact O-N 3.2Å; M495-L505 HydrophobicContact CB-CD1 4.38Å; M495-L505 HydrophobicContact CG-CD1 4.48Å; M495-I507 HydrophobicContact SD-CD1 4.35Å; M495-Y514 HydrophobicContact CE-CD1 3.84Å; M495-Y514 HydrophobicContact CE-CE1 3.45Å; M495-Y514 VanDerWaalsContact CE-CE1 3.45Å; M495-L517 HydrophobicContact CE-CD1 3.4Å; M495-L517 VanDerWaalsContact CE-CD1 3.4Å; M495-L517 HydrophobicContact SD-CD1 3.98Å; M495-F622 HydrophobicContact SD-CE1 4.34Å; M495-F622 HydrophobicContact SD-CE2 4.2Å; M495-F622 HydrophobicContact SD-CZ 3.47Å; M495-F622 WeakPolarHBondContact SD-CZ 3.15Å; M495-F626 HydrophobicContact CB-CD2 4.17Å; M495-F626 HydrophobicContact CE-CE2 4.3Å; M495-F626 HydrophobicContact CG-CD2 3.93Å; M495-F626 HydrophobicContact CG-CE2 4.09Å; M495-F626 HydrophobicContact SD-CD2 4.24Å; M495-V647 HydrophobicContact CE-CB 4.12Å; M495-V647 HydrophobicContact CE-CG1 3.89Å; M495-V647 HydrophobicContact CE-CG2 3.43Å; M495-V647 VanDerWaalsContact CE-CG2 3.43Å; M495-V647 HydrophobicContact CG-CG1 3.86Å; M495-V647 HydrophobicContact CG-CG2 4.12Å; M495-V647 HydrophobicContact SD-CG1 4.41Å
496	G	93.9	Very high	90.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-42.9	174.1	0	0	0	0	0	113	G492 T493 L494 A498 V499 Y500 C630	G492-G496 PolarHBondContact O-N 3.08Å; T493-G496 PolarHBondContact O-N 2.91Å; L494-G496 VanDerWaalsContact C-N 3.29Å; L494-G496 PolarHBondContact O-N 2.76Å; G496-A498 VanDerWaalsContact C-N 3.3Å; G496-A498 PolarHBondContact O-N 2.84Å; G496-V499 PolarHBondContact O-N 3.17Å; G496-Y500 WeakPolarHBondContact O-CB 3.47Å; G496-Y500 PolarHBondContact O-N 2.89Å; G496-C630 VanDerWaalsContact CA-SG 3.57Å; G496-C630 PolarHBondContact O-SG 2.87Å
497	L	93.9	Very high	90.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.2	-37.4	175.1	-76	173	0	0	0	111.6	L403 L420 L427 W450 F451 T493 L494 Y500 N501 V629	L403-L497 HydrophobicContact CD2-CD2 4.07Å; L420-L497 HydrophobicContact CD2-CD1 3.65Å; L427-L497 HydrophobicContact CD2-CD1 4.49Å; L427-L497 WeakPolarHBondContact O-CD2 3.17Å; W450-L497 HydrophobicContact CH2-CD1 4.48Å; F451-L497 HydrophobicContact CE1-CB 4.38Å; F451-L497 HydrophobicContact CZ-CB 3.86Å; T493-L497 HydrophobicContact CG2-CD1 4.19Å; T493-L497 HydrophobicContact CG2-CG 4.35Å; T493-L497 WeakPolarHBondContact O-CB 3.26Å; T493-L497 WeakPolarHBondContact O-CG 3.45Å; T493-L497 PolarHBondContact O-N 3.22Å; L494-L497 PolarHBondContact O-N 3.47Å; L497-Y500 PolarHBondContact O-N 3.03Å; L497-N501 WeakPolarHBondContact O-CB 3.42Å; L497-N501 PolarHBondContact O-N 2.87Å; L497-N501 PolarHBondContact O-ND2 3.15Å; L497-V629 HydrophobicContact CD2-CG1 3.98Å; L497-V629 HydrophobicContact CD2-CG2 4.18Å; L497-V629 HydrophobicContact CG-CG1 4.46Å; L497-V629 HydrophobicContact CG-CG2 4.09Å
498	A	91.7	Very high	90.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.2	-50.8	178.2	0	0	0	0	0	111.1	F451 L494 M495 G496 Y500 N501 S502 I503 L505	F451-A498 HydrophobicContact CE1-CB 4.08Å; F451-A498 HydrophobicContact CZ-CB 4.24Å; L494-A498 WeakPolarHBondContact O-CB 3.22Å; L494-A498 PolarHBondContact O-N 2.88Å; M495-A498 PolarHBondContact O-N 3.07Å; G496-A498 VanDerWaalsContact C-N 3.3Å; G496-A498 PolarHBondContact O-N 2.84Å; A498-Y500 PolarHBondContact O-N 3.31Å; A498-N501 CarbonylContact O-C 3.5Å; A498-N501 PolarHBondContact O-N 3.02Å; A498-S502 PolarHBondContact O-N 2.87Å; A498-I503 CarbonylContact C-O 3.54Å; A498-I503 WeakPolarHBondContact CB-O 3.21Å; A498-I503 PolarHBondContact O-N 3.36Å; A498-L505 HydrophobicContact CB-CD1 3.61Å; A498-L505 HydrophobicContact CB-CD2 3.68Å; A498-L505 HydrophobicContact CB-CG 3.53Å
499	V	91.4	Very high	90.6	Very high	8 Å²	8	19.6 Å²	19.6	5%	0.048	11%	0.112	C	C	.	.	H	α-helix	trans	-59.8	-46.8	174.6	175.9	0	0	0	0	111.2	I370 M495 G496 N501 S502 F626 V647	I370-V499 HydrophobicContact CG2-CG1 4.26Å; M495-V499 PolarHBondContact O-N 3.2Å; G496-V499 PolarHBondContact O-N 3.17Å; V499-N501 VanDerWaalsContact C-N 3.26Å; V499-N501 PolarHBondContact O-N 3.33Å; V499-S502 PolarHBondContact O-N 3.07Å; V499-S502 VanDerWaalsContact O-N 3.08Å; V499-F626 HydrophobicContact CG2-CE2 4.32Å; V499-V647 HydrophobicContact CG2-CB 4.48Å; V499-V647 HydrophobicContact CG2-CG2 3.46Å; V499-V647 VanDerWaalsContact CG2-CG2 3.46Å
500	Y	90.6	Very high	90.7	Very high	5 Å²	5	17.4 Å²	17.4	2%	0.02	10%	0.103	C	C	.	.	H	α-helix	trans	-63.6	-28.4	-178.2	-167.9	-108.8	0	0	0	113.5	S374 Q377 M378 K428 G496 L497 A498 V629	S374-Y500 VanDerWaalsContact CB-CD2 3.41Å; S374-Y500 VanDerWaalsContact CB-CE2 3.47Å; S374-Y500 WeakPolarHBondContact CB-O 3.38Å; S374-Y500 PolarHBondContact O-OH 3.24Å; S374-Y500 WeakPolarHBondContact OG-CD2 3.12Å; Q377-Y500 HydrophobicContact CB-CE2 4.35Å; Q377-Y500 WeakPolarHBondContact CB-OH 3.25Å; M378-Y500 HydrophobicContact CE-CD1 3.24Å; M378-Y500 HydrophobicContact CE-CE1 3.23Å; M378-Y500 HydrophobicContact CE-CG 4.13Å; M378-Y500 VanDerWaalsContact CE-O 3.3Å; M378-Y500 WeakPolarHBondContact CE-O 3.49Å; M378-Y500 HydrophobicContact CG-CD1 4.43Å; M378-Y500 HydrophobicContact CG-CE1 3.43Å; M378-Y500 VanDerWaalsContact CG-CE1 3.43Å; M378-Y500 WeakPolarHBondContact CG-OH 3.23Å; M378-Y500 PolarHBondContact N-OH 3.14Å; M378-Y500 HydrophobicContact SD-CE1 4.17Å; K428-Y500 HydrophobicContact CB-CE1 4.43Å; K428-Y500 WeakPolarHBondContact O-CE1 3.46Å; K428-Y500 PolarHBondContact O-OH 3.11Å; G496-Y500 WeakPolarHBondContact O-CB 3.47Å; G496-Y500 PolarHBondContact O-N 2.89Å; L497-Y500 PolarHBondContact O-N 3.03Å; A498-Y500 PolarHBondContact O-N 3.31Å; Y500-V629 HydrophobicContact CD1-CG1 3.91Å; Y500-V629 HydrophobicContact CD2-CG1 4.1Å; Y500-V629 HydrophobicContact CG-CG1 3.62Å
501	N	88.7	Confident	90.8	Very high	37 Å²	37	18.6 Å²	18.6	20%	0.198	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	8.1	176.2	-66.8	-88.5	0	0	0	113.1	M378 L497 A498 V499 I503	M378-N501 WeakPolarHBondContact CE-OD1 3.32Å; L497-N501 WeakPolarHBondContact O-CB 3.42Å; L497-N501 PolarHBondContact O-N 2.87Å; L497-N501 PolarHBondContact O-ND2 3.15Å; A498-N501 CarbonylContact O-C 3.5Å; A498-N501 PolarHBondContact O-N 3.02Å; V499-N501 VanDerWaalsContact C-N 3.26Å; V499-N501 PolarHBondContact O-N 3.33Å; N501-I503 VanDerWaalsContact C-N 3.33Å; N501-I503 HydrophobicContact CB-CD1 3.93Å; N501-I503 HydrophobicContact CB-CG1 4.26Å; N501-I503 PolarHBondContact O-N 2.8Å
502	S	87.4	Confident	91	Very high	61 Å²	61	18.2 Å²	18.2	43%	0.427	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	41.9	-178.3	-56.6	0	0	0	0	114	A498 V499	A498-S502 PolarHBondContact O-N 2.87Å; V499-S502 PolarHBondContact O-N 3.07Å; V499-S502 VanDerWaalsContact O-N 3.08Å
503	I	86.4	Confident	91	Very high	29 Å²	29	18.2 Å²	18.2	15%	0.149	11%	0.107	C	C	.	.			trans	-109.2	127.6	178.1	-64.2	168.6	0	0	0	108.7	T447 F451 A498 N501	T447-I503 HydrophobicContact CG2-CD1 3.47Å; T447-I503 VanDerWaalsContact CG2-CD1 3.47Å; F451-I503 HydrophobicContact CD2-CD1 3.84Å; F451-I503 HydrophobicContact CD2-CG2 4.01Å; F451-I503 HydrophobicContact CE2-CD1 3.62Å; F451-I503 HydrophobicContact CE2-CG2 4.49Å; F451-I503 HydrophobicContact CG-CG2 4.45Å; A498-I503 CarbonylContact C-O 3.54Å; A498-I503 WeakPolarHBondContact CB-O 3.21Å; A498-I503 PolarHBondContact O-N 3.36Å; N501-I503 VanDerWaalsContact C-N 3.33Å; N501-I503 HydrophobicContact CB-CD1 3.93Å; N501-I503 HydrophobicContact CB-CG1 4.26Å; N501-I503 PolarHBondContact O-N 2.8Å
504	A	86.2	Confident	91	Very high	52 Å²	52	17.8 Å²	17.8	43%	0.43	11%	0.105	S	C	.	.			trans	-79.4	142.3	172.4	0	0	0	0	0	110.9	V647	A504-V647 CarbonylContact C-O 3.45Å; A504-V647 VanDerWaalsContact CA-O 3.31Å; A504-V647 WeakPolarHBondContact CA-O 3.38Å
505	L	88.4	Confident	91.1	Very high	8 Å²	8	20.9 Å²	20.9	4%	0.042	12%	0.116	C	C	.	.			trans	-108.7	138.8	176.5	-59.7	-177.4	0	0	0	110.2	F451 V455 M495 A498 I507 V647	F451-L505 HydrophobicContact CB-CD2 3.95Å; F451-L505 HydrophobicContact CD1-CD2 3.62Å; F451-L505 HydrophobicContact CE1-CD2 4.34Å; F451-L505 HydrophobicContact CG-CD2 3.95Å; V455-L505 HydrophobicContact CG2-CD2 4.18Å; M495-L505 HydrophobicContact CB-CD1 4.38Å; M495-L505 HydrophobicContact CG-CD1 4.48Å; A498-L505 HydrophobicContact CB-CD1 3.61Å; A498-L505 HydrophobicContact CB-CD2 3.68Å; A498-L505 HydrophobicContact CB-CG 3.53Å; L505-I507 HydrophobicContact CB-CD1 4.31Å; L505-I507 HydrophobicContact CB-CG1 4.13Å; L505-I507 HydrophobicContact CB-CG2 4.16Å; L505-I507 HydrophobicContact CD1-CD1 4.27Å; L505-I507 PolarHBondContact O-N 3.37Å; L505-V647 HydrophobicContact CB-CG1 4.37Å; L505-V647 HydrophobicContact CD1-CG1 4.25Å; L505-V647 PolarHBondContact N-O 3.38Å
506	D	83.8	Confident	91.2	Very high	50 Å²	50	20.8 Å²	20.8	27%	0.267	12%	0.115	S	C	.	.			trans	-81.5	67.1	172.8	-169.1	26.1	0	0	0	110.4	V455 H694	V455-D506 WeakPolarHBondContact CG1-O 3.18Å; D506-H694 IonicContact OD2-CE1 3.4Å
507	I	87.1	Confident	91.2	Very high	6 Å²	6	20.8 Å²	20.8	3%	0.031	12%	0.115	C	C	.	.			trans	-122	145	177.4	65.9	179.4	0	0	0	110.1	V455 F459 M495 L505 F509 V647 C648	V455-I507 HydrophobicContact CG1-CG2 3.52Å; V455-I507 HydrophobicContact CG2-CG2 4.18Å; F459-I507 HydrophobicContact CD2-CG2 4.12Å; F459-I507 HydrophobicContact CE2-CB 4.47Å; F459-I507 HydrophobicContact CE2-CG2 3.51Å; F459-I507 HydrophobicContact CZ-CB 4.33Å; F459-I507 HydrophobicContact CZ-CG2 3.81Å; M495-I507 HydrophobicContact SD-CD1 4.35Å; L505-I507 HydrophobicContact CB-CD1 4.31Å; L505-I507 HydrophobicContact CB-CG1 4.13Å; L505-I507 HydrophobicContact CB-CG2 4.16Å; L505-I507 HydrophobicContact CD1-CD1 4.27Å; L505-I507 PolarHBondContact O-N 3.37Å; I507-F509 HydrophobicContact CD1-CD2 3.82Å; I507-F509 HydrophobicContact CD1-CE2 3.78Å; I507-F509 HydrophobicContact CG1-CD2 4.36Å; I507-V647 HydrophobicContact CD1-CG1 3.57Å; I507-V647 HydrophobicContact CG1-CG1 4.12Å; I507-C648 PolarHBondContact O-SG 3.2Å
508	H	87.8	Confident	91.2	Very high	59 Å²	59	21.8 Å²	21.8	27%	0.273	12%	0.12	S	C	.	.			trans	-124.4	94.8	177	-89.1	80.5	0	0	0	109.8	C474 H475 R701	C474-H508 WeakPolarHBondContact CA-O 3.5Å; H475-H508 PolarHBondContact N-O 2.63Å; H508-R701 PolarHBondContact NE2-NH2 2.83Å; H508-R701 VanDerWaalsContact NE2-NH2 3.11Å
509	F	93.3	Very high	91.2	Very high	9 Å²	9	24.1 Å²	24.1	4%	0.039	14%	0.135	C	C	.	.			trans	-103.3	150.4	169.1	-72.7	-57.5	0	0	0	110.4	F459 F466 H475 F477 I507 C513 Y514 F622	F459-F509 AromaticContact CE1-CE1 3.77Å; F459-F509 HydrophobicContact CE1-CE1 3.77Å; F459-F509 HydrophobicContact CE1-CE2 4.2Å; F459-F509 AromaticContact CE1-CZ 3.44Å; F459-F509 HydrophobicContact CE1-CZ 3.44Å; F459-F509 VanDerWaalsContact CE1-CZ 3.44Å; F459-F509 HydrophobicContact CZ-CE1 4.24Å; F459-F509 AromaticContact CZ-CE2 3.87Å; F459-F509 HydrophobicContact CZ-CE2 3.87Å; F459-F509 AromaticContact CZ-CZ 3.44Å; F459-F509 HydrophobicContact CZ-CZ 3.44Å; F459-F509 VanDerWaalsContact CZ-CZ 3.44Å; F466-F509 AromaticContact CD1-CE1 3.89Å; F466-F509 HydrophobicContact CD1-CE1 3.89Å; F466-F509 HydrophobicContact CD1-CZ 4.23Å; F466-F509 AromaticContact CE1-CE1 3.78Å; F466-F509 HydrophobicContact CE1-CE1 3.78Å; F466-F509 AromaticContact CE1-CZ 3.74Å; F466-F509 HydrophobicContact CE1-CZ 3.74Å; F466-F509 HydrophobicContact CZ-CZ 4.1Å; H475-F509 HydrophobicContact CB-CD1 4.32Å; H475-F509 HydrophobicContact CB-CE1 4.16Å; H475-F509 VanDerWaalsContact O-CD1 3.3Å; H475-F509 WeakPolarHBondContact O-CD1 3.21Å; F477-F509 HydrophobicContact CE2-CE1 4.4Å; I507-F509 HydrophobicContact CD1-CD2 3.82Å; I507-F509 HydrophobicContact CD1-CE2 3.78Å; I507-F509 HydrophobicContact CG1-CD2 4.36Å; F509-C513 HydrophobicContact CB-CB 3.82Å; F509-C513 HydrophobicContact CG-CB 4.29Å; F509-Y514 HydrophobicContact CB-CE2 3.84Å; F509-F622 HydrophobicContact CE2-CZ 4.31Å
510	P	94.3	Very high	91.2	Very high	8 Å²	8	25.5 Å²	25.5	5%	0.052	14%	0.144	C	C	.	.			trans	-67.1	153.6	170.7	30.8	-36.5	0	0	0	110.6	W476 Y512 C513 Q543 V544	W476-P510 HydrophobicContact CE3-CG 3.52Å; W476-P510 HydrophobicContact CZ3-CG 3.51Å; P510-Y512 PolarHBondContact O-N 2.76Å; P510-C513 VanDerWaalsContact O-CB 3.23Å; P510-C513 WeakPolarHBondContact O-CB 3.31Å; P510-C513 PolarHBondContact O-N 3.15Å; P510-Q543 HydrophobicContact CB-CB 4.25Å; P510-V544 HydrophobicContact CB-CG2 3.91Å; P510-V544 HydrophobicContact CG-CG2 3.72Å
511	L	93	Very high	91	Very high	32 Å²	32	27.1 Å²	27.1	17%	0.168	16%	0.155	C	C	.	.	H	α-helix	trans	-54.8	-32.6	-177	-176.7	60.5	0	0	0	112.7	C513 Y514 R515 P640 E641	L511-C513 PolarHBondContact O-N 2.8Å; L511-Y514 PolarHBondContact O-N 3.15Å; L511-Y514 VanDerWaalsContact O-N 3.11Å; L511-R515 PolarHBondContact O-N 3.34Å; L511-R515 VanDerWaalsContact O-N 3.14Å; L511-P640 HydrophobicContact CD1-CB 3.84Å; L511-P640 HydrophobicContact CG-CB 4.43Å; L511-E641 HydrophobicContact CD1-CB 4.31Å; L511-E641 HydrophobicContact CD1-CG 3.86Å; L511-E641 HydrophobicContact CD2-CG 3.93Å
512	Y	94.9	Very high	90.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-31.3	177.1	-169.5	-106.8	0	0	0	113.3	W476 P510 Y514 R515 K516 A534 A536 D540 L611 N612	W476-Y512 AromaticContact CH2-CD1 3.95Å; W476-Y512 HydrophobicContact CH2-CD1 3.95Å; P510-Y512 PolarHBondContact O-N 2.76Å; Y512-Y514 PolarHBondContact O-N 3.04Å; Y512-R515 PolarHBondContact O-N 3.27Å; Y512-K516 HydrophobicContact CD1-CD 3.84Å; Y512-K516 HydrophobicContact CD1-CG 4.14Å; Y512-K516 HydrophobicContact CE1-CD 3.52Å; Y512-K516 HydrophobicContact CE1-CG 3.72Å; Y512-K516 WeakPolarHBondContact O-CG 3.4Å; Y512-K516 PolarHBondContact O-N 3.41Å; Y512-A534 HydrophobicContact CE2-CB 4.06Å; Y512-A534 PolarHBondContact OH-O 3.49Å; Y512-A536 HydrophobicContact CE1-CB 4.45Å; Y512-A536 HydrophobicContact CE2-CB 3.96Å; Y512-A536 WeakPolarHBondContact OH-CB 3.49Å; Y512-D540 HydrophobicContact CD2-CB 3.67Å; Y512-D540 VanDerWaalsContact CD2-CG 3.49Å; Y512-D540 HydrophobicContact CE2-CB 4.34Å; Y512-D540 HydrophobicContact CG-CB 3.99Å; Y512-L611 HydrophobicContact CD1-CB 4.07Å; Y512-L611 HydrophobicContact CD1-CD1 4.1Å; Y512-L611 HydrophobicContact CE1-CB 3.53Å; Y512-L611 HydrophobicContact CE1-CD1 4.15Å; Y512-L611 HydrophobicContact CE1-CG 4.41Å; Y512-N612 PolarHBondContact OH-ND2 2.7Å; Y512-N612 PolarHBondContact OH-OD1 2.92Å
513	C	95.9	Very high	90.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.6	-45.9	174.6	-177.6	0	0	0	0	111.7	W476 F509 P510 L511 R515 K516 L517	W476-C513 HydrophobicContact CZ3-CB 4.29Å; F509-C513 HydrophobicContact CB-CB 3.82Å; F509-C513 HydrophobicContact CG-CB 4.29Å; P510-C513 VanDerWaalsContact O-CB 3.23Å; P510-C513 WeakPolarHBondContact O-CB 3.31Å; P510-C513 PolarHBondContact O-N 3.15Å; L511-C513 PolarHBondContact O-N 2.8Å; C513-R515 VanDerWaalsContact C-N 3.33Å; C513-R515 PolarHBondContact O-N 2.7Å; C513-K516 PolarHBondContact O-N 2.97Å; C513-L517 PolarHBondContact O-N 2.72Å
514	Y	95.6	Very high	90.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.1	-32.8	178.5	-56.2	-85.6	0	0	0	111.9	M495 F509 L511 Y512 L517 L518 P640 V643 E644 V647 C648	M495-Y514 HydrophobicContact CE-CD1 3.84Å; M495-Y514 HydrophobicContact CE-CE1 3.45Å; M495-Y514 VanDerWaalsContact CE-CE1 3.45Å; F509-Y514 HydrophobicContact CB-CE2 3.84Å; L511-Y514 PolarHBondContact O-N 3.15Å; L511-Y514 VanDerWaalsContact O-N 3.11Å; Y512-Y514 PolarHBondContact O-N 3.04Å; Y514-L517 HydrophobicContact CD1-CD1 4.47Å; Y514-L517 WeakPolarHBondContact O-CB 3.39Å; Y514-L517 PolarHBondContact O-N 3.3Å; Y514-L518 PolarHBondContact O-N 3.16Å; Y514-L518 VanDerWaalsContact O-N 3.16Å; Y514-P640 WeakPolarHBondContact CB-O 3.33Å; Y514-V643 HydrophobicContact CD1-CB 4.18Å; Y514-V643 HydrophobicContact CD1-CG1 3.83Å; Y514-E644 HydrophobicContact CD1-CB 4.2Å; Y514-E644 HydrophobicContact CD2-CB 3.91Å; Y514-E644 HydrophobicContact CD2-CG 4.28Å; Y514-E644 HydrophobicContact CE1-CB 4.03Å; Y514-E644 HydrophobicContact CE1-CG 4.37Å; Y514-E644 HydrophobicContact CE2-CB 3.77Å; Y514-E644 HydrophobicContact CE2-CG 3.67Å; Y514-E644 HydrophobicContact CG-CB 4.12Å; Y514-V647 HydrophobicContact CE1-CB 4.29Å; Y514-V647 HydrophobicContact CE1-CG2 4.29Å; Y514-C648 PolarHBondContact OH-SG 3.2Å
515	R	94.9	Very high	90.8	Very high	72 Å²	72	31.9 Å²	31.9	27%	0.272	19%	0.185	S	C	.	.	H	α-helix	trans	-63.3	-45	172.5	-166.5	-175.2	-58.5	155.2	12.6	111.5	L511 Y512 C513 L517 L518 T519 A534 D540 P640	L511-R515 PolarHBondContact O-N 3.34Å; L511-R515 VanDerWaalsContact O-N 3.14Å; Y512-R515 PolarHBondContact O-N 3.27Å; C513-R515 VanDerWaalsContact C-N 3.33Å; C513-R515 PolarHBondContact O-N 2.7Å; R515-L517 VanDerWaalsContact C-N 3.34Å; R515-L517 PolarHBondContact O-N 2.77Å; R515-L518 CarbonylContact O-C 3.18Å; R515-L518 PolarHBondContact O-N 2.82Å; R515-T519 PolarHBondContact O-N 3.23Å; R515-T519 PolarHBondContact O-OG1 3.23Å; R515-A534 HydrophobicContact CG-CB 4.12Å; R515-D540 IonicContact CZ-OD1 2.68Å; R515-D540 VanDerWaalsContact CZ-OD1 3.27Å; R515-D540 IonicContact CZ-OD2 3.25Å; R515-D540 VanDerWaalsContact NH1-CG 3.31Å; R515-D540 IonicContact NH1-OD1 2.62Å; R515-D540 PolarHBondContact NH1-OD1 2.86Å; R515-D540 IonicContact NH1-OD2 2.69Å; R515-D540 PolarHBondContact NH1-OD2 3.22Å; R515-D540 IonicContact NH2-OD1 2.93Å; R515-D540 PolarHBondContact NH2-OD1 3.22Å; R515-P640 HydrophobicContact CB-CB 4.27Å; R515-P640 HydrophobicContact CB-CG 4.02Å; R515-P640 HydrophobicContact CG-CG 4.15Å
516	K	95.8	Very high	90.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-42.2	173.9	-67.8	170.6	73	72.2	0	111.3	W476 Y512 C513 L518 T519 G532 A534 L611 N612 F619	W476-K516 HydrophobicContact CH2-CD 4.34Å; Y512-K516 HydrophobicContact CD1-CD 3.84Å; Y512-K516 HydrophobicContact CD1-CG 4.14Å; Y512-K516 HydrophobicContact CE1-CD 3.52Å; Y512-K516 HydrophobicContact CE1-CG 3.72Å; Y512-K516 WeakPolarHBondContact O-CG 3.4Å; Y512-K516 PolarHBondContact O-N 3.41Å; C513-K516 PolarHBondContact O-N 2.97Å; K516-L518 PolarHBondContact O-N 3.14Å; K516-T519 PolarHBondContact O-N 3.2Å; K516-G532 WeakPolarHBondContact CE-O 3.49Å; K516-G532 PolarHBondContact NZ-O 2.72Å; K516-G532 WeakPolarHBondContact O-CA 3.06Å; K516-A534 HydrophobicContact CG-CB 4.34Å; K516-L611 WeakPolarHBondContact CE-O 3.38Å; K516-L611 PolarHBondContact NZ-O 3.29Å; K516-N612 PolarHBondContact NZ-OD1 3.46Å; K516-F619 HydrophobicContact CB-CD1 4.22Å; K516-F619 HydrophobicContact CB-CE1 3.38Å; K516-F619 HydrophobicContact CB-CE2 3.91Å; K516-F619 HydrophobicContact CB-CZ 3.19Å; K516-F619 HydrophobicContact CD-CD2 4.1Å; K516-F619 HydrophobicContact CD-CE1 4.39Å; K516-F619 HydrophobicContact CD-CE2 3.83Å; K516-F619 HydrophobicContact CD-CG 4.49Å; K516-F619 HydrophobicContact CD-CZ 4.01Å; K516-F619 VanDerWaalsContact CE-CG 3.4Å; K516-F619 HydrophobicContact CG-CE1 4.47Å; K516-F619 HydrophobicContact CG-CZ 4.25Å
517	L	94.6	Very high	90.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.4	-31.3	176.6	-83.5	177	0	0	0	113.7	M495 C513 Y514 R515 F619 F622 Y623 F626 H627	M495-L517 HydrophobicContact CE-CD1 3.4Å; M495-L517 VanDerWaalsContact CE-CD1 3.4Å; M495-L517 HydrophobicContact SD-CD1 3.98Å; C513-L517 PolarHBondContact O-N 2.72Å; Y514-L517 HydrophobicContact CD1-CD1 4.47Å; Y514-L517 WeakPolarHBondContact O-CB 3.39Å; Y514-L517 PolarHBondContact O-N 3.3Å; R515-L517 VanDerWaalsContact C-N 3.34Å; R515-L517 PolarHBondContact O-N 2.77Å; L517-F619 HydrophobicContact CD2-CZ 4.28Å; L517-F619 HydrophobicContact CG-CZ 4.05Å; L517-F622 HydrophobicContact CD1-CE1 3.87Å; L517-F622 HydrophobicContact CD1-CZ 4.38Å; L517-F622 HydrophobicContact CD2-CD1 3.81Å; L517-F622 HydrophobicContact CD2-CE1 3.56Å; L517-F622 HydrophobicContact CG-CD1 4.49Å; L517-F622 HydrophobicContact CG-CE1 3.88Å; L517-Y623 VanDerWaalsContact O-CE2 3.26Å; L517-Y623 WeakPolarHBondContact O-CE2 3.46Å; L517-F626 HydrophobicContact CD1-CD2 4.49Å; L517-F626 HydrophobicContact CD2-CB 3.93Å; L517-F626 HydrophobicContact CD2-CD1 4.11Å; L517-F626 HydrophobicContact CD2-CG 3.99Å; L517-H627 PolarHBondContact O-NE2 2.99Å
518	L	93.1	Very high	90.1	Very high	21 Å²	21	45 Å²	45	11%	0.11	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	11.6	176.6	-65.2	-178.7	0	0	0	113.7	Y514 R515 K516 P520 P521 P640 V643	Y514-L518 PolarHBondContact O-N 3.16Å; Y514-L518 VanDerWaalsContact O-N 3.16Å; R515-L518 CarbonylContact O-C 3.18Å; R515-L518 PolarHBondContact O-N 2.82Å; K516-L518 PolarHBondContact O-N 3.14Å; L518-P520 CarbonylContact C-O 3.58Å; L518-P520 CarbonylContact O-C 3.57Å; L518-P520 WeakPolarHBondContact O-CA 3.23Å; L518-P521 HydrophobicContact CD2-CB 4.17Å; L518-P521 WeakPolarHBondContact O-CD 3.34Å; L518-P640 HydrophobicContact CD1-CG 4.16Å; L518-V643 HydrophobicContact CD1-CG2 3.72Å; L518-V643 HydrophobicContact CD2-CG2 3.97Å; L518-V643 HydrophobicContact CG-CG2 4.03Å
519	T	92.3	Very high	90.1	Very high	49 Å²	49	43.6 Å²	43.6	30%	0.301	26%	0.26	S	S	.	.	S	Bend	trans	-119.2	93.8	-179.1	-50	0	0	0	0	111.8	R515 K516 V531 G532 T533	R515-T519 PolarHBondContact O-N 3.23Å; R515-T519 PolarHBondContact O-OG1 3.23Å; K516-T519 PolarHBondContact O-N 3.2Å; T519-V531 CarbonylContact O-C 3.54Å; T519-G532 PolarHBondContact O-N 3.45Å; T519-T533 WeakPolarHBondContact CG2-O 3.41Å
520	P	91.4	Very high	89.9	Confident	38 Å²	38	50.9 Å²	50.9	25%	0.247	29%	0.292	C	S	.	.	S	Bend	cis	-74.9	166.1	-11.1	30.6	-31.9	0	0	0	112.8	L518 T522 P524 V531 Y623	L518-P520 CarbonylContact C-O 3.58Å; L518-P520 CarbonylContact O-C 3.57Å; L518-P520 WeakPolarHBondContact O-CA 3.23Å; P520-T522 VanDerWaalsContact CG-O 3.32Å; P520-T522 WeakPolarHBondContact CG-O 3.31Å; P520-T522 PolarHBondContact O-N 2.72Å; P520-P524 HydrophobicContact CG-CG 3.68Å; P520-V531 HydrophobicContact CG-CG1 4.45Å; P520-Y623 VanDerWaalsContact O-CE2 3.26Å; P520-Y623 WeakPolarHBondContact O-CE2 3.45Å; P520-Y623 PolarHBondContact O-OH 3.18Å
521	P	85.8	Confident	89.8	Confident	39 Å²	39	50.7 Å²	50.7	25%	0.253	29%	0.291	S	S	.	.	S	Bend	trans	-79.1	-6.5	179.4	31.5	-35.1	0	0	0	112.8	L518 H627 M636	L518-P521 HydrophobicContact CD2-CB 4.17Å; L518-P521 WeakPolarHBondContact O-CD 3.34Å; P521-H627 PolarHBondContact O-CE1 3.18Å; P521-M636 HydrophobicContact CB-CG 4.47Å; P521-M636 HydrophobicContact CG-CG 4.25Å
522	T	86.1	Confident	89.8	Confident	53 Å²	53	49.1 Å²	49.1	33%	0.325	28%	0.283	S	S	.	.	S	Bend	trans	-134.1	135.4	175.4	56.8	0	0	0	0	108.9	P520 P524 M636	P520-T522 VanDerWaalsContact CG-O 3.32Å; P520-T522 WeakPolarHBondContact CG-O 3.31Å; P520-T522 PolarHBondContact O-N 2.72Å; T522-P524 WeakPolarHBondContact O-CD 3.2Å; T522-M636 HydrophobicContact CG2-CG 3.99Å; T522-M636 HydrophobicContact CG2-SD 3.97Å
523	V	87.2	Confident	89.6	Confident	58 Å²	58	51.5 Å²	51.5	35%	0.352	30%	0.297	S	S	.	.			trans	-59.1	122.3	178.2	-172	0	0	0	0	110	Y623 H627	V523-Y623 HydrophobicContact CG2-CE1 4.05Å; V523-H627 HydrophobicContact CG2-CB 3.3Å
524	P	86.7	Confident	89.4	Confident	41 Å²	41	52 Å²	52	27%	0.266	30%	0.301	S	S	.	.			trans	-60.1	149.2	174.6	-24.5	36.3	0	0	0	111.5	P520 T522 D526 A529 V531	P520-P524 HydrophobicContact CG-CG 3.68Å; T522-P524 WeakPolarHBondContact O-CD 3.2Å; P524-D526 PolarHBondContact O-N 3.13Å; P524-A529 HydrophobicContact CB-CB 3.59Å; P524-A529 HydrophobicContact CG-CB 3.72Å; P524-V531 HydrophobicContact CG-CG1 4.18Å
525	S	84.9	Confident	89.2	Confident	127 Å²	127	54.7 Å²	54.7	89%	0.888	32%	0.318	S	S	*	.	S	Bend	trans	-70.1	-23.1	174.5	-52.8	0	0	0	0	112.9	P527	S525-P527 WeakPolarHBondContact O-CD 3.34Å
526	D	85.9	Confident	89.1	Confident	89 Å²	89	51.3 Å²	51.3	48%	0.476	31%	0.305	S	S	.	.	S	Bend	trans	-79.6	115.3	173.2	179.2	7.3	0	0	0	109.8	P524 N528 A529	P524-D526 PolarHBondContact O-N 3.13Å; D526-N528 PolarHBondContact O-N 3.27Å; D526-N528 PolarHBondContact OD1-N 3.02Å; D526-A529 HydrophobicContact CB-CB 4.27Å; D526-A529 WeakPolarHBondContact O-CB 3.2Å; D526-A529 PolarHBondContact O-N 2.55Å; D526-A529 VanDerWaalsContact O-N 3.13Å
527	P	78.5	Confident	88.9	Confident	116 Å²	116	53 Å²	53	75%	0.753	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.1	179.2	26.6	-33.6	0	0	0	113.8	S525	S525-P527 WeakPolarHBondContact O-CD 3.34Å
528	N	80.6	Confident	88.9	Confident	134 Å²	134	55 Å²	55	72%	0.717	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-2.2	176.7	-61.6	-48.8	0	0	0	113.3	D526 F530	D526-N528 PolarHBondContact O-N 3.27Å; D526-N528 PolarHBondContact OD1-N 3.02Å; N528-F530 PolarHBondContact O-N 3.11Å
529	A	87.2	Confident	88.9	Confident	30 Å²	30	58.6 Å²	58.6	25%	0.248	35%	0.346	C	S	.	.	S	Bend	trans	-63.9	134	178.4	0	0	0	0	0	110.6	P524 D526 V531	P524-A529 HydrophobicContact CB-CB 3.59Å; P524-A529 HydrophobicContact CG-CB 3.72Å; D526-A529 HydrophobicContact CB-CB 4.27Å; D526-A529 WeakPolarHBondContact O-CB 3.2Å; D526-A529 PolarHBondContact O-N 2.55Å; D526-A529 VanDerWaalsContact O-N 3.13Å; A529-V531 PolarHBondContact O-N 2.87Å
530	F	89	Confident	89	Confident	161 Å²	161	56.4 Å²	56.4	71%	0.706	33%	0.332	S	S	*	.			trans	-65.2	130.7	172.9	-74.4	-90.1	0	0	0	110	N528 Y616	N528-F530 PolarHBondContact O-N 3.11Å; F530-Y616 HydrophobicContact CD1-CE1 4.33Å; F530-Y616 AromaticContact CD1-CE2 3.8Å; F530-Y616 HydrophobicContact CD1-CE2 3.8Å; F530-Y616 AromaticContact CD1-CZ 3.55Å; F530-Y616 VanDerWaalsContact CD1-OH 3.24Å; F530-Y616 WeakPolarHBondContact CD1-OH 3.47Å; F530-Y616 HydrophobicContact CE1-CE1 4.34Å; F530-Y616 HydrophobicContact CE1-CE2 4.48Å
531	V	93	Very high	89.1	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.024	32%	0.32	C	S	.	.			trans	-128.4	163.8	177.9	-61.6	0	0	0	0	109.7	T519 P520 P524 A529 T533 Y616 A620 Y623	T519-V531 CarbonylContact O-C 3.54Å; P520-V531 HydrophobicContact CG-CG1 4.45Å; P524-V531 HydrophobicContact CG-CG1 4.18Å; A529-V531 PolarHBondContact O-N 2.87Å; V531-T533 PolarHBondContact O-N 2.91Å; V531-T533 PolarHBondContact O-OG1 3.24Å; V531-Y616 WeakPolarHBondContact O-CE2 3.35Å; V531-A620 HydrophobicContact CG2-CB 4.26Å; V531-Y623 HydrophobicContact CB-CD1 3.67Å; V531-Y623 HydrophobicContact CB-CD2 4.38Å; V531-Y623 HydrophobicContact CB-CE1 3.53Å; V531-Y623 HydrophobicContact CB-CE2 4.22Å; V531-Y623 HydrophobicContact CB-CG 4.13Å; V531-Y623 HydrophobicContact CG1-CD1 4.23Å; V531-Y623 HydrophobicContact CG1-CE1 3.65Å; V531-Y623 HydrophobicContact CG2-CD1 3.5Å; V531-Y623 VanDerWaalsContact CG2-CD1 3.5Å; V531-Y623 HydrophobicContact CG2-CE1 3.83Å; V531-Y623 HydrophobicContact CG2-CG 4.03Å
532	G	91.9	Very high	89.6	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.332	C	S	.	.	S	Bend	trans	66.9	19.7	175	0	0	0	0	0	114.3	K516 T519	K516-G532 WeakPolarHBondContact CE-O 3.49Å; K516-G532 PolarHBondContact NZ-O 2.72Å; K516-G532 WeakPolarHBondContact O-CA 3.06Å; T519-G532 PolarHBondContact O-N 3.45Å
533	T	91.3	Very high	89.8	Confident	50 Å²	50	58.9 Å²	58.9	31%	0.307	33%	0.333	S	S	.	.			trans	-122.3	115.4	-175.8	-55.7	0	0	0	0	109.1	T519 V531 N612	T519-T533 WeakPolarHBondContact CG2-O 3.41Å; V531-T533 PolarHBondContact O-N 2.91Å; V531-T533 PolarHBondContact O-OG1 3.24Å; T533-N612 HydrophobicContact CG2-CB 4.16Å
534	A	91.9	Very high	90.1	Very high	10 Å²	10	56.1 Å²	56.1	8%	0.083	32%	0.316	C	S	.	.			trans	-116.9	164.3	178	0	0	0	0	0	109.9	Y512 R515 K516 A536 N612	Y512-A534 HydrophobicContact CE2-CB 4.06Å; Y512-A534 PolarHBondContact OH-O 3.49Å; R515-A534 HydrophobicContact CG-CB 4.12Å; K516-A534 HydrophobicContact CG-CB 4.34Å; A534-A536 PolarHBondContact O-N 3.16Å; A534-N612 PolarHBondContact O-ND2 2.93Å
535	T	90.3	Very high	90.5	Very high	56 Å²	56	55.9 Å²	55.9	34%	0.344	31%	0.312	S	S	.	.			trans	-72.9	120.2	170.1	-51.2	0	0	0	0	109	D52	D52-T535 WeakPolarHBondContact CB-OG1 3.48Å; D52-T535 WeakPolarHBondContact OD1-CB 3.41Å; D52-T535 VanDerWaalsContact OD1-CG2 3.32Å; D52-T535 WeakPolarHBondContact OD1-CG2 3.25Å; D52-T535 PolarHBondContact OD1-OG1 3.22Å; D52-T535 PolarHBondContact OD2-OG1 3.17Å
536	A	92.6	Very high	90.9	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.008	28%	0.279	C	S	.	.			trans	-92.3	139.3	179.7	0	0	0	0	0	111	Y512 A534 Q604 I607 L611	Y512-A536 HydrophobicContact CE1-CB 4.45Å; Y512-A536 HydrophobicContact CE2-CB 3.96Å; Y512-A536 WeakPolarHBondContact OH-CB 3.49Å; A534-A536 PolarHBondContact O-N 3.16Å; A536-Q604 PolarHBondContact O-NE2 2.8Å; A536-I607 HydrophobicContact CB-CG2 3.44Å; A536-I607 VanDerWaalsContact CB-CG2 3.44Å; A536-L611 HydrophobicContact CB-CB 4.32Å; A536-L611 HydrophobicContact CB-CD1 4.06Å
537	T	92.8	Very high	91.3	Very high	37 Å²	37	52.5 Å²	52.5	23%	0.227	29%	0.286	C	S	.	.			trans	-114.9	168.8	175.7	66.2	0	0	0	0	111.3	D539 D540 L541	T537-D539 VanDerWaalsContact C-N 3.25Å; T537-D539 PolarHBondContact O-N 2.93Å; T537-D540 WeakPolarHBondContact CB-OD2 3.42Å; T537-D540 PolarHBondContact N-OD2 3.47Å; T537-D540 WeakPolarHBondContact O-CB 3.41Å; T537-D540 PolarHBondContact O-N 2.94Å; T537-D540 VanDerWaalsContact O-N 3.16Å; T537-D540 PolarHBondContact OG1-N 3.47Å; T537-D540 PolarHBondContact OG1-OD2 2.85Å; T537-L541 PolarHBondContact O-N 3.08Å; T537-L541 VanDerWaalsContact O-N 3.08Å
538	L	94.2	Very high	92	Very high	42 Å²	42	49.5 Å²	49.5	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-62	-35.6	175.4	-170.5	65.7	0	0	0	111.8	D540 L541 Q542 A549 L552 A553 L556 V603 I607	L538-D540 VanDerWaalsContact C-N 3.3Å; L538-D540 PolarHBondContact O-N 3.4Å; L538-L541 HydrophobicContact CD1-CD2 4.48Å; L538-L541 WeakPolarHBondContact O-CB 3.37Å; L538-L541 PolarHBondContact O-N 2.91Å; L538-Q542 PolarHBondContact O-N 3.25Å; L538-A549 HydrophobicContact CD1-CB 4.2Å; L538-L552 HydrophobicContact CD1-CB 4Å; L538-A553 HydrophobicContact CD2-CB 3.93Å; L538-L556 HydrophobicContact CD2-CD1 4.08Å; L538-V603 HydrophobicContact CD1-CG1 4.47Å; L538-I607 HydrophobicContact CB-CD1 4.22Å; L538-I607 HydrophobicContact CD1-CD1 4.02Å
539	D	92.6	Very high	92.8	Very high	96 Å²	96	43.3 Å²	43.3	51%	0.513	23%	0.231	S	C	.	.	H	α-helix	trans	-65.7	-33.9	175.5	-58.7	-20.2	0	0	0	111.8	T537 Q542 Q543	T537-D539 VanDerWaalsContact C-N 3.25Å; T537-D539 PolarHBondContact O-N 2.93Å; D539-Q542 PolarHBondContact O-N 3.3Å; D539-Q543 PolarHBondContact O-N 3.08Å; D539-Q543 PolarHBondContact O-NE2 3.3Å
540	D	94.1	Very high	93.2	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.011	24%	0.244	C	C	.	.	H	α-helix	trans	-69.1	-39.8	173.8	-60.2	-56.5	0	0	0	110.6	Y512 R515 T537 L538 Q542 Q543 L611	Y512-D540 HydrophobicContact CD2-CB 3.67Å; Y512-D540 VanDerWaalsContact CD2-CG 3.49Å; Y512-D540 HydrophobicContact CE2-CB 4.34Å; Y512-D540 HydrophobicContact CG-CB 3.99Å; R515-D540 IonicContact CZ-OD1 2.68Å; R515-D540 VanDerWaalsContact CZ-OD1 3.27Å; R515-D540 IonicContact CZ-OD2 3.25Å; R515-D540 VanDerWaalsContact NH1-CG 3.31Å; R515-D540 IonicContact NH1-OD1 2.62Å; R515-D540 PolarHBondContact NH1-OD1 2.86Å; R515-D540 IonicContact NH1-OD2 2.69Å; R515-D540 PolarHBondContact NH1-OD2 3.22Å; R515-D540 IonicContact NH2-OD1 2.93Å; R515-D540 PolarHBondContact NH2-OD1 3.22Å; T537-D540 WeakPolarHBondContact CB-OD2 3.42Å; T537-D540 PolarHBondContact N-OD2 3.47Å; T537-D540 WeakPolarHBondContact O-CB 3.41Å; T537-D540 PolarHBondContact O-N 2.94Å; T537-D540 VanDerWaalsContact O-N 3.16Å; T537-D540 PolarHBondContact OG1-N 3.47Å; T537-D540 PolarHBondContact OG1-OD2 2.85Å; L538-D540 VanDerWaalsContact C-N 3.3Å; L538-D540 PolarHBondContact O-N 3.4Å; D540-Q542 VanDerWaalsContact C-N 3.34Å; D540-Q543 PolarHBondContact O-N 3.36Å; D540-L611 HydrophobicContact CB-CD1 4.23Å
541	L	95.3	Very high	93.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.8	-40.9	174	-176.2	67.9	0	0	0	111.3	T537 L538 Q543 V544 M545 L548 A549 L552 I607 L610 L611	T537-L541 PolarHBondContact O-N 3.08Å; T537-L541 VanDerWaalsContact O-N 3.08Å; L538-L541 HydrophobicContact CD1-CD2 4.48Å; L538-L541 WeakPolarHBondContact O-CB 3.37Å; L538-L541 PolarHBondContact O-N 2.91Å; L541-Q543 PolarHBondContact O-N 3.47Å; L541-V544 PolarHBondContact O-N 3Å; L541-M545 HydrophobicContact CD1-CB 4.14Å; L541-M545 HydrophobicContact CD1-CE 3.36Å; L541-M545 HydrophobicContact CD1-SD 4.25Å; L541-M545 CarbonylContact O-C 3.59Å; L541-M545 PolarHBondContact O-N 3.48Å; L541-L548 HydrophobicContact CD2-CD2 4.37Å; L541-L548 HydrophobicContact CD2-CG 4.24Å; L541-A549 HydrophobicContact CB-CB 4.3Å; L541-A549 HydrophobicContact CD2-CB 4.12Å; L541-A549 HydrophobicContact CG-CB 4.07Å; L541-L552 HydrophobicContact CD2-CD1 3.62Å; L541-I607 HydrophobicContact CB-CG1 4.36Å; L541-I607 HydrophobicContact CB-CG2 4.37Å; L541-I607 HydrophobicContact CD2-CG1 3.92Å; L541-L610 HydrophobicContact CD1-CD1 4.17Å; L541-L611 HydrophobicContact CB-CD1 4.31Å; L541-L611 HydrophobicContact CD1-CD1 4.38Å; L541-L611 HydrophobicContact CD1-CD2 4.31Å; L541-L611 HydrophobicContact CD1-CG 4.32Å
542	Q	94.6	Very high	93.7	Very high	109 Å²	109	41.4 Å²	41.4	51%	0.509	23%	0.227	S	C	.	.	H	α-helix	trans	-59.3	-33.3	-179.9	-170	177.4	25.2	0	0	112.7	L538 D539 D540 V544 P546 A549	L538-Q542 PolarHBondContact O-N 3.25Å; D539-Q542 PolarHBondContact O-N 3.3Å; D540-Q542 VanDerWaalsContact C-N 3.34Å; Q542-V544 VanDerWaalsContact C-N 3.27Å; Q542-V544 PolarHBondContact O-N 2.98Å; Q542-P546 WeakPolarHBondContact O-CA 3.29Å; Q542-A549 VanDerWaalsContact CA-CB 3.5Å; Q542-A549 HydrophobicContact CB-CB 3.75Å; Q542-A549 HydrophobicContact CG-CB 4.26Å
543	Q	91.9	Very high	94	Very high	74 Å²	74	43 Å²	43	35%	0.346	24%	0.24	S	C	.	.	H	α-helix	trans	-69.5	-22.8	175.4	-70.6	169.8	57.9	0	0	113.5	S472 P510 D539 D540 L541	S472-Q543 WeakPolarHBondContact CB-O 3.24Å; P510-Q543 HydrophobicContact CB-CB 4.25Å; D539-Q543 PolarHBondContact O-N 3.08Å; D539-Q543 PolarHBondContact O-NE2 3.3Å; D540-Q543 PolarHBondContact O-N 3.36Å; L541-Q543 PolarHBondContact O-N 3.47Å
544	V	93.1	Very high	94.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-99.8	-54.4	-179.5	-168	0	0	0	0	110.6	M469 S472 W476 P510 L541 Q542 L611	M469-V544 WeakPolarHBondContact CE-O 3.5Å; M469-V544 HydrophobicContact CG-CG1 4.37Å; S472-V544 PolarHBondContact OG-O 3.2Å; W476-V544 HydrophobicContact CB-CG1 3.98Å; W476-V544 HydrophobicContact CD2-CG1 3.74Å; W476-V544 HydrophobicContact CE3-CG1 4.1Å; W476-V544 HydrophobicContact CE3-CG2 4.27Å; W476-V544 HydrophobicContact CG-CG1 3.68Å; W476-V544 HydrophobicContact CZ3-CG2 4.41Å; P510-V544 HydrophobicContact CB-CG2 3.91Å; P510-V544 HydrophobicContact CG-CG2 3.72Å; L541-V544 PolarHBondContact O-N 3Å; Q542-V544 VanDerWaalsContact C-N 3.27Å; Q542-V544 PolarHBondContact O-N 2.98Å; V544-L611 HydrophobicContact CB-CD2 4.34Å; V544-L611 HydrophobicContact CG2-CD2 3.95Å
545	M	93.9	Very high	94.4	Very high	35 Å²	35	45.4 Å²	45.4	17%	0.172	25%	0.246	C	C	.	.			trans	-129	80	-173.5	-70.4	168.8	-88.8	0	0	109.6	M469 L541 D547 L548 A549 L610 L611	M469-M545 HydrophobicContact CE-CB 4.45Å; M469-M545 HydrophobicContact CE-CG 3.43Å; M469-M545 VanDerWaalsContact CE-CG 3.43Å; L541-M545 HydrophobicContact CD1-CB 4.14Å; L541-M545 HydrophobicContact CD1-CE 3.36Å; L541-M545 HydrophobicContact CD1-SD 4.25Å; L541-M545 CarbonylContact O-C 3.59Å; L541-M545 PolarHBondContact O-N 3.48Å; M545-D547 PolarHBondContact O-N 2.83Å; M545-L548 HydrophobicContact CB-CB 4.09Å; M545-L548 PolarHBondContact O-N 2.76Å; M545-L548 HydrophobicContact SD-CD2 4.11Å; M545-A549 WeakPolarHBondContact O-CB 3.39Å; M545-A549 PolarHBondContact O-N 2.92Å; M545-L610 HydrophobicContact CE-CB 4.08Å; M545-L610 HydrophobicContact CE-CD1 4.07Å; M545-L610 HydrophobicContact SD-CD1 4.21Å; M545-L611 HydrophobicContact CE-CD2 4.02Å
546	P	94.8	Very high	94.7	Very high	31 Å²	31	45 Å²	45	20%	0.201	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-42.6	-173	22.9	-32.7	0	0	0	113.4	D471 Q542 L548 A549 H550	D471-P546 HydrophobicContact CB-CG 3.58Å; Q542-P546 WeakPolarHBondContact O-CA 3.29Å; P546-L548 PolarHBondContact O-N 3.07Å; P546-A549 PolarHBondContact O-N 3.13Å; P546-H550 PolarHBondContact O-N 3.28Å
547	D	93.8	Very high	94.8	Very high	115 Å²	115	48.8 Å²	48.8	62%	0.615	27%	0.268	S	S	*	.	H	α-helix	trans	-65.9	-41.4	-178.4	-66.3	-11.1	0	0	0	112.1	M545 H550 G551	M545-D547 PolarHBondContact O-N 2.83Å; D547-H550 WeakPolarHBondContact O-CB 3.49Å; D547-H550 PolarHBondContact O-N 3.43Å; D547-G551 PolarHBondContact O-N 3.03Å
548	L	94.1	Very high	94.9	Very high	53 Å²	53	50.8 Å²	50.8	28%	0.277	27%	0.272	S	S	.	.	H	α-helix	trans	-66.2	-42.5	175.3	-179.1	60.6	0	0	0	111.2	L541 M545 P546 H550 G551 L552 Y606 L610	L541-L548 HydrophobicContact CD2-CD2 4.37Å; L541-L548 HydrophobicContact CD2-CG 4.24Å; M545-L548 HydrophobicContact CB-CB 4.09Å; M545-L548 PolarHBondContact O-N 2.76Å; M545-L548 HydrophobicContact SD-CD2 4.11Å; P546-L548 PolarHBondContact O-N 3.07Å; L548-H550 PolarHBondContact O-N 3.49Å; L548-G551 PolarHBondContact O-N 3.21Å; L548-L552 HydrophobicContact CD1-CG 4.32Å; L548-L552 HydrophobicContact CG-CD1 4.29Å; L548-L552 HydrophobicContact CG-CG 4.49Å; L548-L552 WeakPolarHBondContact O-CG 3.48Å; L548-L552 PolarHBondContact O-N 3.45Å; L548-Y606 HydrophobicContact CD1-CE1 4.28Å; L548-L610 HydrophobicContact CD2-CD1 3.43Å; L548-L610 VanDerWaalsContact CD2-CD1 3.43Å
549	A	95.8	Very high	94.9	Very high	4 Å²	4	55.5 Å²	55.5	3%	0.033	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-38.2	175.8	0	0	0	0	0	111.5	L538 L541 Q542 M545 P546 L552 A553	L538-A549 HydrophobicContact CD1-CB 4.2Å; L541-A549 HydrophobicContact CB-CB 4.3Å; L541-A549 HydrophobicContact CD2-CB 4.12Å; L541-A549 HydrophobicContact CG-CB 4.07Å; Q542-A549 VanDerWaalsContact CA-CB 3.5Å; Q542-A549 HydrophobicContact CB-CB 3.75Å; Q542-A549 HydrophobicContact CG-CB 4.26Å; M545-A549 WeakPolarHBondContact O-CB 3.39Å; M545-A549 PolarHBondContact O-N 2.92Å; P546-A549 PolarHBondContact O-N 3.13Å; A549-L552 PolarHBondContact O-N 2.87Å; A549-A553 WeakPolarHBondContact O-CB 3.34Å; A549-A553 PolarHBondContact O-N 2.95Å
550	H	96.2	Very high	95	Very high	114 Å²	114	52.4 Å²	52.4	53%	0.528	28%	0.284	S	S	.	.	H	α-helix	trans	-61	-51.7	174	-175.8	64.8	0	0	0	111.7	P546 D547 L548 L552 A553 E554	P546-H550 PolarHBondContact O-N 3.28Å; D547-H550 WeakPolarHBondContact O-CB 3.49Å; D547-H550 PolarHBondContact O-N 3.43Å; L548-H550 PolarHBondContact O-N 3.49Å; H550-L552 VanDerWaalsContact C-N 3.31Å; H550-L552 PolarHBondContact O-N 2.81Å; H550-A553 WeakPolarHBondContact O-CA 3.41Å; H550-A553 VanDerWaalsContact O-CB 3.3Å; H550-A553 WeakPolarHBondContact O-CB 3.25Å; H550-A553 PolarHBondContact O-N 3.28Å; H550-E554 IonicContact CE1-OE1 3.71Å; H550-E554 IonicContact NE2-OE1 3.7Å; H550-E554 PolarHBondContact NE2-OE1 2.89Å; H550-E554 PolarHBondContact O-N 2.87Å
551	G	96.3	Very high	94.9	Very high	31 Å²	31	55.5 Å²	55.5	32%	0.32	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-36.7	177.9	0	0	0	0	0	113.6	D547 L548 E554 L555	D547-G551 PolarHBondContact O-N 3.03Å; L548-G551 PolarHBondContact O-N 3.21Å; G551-E554 PolarHBondContact O-N 3.46Å; G551-L555 PolarHBondContact O-N 3.46Å
552	L	96.6	Very high	94.9	Very high	9 Å²	9	55.6 Å²	55.6	5%	0.047	30%	0.301	C	S	.	.	H	α-helix	trans	-70.1	-32.5	173.7	-64	179.2	0	0	0	112.3	L538 L541 L548 A549 H550 L555 L556 Y602 V603 Y606 I607	L538-L552 HydrophobicContact CD1-CB 4Å; L541-L552 HydrophobicContact CD2-CD1 3.62Å; L548-L552 HydrophobicContact CD1-CG 4.32Å; L548-L552 HydrophobicContact CG-CD1 4.29Å; L548-L552 HydrophobicContact CG-CG 4.49Å; L548-L552 WeakPolarHBondContact O-CG 3.48Å; L548-L552 PolarHBondContact O-N 3.45Å; A549-L552 PolarHBondContact O-N 2.87Å; H550-L552 VanDerWaalsContact C-N 3.31Å; H550-L552 PolarHBondContact O-N 2.81Å; L552-L555 HydrophobicContact CD2-CD2 4.5Å; L552-L555 PolarHBondContact O-N 2.8Å; L552-L556 VanDerWaalsContact O-CG 3.3Å; L552-L556 WeakPolarHBondContact O-CG 3.21Å; L552-L556 PolarHBondContact O-N 2.86Å; L552-Y602 HydrophobicContact CD2-CE1 4.29Å; L552-V603 HydrophobicContact CB-CG1 4.18Å; L552-V603 HydrophobicContact CB-CG2 4.31Å; L552-V603 HydrophobicContact CD1-CG1 4.37Å; L552-V603 HydrophobicContact CD2-CG2 4.23Å; L552-Y606 HydrophobicContact CD1-CD1 4.19Å; L552-Y606 HydrophobicContact CD2-CD1 3.91Å; L552-Y606 HydrophobicContact CD2-CE1 4.32Å; L552-I607 HydrophobicContact CD1-CG1 4.36Å
553	A	96.9	Very high	94.8	Very high	35 Å²	35	54.5 Å²	54.5	29%	0.289	30%	0.296	S	S	.	.	H	α-helix	trans	-66.1	-40.5	172.3	0	0	0	0	0	111.7	L538 A549 H550 L556 S557	L538-A553 HydrophobicContact CD2-CB 3.93Å; A549-A553 WeakPolarHBondContact O-CB 3.34Å; A549-A553 PolarHBondContact O-N 2.95Å; H550-A553 WeakPolarHBondContact O-CA 3.41Å; H550-A553 VanDerWaalsContact O-CB 3.3Å; H550-A553 WeakPolarHBondContact O-CB 3.25Å; H550-A553 PolarHBondContact O-N 3.28Å; A553-L556 PolarHBondContact O-N 2.92Å; A553-S557 PolarHBondContact O-N 2.84Å; A553-S557 PolarHBondContact O-OG 2.99Å
554	E	96.5	Very high	94.9	Very high	105 Å²	105	56.5 Å²	56.5	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-61.6	-46.4	173.1	-68.6	-173	142	0	0	110.8	H550 G551 L556 S557 Y558	H550-E554 IonicContact CE1-OE1 3.71Å; H550-E554 IonicContact NE2-OE1 3.7Å; H550-E554 PolarHBondContact NE2-OE1 2.89Å; H550-E554 PolarHBondContact O-N 2.87Å; G551-E554 PolarHBondContact O-N 3.46Å; E554-L556 VanDerWaalsContact C-N 3.27Å; E554-L556 PolarHBondContact O-N 2.9Å; E554-S557 WeakPolarHBondContact CA-OG 3.28Å; E554-S557 CarbonylContact O-C 3.53Å; E554-S557 PolarHBondContact O-N 2.95Å; E554-S557 PolarHBondContact O-OG 3.29Å; E554-Y558 WeakPolarHBondContact O-CB 3.36Å; E554-Y558 PolarHBondContact O-N 3.02Å
555	L	96.1	Very high	94.9	Very high	4 Å²	4	60.5 Å²	60.5	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-56.2	-41	174.5	179.1	62.9	0	0	0	112.3	G551 L552 S557 V562 F566 L568 R599 Y602 V603	G551-L555 PolarHBondContact O-N 3.46Å; L552-L555 HydrophobicContact CD2-CD2 4.5Å; L552-L555 PolarHBondContact O-N 2.8Å; L555-S557 VanDerWaalsContact C-N 3.34Å; L555-V562 HydrophobicContact CD1-CG1 3.64Å; L555-F566 HydrophobicContact CD1-CD1 4.31Å; L555-F566 HydrophobicContact CD1-CD2 4.3Å; L555-F566 HydrophobicContact CD1-CE1 4.32Å; L555-F566 HydrophobicContact CD1-CE2 4.31Å; L555-F566 HydrophobicContact CD1-CG 4.3Å; L555-F566 HydrophobicContact CD1-CZ 4.32Å; L555-L568 HydrophobicContact CD2-CD1 4.2Å; L555-R599 VanDerWaalsContact O-CD 3.3Å; L555-R599 WeakPolarHBondContact O-CD 3.16Å; L555-R599 PolarHBondContact O-NH1 2.91Å; L555-Y602 HydrophobicContact CD2-CD1 3.8Å; L555-Y602 HydrophobicContact CD2-CE1 3.93Å; L555-V603 HydrophobicContact CD2-CG2 4.07Å
556	L	95.9	Very high	94.9	Very high	49 Å²	49	62.5 Å²	62.5	26%	0.257	34%	0.335	S	S	.	.	H	α-helix	trans	-69.1	-28.2	178.1	-74.4	175	0	0	0	114	L538 L552 A553 E554 R599 K600 V603	L538-L556 HydrophobicContact CD2-CD1 4.08Å; L552-L556 VanDerWaalsContact O-CG 3.3Å; L552-L556 WeakPolarHBondContact O-CG 3.21Å; L552-L556 PolarHBondContact O-N 2.86Å; A553-L556 PolarHBondContact O-N 2.92Å; E554-L556 VanDerWaalsContact C-N 3.27Å; E554-L556 PolarHBondContact O-N 2.9Å; L556-R599 HydrophobicContact CD2-CG 4.4Å; L556-R599 PolarHBondContact O-NE 3.02Å; L556-R599 PolarHBondContact O-NH1 2.99Å; L556-R599 PolarHBondContact O-NH2 2.99Å; L556-K600 HydrophobicContact CD2-CB 4.48Å; L556-K600 HydrophobicContact CD2-CG 3.89Å; L556-V603 HydrophobicContact CD1-CG1 4.08Å; L556-V603 HydrophobicContact CD2-CB 4.25Å; L556-V603 HydrophobicContact CD2-CG2 3.94Å; L556-V603 HydrophobicContact CG-CB 4.48Å; L556-V603 HydrophobicContact CG-CG1 4.42Å; L556-V603 HydrophobicContact CG-CG2 3.99Å
557	S	95.8	Very high	94.8	Very high	80 Å²	80	70 Å²	70	56%	0.559	36%	0.36	S	S	*	.	H	α-helix	trans	-100	-7.8	-178.4	53.7	0	0	0	0	113.4	A553 E554 L555 E559	A553-S557 PolarHBondContact O-N 2.84Å; A553-S557 PolarHBondContact O-OG 2.99Å; E554-S557 WeakPolarHBondContact CA-OG 3.28Å; E554-S557 CarbonylContact O-C 3.53Å; E554-S557 PolarHBondContact O-N 2.95Å; E554-S557 PolarHBondContact O-OG 3.29Å; L555-S557 VanDerWaalsContact C-N 3.34Å; S557-E559 PolarHBondContact O-N 3.5Å
558	Y	95.4	Very high	94.9	Very high	78 Å²	78	67.1 Å²	67.1	31%	0.306	35%	0.345	S	S	.	.			trans	-59.4	131.8	-179.3	-169.7	-109.7	0	0	0	112.7	E554 V562 D565 F566 R599	E554-Y558 WeakPolarHBondContact O-CB 3.36Å; E554-Y558 PolarHBondContact O-N 3.02Å; Y558-V562 HydrophobicContact CD1-CG2 4Å; Y558-D565 HydrophobicContact CE1-CB 4.13Å; Y558-D565 WeakPolarHBondContact CE1-OD2 3.33Å; Y558-D565 VanDerWaalsContact CZ-OD2 3.25Å; Y558-D565 VanDerWaalsContact OH-CG 3.25Å; Y558-D565 PolarHBondContact OH-OD2 2.77Å; Y558-F566 HydrophobicContact CD1-CD2 4.46Å; Y558-F566 AromaticContact CD1-CE2 3.56Å; Y558-F566 HydrophobicContact CD1-CE2 3.56Å; Y558-F566 HydrophobicContact CD1-CZ 4.36Å; Y558-F566 HydrophobicContact CD2-CE2 4.07Å; Y558-F566 HydrophobicContact CD2-CZ 4.15Å; Y558-F566 HydrophobicContact CE1-CD2 4.41Å; Y558-F566 AromaticContact CE1-CE2 3.66Å; Y558-F566 HydrophobicContact CE1-CE2 3.66Å; Y558-F566 HydrophobicContact CE2-CE2 4.21Å; Y558-F566 HydrophobicContact CE2-CZ 4.46Å; Y558-F566 AromaticContact CG-CE2 3.75Å; Y558-F566 HydrophobicContact CG-CE2 3.75Å; Y558-F566 HydrophobicContact CG-CZ 4.1Å; Y558-R599 PolarHBondContact O-NH1 3.11Å
559	E	93.7	Very high	95	Very high	141 Å²	141	66.5 Å²	66.5	66%	0.659	34%	0.343	S	S	*	.			trans	-96.4	-19.7	-177	-71.4	-59.2	160	0	0	114.4	S557 K596	S557-E559 PolarHBondContact O-N 3.5Å; E559-K596 PolarHBondContact O-NZ 2.85Å; E559-K596 IonicContact OE2-NZ 3.65Å; E559-K596 PolarHBondContact OE2-NZ 3.07Å
560	G	93.6	Very high	95.1	Very high	32 Å²	32	66.3 Å²	66.3	33%	0.33	34%	0.342	S	S	.	.	S	Bend	trans	-75.8	-160.6	-178.9	0	0	0	0	0	115	V562	G560-V562 PolarHBondContact O-N 2.82Å
561	N	93.4	Very high	95.2	Very high	67 Å²	67	63 Å²	63	36%	0.358	33%	0.327	S	S	.	.			trans	-87.9	94.9	-178.7	-169.9	-16	0	0	0	110.6	E563 E564 D565	N561-E563 PolarHBondContact O-N 3.24Å; N561-E563 VanDerWaalsContact O-N 3.13Å; N561-E563 PolarHBondContact OD1-N 2.84Å; N561-E564 HydrophobicContact CB-CB 4.18Å; N561-E564 WeakPolarHBondContact ND2-CG 3.49Å; N561-E564 PolarHBondContact ND2-OE1 3.24Å; N561-E564 PolarHBondContact ND2-OE2 2.99Å; N561-E564 PolarHBondContact O-N 3Å; N561-D565 PolarHBondContact N-OD2 3.35Å; N561-D565 VanDerWaalsContact O-CB 3.24Å; N561-D565 WeakPolarHBondContact O-CB 3.32Å; N561-D565 PolarHBondContact O-N 3.3Å; N561-D565 VanDerWaalsContact O-OD2 3.07Å
562	V	94.4	Very high	95.1	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-52.6	-38.7	-177.5	178.3	0	0	0	0	113.2	L555 Y558 G560 F566 V594 K596	L555-V562 HydrophobicContact CD1-CG1 3.64Å; Y558-V562 HydrophobicContact CD1-CG2 4Å; G560-V562 PolarHBondContact O-N 2.82Å; V562-F566 HydrophobicContact CG1-CD2 4.34Å; V562-F566 WeakPolarHBondContact O-CB 3.47Å; V562-F566 PolarHBondContact O-N 3.22Å; V562-V594 HydrophobicContact CG1-CG1 4.01Å; V562-K596 HydrophobicContact CG2-CB 4.32Å
563	E	92.8	Very high	94.9	Very high	86 Å²	86	67.1 Å²	67.1	40%	0.402	34%	0.336	S	S	.	.	H	α-helix	trans	-71.5	-46.7	-176.2	179.8	170.9	-174.8	0	0	111.7	N561 Y567 P593 V594 T595	N561-E563 PolarHBondContact O-N 3.24Å; N561-E563 VanDerWaalsContact O-N 3.13Å; N561-E563 PolarHBondContact OD1-N 2.84Å; E563-Y567 WeakPolarHBondContact O-CA 3.36Å; E563-Y567 PolarHBondContact O-N 3.31Å; E563-Y567 VanDerWaalsContact O-N 3.13Å; E563-P593 HydrophobicContact CG-CB 3.94Å; E563-P593 WeakPolarHBondContact OE1-CB 3.49Å; E563-P593 WeakPolarHBondContact OE1-CG 3.08Å; E563-V594 WeakPolarHBondContact CA-O 3.4Å; E563-V594 PolarHBondContact N-O 2.81Å; E563-T595 HydrophobicContact CB-CG2 4.42Å; E563-T595 WeakPolarHBondContact OE2-CG2 3.47Å
564	E	93.1	Very high	94.3	Very high	117 Å²	117	67.4 Å²	67.4	55%	0.547	33%	0.331	S	S	.	.	H	α-helix	trans	-77	-29.8	-178.8	-69.1	174.4	176	0	0	112.9	N561 Y567	N561-E564 HydrophobicContact CB-CB 4.18Å; N561-E564 WeakPolarHBondContact ND2-CG 3.49Å; N561-E564 PolarHBondContact ND2-OE1 3.24Å; N561-E564 PolarHBondContact ND2-OE2 2.99Å; N561-E564 PolarHBondContact O-N 3Å; E564-Y567 WeakPolarHBondContact O-CD2 3.43Å; E564-Y567 WeakPolarHBondContact O-CE2 3.44Å; E564-Y567 PolarHBondContact O-OH 3.48Å
565	D	93.7	Very high	93.7	Very high	83 Å²	83	69 Å²	69	44%	0.444	34%	0.339	S	S	.	.	H	α-helix	trans	-87.7	-34.2	-174.7	-62.7	-33.6	0	0	0	112	Y558 N561	Y558-D565 HydrophobicContact CE1-CB 4.13Å; Y558-D565 WeakPolarHBondContact CE1-OD2 3.33Å; Y558-D565 VanDerWaalsContact CZ-OD2 3.25Å; Y558-D565 VanDerWaalsContact OH-CG 3.25Å; Y558-D565 PolarHBondContact OH-OD2 2.77Å; N561-D565 PolarHBondContact N-OD2 3.35Å; N561-D565 VanDerWaalsContact O-CB 3.24Å; N561-D565 WeakPolarHBondContact O-CB 3.32Å; N561-D565 PolarHBondContact O-N 3.3Å; N561-D565 VanDerWaalsContact O-OD2 3.07Å
566	F	93.1	Very high	92.9	Very high	77 Å²	77	69.4 Å²	69.4	34%	0.338	34%	0.34	S	S	.	.	H	α-helix	trans	-106	-22.4	-175.3	-66.3	-100.2	0	0	0	114.1	L555 Y558 V562 L568	L555-F566 HydrophobicContact CD1-CD1 4.31Å; L555-F566 HydrophobicContact CD1-CD2 4.3Å; L555-F566 HydrophobicContact CD1-CE1 4.32Å; L555-F566 HydrophobicContact CD1-CE2 4.31Å; L555-F566 HydrophobicContact CD1-CG 4.3Å; L555-F566 HydrophobicContact CD1-CZ 4.32Å; Y558-F566 HydrophobicContact CD1-CD2 4.46Å; Y558-F566 AromaticContact CD1-CE2 3.56Å; Y558-F566 HydrophobicContact CD1-CE2 3.56Å; Y558-F566 HydrophobicContact CD1-CZ 4.36Å; Y558-F566 HydrophobicContact CD2-CE2 4.07Å; Y558-F566 HydrophobicContact CD2-CZ 4.15Å; Y558-F566 HydrophobicContact CE1-CD2 4.41Å; Y558-F566 AromaticContact CE1-CE2 3.66Å; Y558-F566 HydrophobicContact CE1-CE2 3.66Å; Y558-F566 HydrophobicContact CE2-CE2 4.21Å; Y558-F566 HydrophobicContact CE2-CZ 4.46Å; Y558-F566 AromaticContact CG-CE2 3.75Å; Y558-F566 HydrophobicContact CG-CE2 3.75Å; Y558-F566 HydrophobicContact CG-CZ 4.1Å; V562-F566 HydrophobicContact CG1-CD2 4.34Å; V562-F566 WeakPolarHBondContact O-CB 3.47Å; V562-F566 PolarHBondContact O-N 3.22Å; F566-L568 HydrophobicContact CB-CD1 3.95Å; F566-L568 HydrophobicContact CB-CG 3.88Å; F566-L568 HydrophobicContact CD1-CD1 4.36Å; F566-L568 HydrophobicContact CG-CD1 4.47Å; F566-L568 PolarHBondContact O-N 3.43Å
567	Y	94	Very high	91.8	Very high	188 Å²	188	74.8 Å²	74.8	74%	0.737	37%	0.366	S	S	*	.			trans	49.4	33.5	-176.6	-62.5	-79	0	0	0	114.3	E563 E564	E563-Y567 WeakPolarHBondContact O-CA 3.36Å; E563-Y567 PolarHBondContact O-N 3.31Å; E563-Y567 VanDerWaalsContact O-N 3.13Å; E564-Y567 WeakPolarHBondContact O-CD2 3.43Å; E564-Y567 WeakPolarHBondContact O-CE2 3.44Å; E564-Y567 PolarHBondContact O-OH 3.48Å
568	L	95.7	Very high	91	Very high	55 Å²	55	73.7 Å²	73.7	29%	0.288	37%	0.368	S	S	.	.			trans	-83.2	147.4	179.4	-67.2	171.5	0	0	0	111.1	L555 F566 P593 V594 Y602	L555-L568 HydrophobicContact CD2-CD1 4.2Å; F566-L568 HydrophobicContact CB-CD1 3.95Å; F566-L568 HydrophobicContact CB-CG 3.88Å; F566-L568 HydrophobicContact CD1-CD1 4.36Å; F566-L568 HydrophobicContact CG-CD1 4.47Å; F566-L568 PolarHBondContact O-N 3.43Å; L568-P593 WeakPolarHBondContact O-CA 3.46Å; L568-V594 HydrophobicContact CB-CB 3.96Å; L568-V594 HydrophobicContact CB-CG2 3.75Å; L568-V594 PolarHBondContact O-N 3.34Å; L568-Y602 HydrophobicContact CD1-CE1 4.38Å
569	T	97	Very high	90.5	Very high	41 Å²	41	74 Å²	74	25%	0.252	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-120	173.8	167.3	66.1	0	0	0	0	110	Q571 G589 I592 Y602	T569-Q571 PolarHBondContact O-N 2.95Å; T569-Q571 PolarHBondContact OG1-N 3.19Å; T569-G589 WeakPolarHBondContact CB-O 3.38Å; T569-I592 CarbonylContact C-O 3.29Å; T569-I592 WeakPolarHBondContact CA-O 3.47Å; T569-I592 WeakPolarHBondContact CB-O 3.34Å; T569-Y602 WeakPolarHBondContact O-CE2 3.47Å
570	F	97.8	Very high	90.3	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.374	C	S	.	.	S	Bend	trans	-75	25.9	173	-78.5	-106.1	0	0	0	113	L585 K586 G589 I592 V594 N598 E601 Y602 L605	F570-L585 HydrophobicContact CB-CB 4.49Å; F570-L585 HydrophobicContact CD1-CB 4.48Å; F570-L585 WeakPolarHBondContact O-CB 3.48Å; F570-L585 PolarHBondContact O-N 2.94Å; F570-K586 HydrophobicContact CB-CD 4.49Å; F570-K586 HydrophobicContact CB-CG 3.99Å; F570-K586 HydrophobicContact CD1-CD 3.67Å; F570-K586 HydrophobicContact CD1-CG 3.92Å; F570-K586 HydrophobicContact CE1-CD 3.95Å; F570-K586 HydrophobicContact CG-CD 4.06Å; F570-K586 VanDerWaalsContact CG-CE 3.43Å; F570-K586 HydrophobicContact CG-CG 4.1Å; F570-K586 VanDerWaalsContact CZ-NZ 3.32Å; F570-G589 CarbonylContact C-O 3.54Å; F570-G589 WeakPolarHBondContact CA-O 3.39Å; F570-G589 PolarHBondContact N-O 3.33Å; F570-I592 HydrophobicContact CD2-CB 4.09Å; F570-I592 HydrophobicContact CD2-CG2 3.7Å; F570-I592 WeakPolarHBondContact CD2-O 3.02Å; F570-I592 HydrophobicContact CE2-CG2 3.95Å; F570-I592 PolarHBondContact N-O 3.41Å; F570-V594 HydrophobicContact CD2-CG2 4.13Å; F570-V594 HydrophobicContact CE2-CG2 4.15Å; F570-N598 HydrophobicContact CE2-CB 4.41Å; F570-N598 HydrophobicContact CZ-CB 4.14Å; F570-E601 HydrophobicContact CE1-CB 4.34Å; F570-E601 HydrophobicContact CE1-CG 4.12Å; F570-E601 HydrophobicContact CZ-CB 4.4Å; F570-Y602 HydrophobicContact CD1-CD2 4.15Å; F570-Y602 VanDerWaalsContact CE1-CA 3.5Å; F570-Y602 HydrophobicContact CE1-CD2 4.42Å; F570-Y602 HydrophobicContact CG-CD2 4.22Å; F570-L605 HydrophobicContact CD1-CD1 3.94Å; F570-L605 HydrophobicContact CE1-CD1 3.93Å
571	Q	96.9	Very high	90.1	Very high	45 Å²	45	74.1 Å²	74.1	21%	0.21	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.1	169.3	-178.3	173.6	81.8	0	0	109.5	T569 F573 Y583 N584 D590	T569-Q571 PolarHBondContact O-N 2.95Å; T569-Q571 PolarHBondContact OG1-N 3.19Å; Q571-F573 HydrophobicContact CG-CZ 4.31Å; Q571-Y583 WeakPolarHBondContact CA-O 3.49Å; Q571-N584 WeakPolarHBondContact CB-OD1 3.49Å; Q571-N584 WeakPolarHBondContact CG-OD1 3.31Å; Q571-N584 PolarHBondContact NE2-OD1 3.37Å; Q571-D590 HydrophobicContact CB-CB 4.4Å
572	V	94.8	Very high	90.1	Very high	4 Å²	4	74 Å²	74	2%	0.024	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	156.2	177	-61.8	0	0	0	0	110.4	S582 Y583 L585 Y602 Y606 F609	V572-S582 CarbonylContact O-C 3.54Å; V572-S582 WeakPolarHBondContact O-CA 3.5Å; V572-Y583 PolarHBondContact N-O 2.94Å; V572-Y583 PolarHBondContact O-N 2.81Å; V572-L585 HydrophobicContact CG1-CD1 3.73Å; V572-L585 HydrophobicContact CG1-CD2 4.12Å; V572-L585 HydrophobicContact CG1-CG 3.95Å; V572-L585 HydrophobicContact CG2-CD2 3.75Å; V572-L585 HydrophobicContact CG2-CG 4.23Å; V572-Y602 HydrophobicContact CG1-CE2 4.37Å; V572-Y606 HydrophobicContact CB-CD2 4.4Å; V572-Y606 HydrophobicContact CB-CE2 3.98Å; V572-Y606 HydrophobicContact CG1-CD1 4.14Å; V572-Y606 HydrophobicContact CG1-CD2 3.83Å; V572-Y606 HydrophobicContact CG1-CE1 4.09Å; V572-Y606 HydrophobicContact CG1-CE2 3.78Å; V572-Y606 HydrophobicContact CG1-CG 4.03Å; V572-Y606 HydrophobicContact CG2-CD2 4.44Å; V572-Y606 HydrophobicContact CG2-CE2 4.23Å; V572-F609 HydrophobicContact CG2-CD1 3.89Å; V572-F609 HydrophobicContact CG2-CE1 3.85Å; V572-F609 HydrophobicContact CG2-CZ 4.47Å
573	F	91.6	Very high	90.2	Very high	121 Å²	121	76.6 Å²	76.6	53%	0.531	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.4	-178.7	-57.2	-86.3	0	0	0	109.8	Q571 V580 K581	Q571-F573 HydrophobicContact CG-CZ 4.31Å; F573-V580 HydrophobicContact CB-CG1 3.88Å; F573-V580 HydrophobicContact CD1-CG1 4.16Å; F573-V580 HydrophobicContact CG-CG1 4.42Å; F573-K581 CarbonylContact C-O 3.56Å; F573-K581 WeakPolarHBondContact CA-O 3.33Å
574	Q	85.6	Confident	90.3	Very high	41 Å²	41	76 Å²	76	19%	0.192	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135.1	175	-173	167.6	52.8	0	0	109.5	S479 K581 Y583	S479-Q574 PolarHBondContact OG-NE2 3.37Å; S479-Q574 PolarHBondContact OG-OE1 3.48Å; Q574-K581 PolarHBondContact N-O 3.45Å; Q574-K581 PolarHBondContact O-N 2.92Å; Q574-Y583 HydrophobicContact CB-CD2 4.34Å; Q574-Y583 HydrophobicContact CB-CE2 4.14Å
575	E	83.1	Confident	90.5	Very high	140 Å²	140	71.1 Å²	71.1	65%	0.654	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	122.1	173.1	-170.3	177	175.6	0	0	109.9	G578	E575-G578 WeakPolarHBondContact OE1-CA 3.34Å
576	E	79.4	Confident	90.6	Very high	11 Å²	11	69.1 Å²	69.1	5%	0.051	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	114.3	176.3	-71.3	176.5	-149.9	0	0	109	G578 V579 K581 Y583	E576-G578 VanDerWaalsContact C-N 3.26Å; E576-G578 PolarHBondContact O-N 2.84Å; E576-V579 PolarHBondContact N-O 3.3Å; E576-V579 PolarHBondContact O-N 3Å; E576-K581 HydrophobicContact CB-CD 4.47Å; E576-K581 WeakPolarHBondContact OE2-CD 3.42Å; E576-K581 WeakPolarHBondContact OE2-CE 3.3Å; E576-K581 IonicContact OE2-NZ 2.79Å; E576-K581 PolarHBondContact OE2-NZ 2.94Å; E576-Y583 PolarHBondContact OE1-OH 3.43Å
577	M	73.7	Confident	90.8	Very high	163 Å²	163	71.2 Å²	71.2	80%	0.803	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	39.9	-179.5	-60	-64.5	-66.9	0	0	113.3	V579	M577-V579 VanDerWaalsContact C-N 3.28Å; M577-V579 PolarHBondContact O-N 3.08Å
578	G	78.9	Confident	90.9	Very high	57 Å²	57	64.8 Å²	64.8	59%	0.588	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	2.7	-177.5	0	0	0	0	0	115	E575 E576	E575-G578 WeakPolarHBondContact OE1-CA 3.34Å; E576-G578 VanDerWaalsContact C-N 3.26Å; E576-G578 PolarHBondContact O-N 2.84Å
579	V	85.2	Confident	90.8	Very high	85 Å²	85	62.2 Å²	62.2	52%	0.515	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.7	178.7	-176.7	0	0	0	0	110.1	E576 M577 K581	E576-V579 PolarHBondContact N-O 3.3Å; E576-V579 PolarHBondContact O-N 3Å; M577-V579 VanDerWaalsContact C-N 3.28Å; M577-V579 PolarHBondContact O-N 3.08Å; V579-K581 PolarHBondContact O-N 3.28Å
580	V	88.8	Confident	90.8	Very high	96 Å²	96	63.3 Å²	63.3	58%	0.582	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	121	175.3	-176.7	0	0	0	0	109.9	F573	F573-V580 HydrophobicContact CB-CG1 3.88Å; F573-V580 HydrophobicContact CD1-CG1 4.16Å; F573-V580 HydrophobicContact CG-CG1 4.42Å
581	K	90.1	Very high	90.7	Very high	78 Å²	78	71.1 Å²	71.1	34%	0.339	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.3	175.7	-66.2	-177.7	-170	166.1	0	110.7	F573 Q574 E576 V579 Y583	F573-K581 CarbonylContact C-O 3.56Å; F573-K581 WeakPolarHBondContact CA-O 3.33Å; Q574-K581 PolarHBondContact N-O 3.45Å; Q574-K581 PolarHBondContact O-N 2.92Å; E576-K581 HydrophobicContact CB-CD 4.47Å; E576-K581 WeakPolarHBondContact OE2-CD 3.42Å; E576-K581 WeakPolarHBondContact OE2-CE 3.3Å; E576-K581 IonicContact OE2-NZ 2.79Å; E576-K581 PolarHBondContact OE2-NZ 2.94Å; V579-K581 PolarHBondContact O-N 3.28Å; K581-Y583 HydrophobicContact CB-CE2 3.74Å
582	S	93.4	Very high	90.7	Very high	65 Å²	65	71.4 Å²	71.4	46%	0.455	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136	177.7	60	0	0	0	0	111.7	V572	V572-S582 CarbonylContact O-C 3.54Å; V572-S582 WeakPolarHBondContact O-CA 3.5Å
583	Y	94.6	Very high	90.8	Very high	56 Å²	56	73.3 Å²	73.3	22%	0.22	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	121	-179.1	-67.4	-79.2	0	0	0	110.9	Q571 V572 Q574 E576 K581 L585 F609	Q571-Y583 WeakPolarHBondContact CA-O 3.49Å; V572-Y583 PolarHBondContact N-O 2.94Å; V572-Y583 PolarHBondContact O-N 2.81Å; Q574-Y583 HydrophobicContact CB-CD2 4.34Å; Q574-Y583 HydrophobicContact CB-CE2 4.14Å; E576-Y583 PolarHBondContact OE1-OH 3.43Å; K581-Y583 HydrophobicContact CB-CE2 3.74Å; Y583-L585 PolarHBondContact O-N 3.41Å; Y583-F609 HydrophobicContact CD1-CE2 4Å; Y583-F609 HydrophobicContact CD1-CZ 4.1Å; Y583-F609 HydrophobicContact CD2-CE1 4.42Å; Y583-F609 HydrophobicContact CD2-CE2 4.32Å; Y583-F609 AromaticContact CD2-CZ 3.61Å; Y583-F609 HydrophobicContact CD2-CZ 3.61Å; Y583-F609 HydrophobicContact CE2-CZ 4.2Å; Y583-F609 AromaticContact CG-CE2 3.8Å; Y583-F609 HydrophobicContact CG-CE2 3.8Å; Y583-F609 AromaticContact CG-CZ 3.54Å; Y583-F609 HydrophobicContact CG-CZ 3.54Å
584	N	96.9	Very high	91.1	Very high	73 Å²	73	67.6 Å²	67.6	39%	0.39	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	118.4	173.4	-76.3	-5.2	0	0	0	109.9	Q571 K586 D590	Q571-N584 WeakPolarHBondContact CB-OD1 3.49Å; Q571-N584 WeakPolarHBondContact CG-OD1 3.31Å; Q571-N584 PolarHBondContact NE2-OD1 3.37Å; N584-K586 VanDerWaalsContact C-N 3.25Å; N584-K586 PolarHBondContact O-N 3.47Å; N584-D590 PolarHBondContact ND2-OD1 3Å; N584-D590 PolarHBondContact OD1-N 3.3Å
585	L	96.4	Very high	91.6	Very high	14 Å²	14	66.9 Å²	66.9	7%	0.073	37%	0.374	C	S	.	.	S	Bend	trans	-68.3	-26.2	179.4	-64.5	-178.2	0	0	0	112.8	F570 V572 Y583 Y602 L605 F609	F570-L585 HydrophobicContact CB-CB 4.49Å; F570-L585 HydrophobicContact CD1-CB 4.48Å; F570-L585 WeakPolarHBondContact O-CB 3.48Å; F570-L585 PolarHBondContact O-N 2.94Å; V572-L585 HydrophobicContact CG1-CD1 3.73Å; V572-L585 HydrophobicContact CG1-CD2 4.12Å; V572-L585 HydrophobicContact CG1-CG 3.95Å; V572-L585 HydrophobicContact CG2-CD2 3.75Å; V572-L585 HydrophobicContact CG2-CG 4.23Å; Y583-L585 PolarHBondContact O-N 3.41Å; L585-Y602 HydrophobicContact CD1-CD2 3.92Å; L585-Y602 HydrophobicContact CD1-CE2 3.83Å; L585-L605 HydrophobicContact CB-CB 4.07Å; L585-L605 HydrophobicContact CB-CD1 4.37Å; L585-L605 HydrophobicContact CD1-CB 4.2Å; L585-F609 HydrophobicContact CD2-CB 3.59Å; L585-F609 HydrophobicContact CD2-CD1 4.34Å; L585-F609 HydrophobicContact CD2-CD2 4.47Å; L585-F609 HydrophobicContact CD2-CG 3.89Å
586	K	96.3	Very high	92.2	Very high	42 Å²	42	64.3 Å²	64.3	18%	0.183	36%	0.36	C	S	.	.	S	Bend	trans	-144.5	166.3	173.5	68.7	-178.3	177.2	-174.7	0	110.8	F570 N584 A588 G589 I592 E601 L605	F570-K586 HydrophobicContact CB-CD 4.49Å; F570-K586 HydrophobicContact CB-CG 3.99Å; F570-K586 HydrophobicContact CD1-CD 3.67Å; F570-K586 HydrophobicContact CD1-CG 3.92Å; F570-K586 HydrophobicContact CE1-CD 3.95Å; F570-K586 HydrophobicContact CG-CD 4.06Å; F570-K586 VanDerWaalsContact CG-CE 3.43Å; F570-K586 HydrophobicContact CG-CG 4.1Å; F570-K586 VanDerWaalsContact CZ-NZ 3.32Å; N584-K586 VanDerWaalsContact C-N 3.25Å; N584-K586 PolarHBondContact O-N 3.47Å; K586-A588 PolarHBondContact O-N 3.2Å; K586-G589 WeakPolarHBondContact O-CA 3.3Å; K586-G589 PolarHBondContact O-N 3.48Å; K586-I592 HydrophobicContact CD-CD1 4.3Å; K586-I592 HydrophobicContact CG-CD1 4.24Å; K586-E601 WeakPolarHBondContact CD-OE1 3.44Å; K586-E601 VanDerWaalsContact NZ-CD 3.3Å; K586-E601 IonicContact NZ-OE1 2.65Å; K586-E601 PolarHBondContact NZ-OE1 2.72Å; K586-E601 IonicContact NZ-OE2 3.67Å; K586-E601 PolarHBondContact NZ-OE2 3.14Å; K586-L605 HydrophobicContact CB-CD1 4.19Å; K586-L605 HydrophobicContact CD-CD1 4.3Å
587	P	96.4	Very high	92.9	Very high	120 Å²	120	71.7 Å²	71.7	78%	0.779	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	132.9	179.5	-26.5	35.9	0	0	0	111.9	G589 I592	P587-G589 PolarHBondContact O-N 2.57Å; P587-I592 WeakPolarHBondContact O-CD1 3.47Å
588	A	95.3	Very high	94	Very high	54 Å²	54	65.3 Å²	65.3	45%	0.446	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	30.3	-174.1	0	0	0	0	0	114.7	K586 D590 K591 I592	K586-A588 PolarHBondContact O-N 3.2Å; A588-D590 VanDerWaalsContact C-OD1 3.31Å; A588-D590 PolarHBondContact O-N 2.8Å; A588-D590 VanDerWaalsContact O-N 3.14Å; A588-K591 PolarHBondContact O-N 3.35Å; A588-I592 WeakPolarHBondContact O-CG1 3.5Å
589	G	94.9	Very high	94.8	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-57.2	-28.3	-176	0	0	0	0	0	114.8	T569 F570 K586 P587 K591 I592	T569-G589 WeakPolarHBondContact CB-O 3.38Å; F570-G589 CarbonylContact C-O 3.54Å; F570-G589 WeakPolarHBondContact CA-O 3.39Å; F570-G589 PolarHBondContact N-O 3.33Å; K586-G589 WeakPolarHBondContact O-CA 3.3Å; K586-G589 PolarHBondContact O-N 3.48Å; P587-G589 PolarHBondContact O-N 2.57Å; G589-K591 PolarHBondContact O-N 3.3Å; G589-I592 PolarHBondContact O-N 3.15Å
590	D	96.1	Very high	95.4	Very high	65 Å²	65	66.9 Å²	66.9	35%	0.348	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-61.2	-23.7	173.4	55.9	-58.6	0	0	0	113.9	Q571 N584 A588	Q571-D590 HydrophobicContact CB-CB 4.4Å; N584-D590 PolarHBondContact ND2-OD1 3Å; N584-D590 PolarHBondContact OD1-N 3.3Å; A588-D590 VanDerWaalsContact C-OD1 3.31Å; A588-D590 PolarHBondContact O-N 2.8Å; A588-D590 VanDerWaalsContact O-N 3.14Å
591	K	96.4	Very high	95.8	Very high	164 Å²	164	66.3 Å²	66.3	71%	0.713	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-106	-2.3	-177.5	-58.5	-179.7	-176.2	178.4	0	113.4	A588 G589 P593	A588-K591 PolarHBondContact O-N 3.35Å; G589-K591 PolarHBondContact O-N 3.3Å; K591-P593 WeakPolarHBondContact O-CD 3.41Å
592	I	97.3	Very high	96.2	Very high	50 Å²	50	63.1 Å²	63.1	26%	0.256	32%	0.324	S	S	.	.			trans	-106.1	109.6	-175	-59.1	170.1	0	0	0	107.8	T569 F570 K586 P587 A588 G589	T569-I592 CarbonylContact C-O 3.29Å; T569-I592 WeakPolarHBondContact CA-O 3.47Å; T569-I592 WeakPolarHBondContact CB-O 3.34Å; F570-I592 HydrophobicContact CD2-CB 4.09Å; F570-I592 HydrophobicContact CD2-CG2 3.7Å; F570-I592 WeakPolarHBondContact CD2-O 3.02Å; F570-I592 HydrophobicContact CE2-CG2 3.95Å; F570-I592 PolarHBondContact N-O 3.41Å; K586-I592 HydrophobicContact CD-CD1 4.3Å; K586-I592 HydrophobicContact CG-CD1 4.24Å; P587-I592 WeakPolarHBondContact O-CD1 3.47Å; A588-I592 WeakPolarHBondContact O-CG1 3.5Å; G589-I592 PolarHBondContact O-N 3.15Å
593	P	97	Very high	96.4	Very high	45 Å²	45	60.3 Å²	60.3	29%	0.292	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-70.1	150.6	177.6	28	-33.2	0	0	0	111.6	E563 L568 K591 N598	E563-P593 HydrophobicContact CG-CB 3.94Å; E563-P593 WeakPolarHBondContact OE1-CB 3.49Å; E563-P593 WeakPolarHBondContact OE1-CG 3.08Å; L568-P593 WeakPolarHBondContact O-CA 3.46Å; K591-P593 WeakPolarHBondContact O-CD 3.41Å; P593-N598 PolarHBondContact O-ND2 2.98Å
594	V	97.3	Very high	96.5	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.313	C	S	.	.			trans	-84.8	124.5	171.5	-175.5	0	0	0	0	108.7	V562 E563 L568 F570 N598 R599 Y602	V562-V594 HydrophobicContact CG1-CG1 4.01Å; E563-V594 WeakPolarHBondContact CA-O 3.4Å; E563-V594 PolarHBondContact N-O 2.81Å; L568-V594 HydrophobicContact CB-CB 3.96Å; L568-V594 HydrophobicContact CB-CG2 3.75Å; L568-V594 PolarHBondContact O-N 3.34Å; F570-V594 HydrophobicContact CD2-CG2 4.13Å; F570-V594 HydrophobicContact CE2-CG2 4.15Å; V594-N598 WeakPolarHBondContact CA-OD1 3.47Å; V594-R599 HydrophobicContact CG1-CB 4.12Å; V594-Y602 HydrophobicContact CG1-CD1 4.35Å; V594-Y602 HydrophobicContact CG1-CG 4.1Å; V594-Y602 HydrophobicContact CG2-CD1 4.33Å; V594-Y602 HydrophobicContact CG2-CD2 3.45Å; V594-Y602 VanDerWaalsContact CG2-CD2 3.45Å; V594-Y602 HydrophobicContact CG2-CE2 3.9Å; V594-Y602 HydrophobicContact CG2-CG 3.69Å
595	T	96.3	Very high	96.5	Very high	26 Å²	26	60 Å²	60	16%	0.16	30%	0.303	C	S	.	.			trans	-123.6	169	-176.9	73.2	0	0	0	0	110.5	E563 Q597 N598 R599	E563-T595 HydrophobicContact CB-CG2 4.42Å; E563-T595 WeakPolarHBondContact OE2-CG2 3.47Å; T595-Q597 PolarHBondContact O-N 2.95Å; T595-Q597 VanDerWaalsContact O-N 3.15Å; T595-Q597 PolarHBondContact OG1-N 3.26Å; T595-Q597 PolarHBondContact OG1-OE1 2.93Å; T595-N598 PolarHBondContact N-OD1 2.87Å; T595-N598 PolarHBondContact O-N 3Å; T595-N598 PolarHBondContact O-OD1 2.85Å; T595-N598 PolarHBondContact OG1-N 2.79Å; T595-N598 PolarHBondContact OG1-ND2 3.39Å; T595-R599 WeakPolarHBondContact O-CB 3.26Å; T595-R599 PolarHBondContact O-N 3.19Å
596	K	94.8	Very high	96.6	Very high	86 Å²	86	61 Å²	61	37%	0.374	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32	177.2	-168.1	168.3	-172.3	165.3	0	112.6	E559 V562	E559-K596 PolarHBondContact O-NZ 2.85Å; E559-K596 IonicContact OE2-NZ 3.65Å; E559-K596 PolarHBondContact OE2-NZ 3.07Å; V562-K596 HydrophobicContact CG2-CB 4.32Å
597	Q	95.6	Very high	96.6	Very high	166 Å²	166	59.1 Å²	59.1	78%	0.776	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-38.1	-179.9	-65	76.9	11.6	0	0	112.7	T595	T595-Q597 PolarHBondContact O-N 2.95Å; T595-Q597 VanDerWaalsContact O-N 3.15Å; T595-Q597 PolarHBondContact OG1-N 3.26Å; T595-Q597 PolarHBondContact OG1-OE1 2.93Å
598	N	96.6	Very high	96.6	Very high	29 Å²	29	55 Å²	55	16%	0.155	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-5	-173.8	75	22	0	0	0	114	F570 P593 V594 T595 K600 E601 Y602	F570-N598 HydrophobicContact CE2-CB 4.41Å; F570-N598 HydrophobicContact CZ-CB 4.14Å; P593-N598 PolarHBondContact O-ND2 2.98Å; V594-N598 WeakPolarHBondContact CA-OD1 3.47Å; T595-N598 PolarHBondContact N-OD1 2.87Å; T595-N598 PolarHBondContact O-N 3Å; T595-N598 PolarHBondContact O-OD1 2.85Å; T595-N598 PolarHBondContact OG1-N 2.79Å; T595-N598 PolarHBondContact OG1-ND2 3.39Å; N598-K600 PolarHBondContact O-N 2.98Å; N598-K600 VanDerWaalsContact O-N 3.12Å; N598-E601 WeakPolarHBondContact O-CA 3.26Å; N598-E601 VanDerWaalsContact O-CB 3.26Å; N598-E601 WeakPolarHBondContact O-CB 3.44Å; N598-E601 PolarHBondContact O-N 3.32Å; N598-Y602 PolarHBondContact O-N 3.46Å
599	R	96	Very high	96.6	Very high	22 Å²	22	53.3 Å²	53.3	8%	0.083	25%	0.252	C	S	.	.	H	α-helix	trans	-54.1	-34.4	-179.3	68	-179.8	-179.6	-174.5	-6	114.6	L555 L556 Y558 V594 T595 E601 Y602 V603	L555-R599 VanDerWaalsContact O-CD 3.3Å; L555-R599 WeakPolarHBondContact O-CD 3.16Å; L555-R599 PolarHBondContact O-NH1 2.91Å; L556-R599 HydrophobicContact CD2-CG 4.4Å; L556-R599 PolarHBondContact O-NE 3.02Å; L556-R599 PolarHBondContact O-NH1 2.99Å; L556-R599 PolarHBondContact O-NH2 2.99Å; Y558-R599 PolarHBondContact O-NH1 3.11Å; V594-R599 HydrophobicContact CG1-CB 4.12Å; T595-R599 WeakPolarHBondContact O-CB 3.26Å; T595-R599 PolarHBondContact O-N 3.19Å; R599-E601 VanDerWaalsContact C-N 3.33Å; R599-Y602 PolarHBondContact O-N 2.8Å; R599-V603 VanDerWaalsContact O-CG2 3.3Å; R599-V603 WeakPolarHBondContact O-CG2 3.34Å; R599-V603 PolarHBondContact O-N 3.31Å
600	K	96.5	Very high	96.6	Very high	153 Å²	153	54 Å²	54	67%	0.665	26%	0.256	S	S	*	.	H	α-helix	trans	-65.1	-39.3	177	-68.3	-175.7	179.6	-179.4	0	111.4	L556 N598 Q604	L556-K600 HydrophobicContact CD2-CB 4.48Å; L556-K600 HydrophobicContact CD2-CG 3.89Å; N598-K600 PolarHBondContact O-N 2.98Å; N598-K600 VanDerWaalsContact O-N 3.12Å; K600-Q604 WeakPolarHBondContact O-CB 3.38Å; K600-Q604 PolarHBondContact O-N 3.41Å; K600-Q604 VanDerWaalsContact O-N 3.07Å
601	E	97.5	Very high	96.5	Very high	85 Å²	85	50.9 Å²	50.9	40%	0.397	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-45.9	174.3	-171.7	-159.2	161.7	0	0	110.5	F570 K586 N598 R599 V603 Q604 L605	F570-E601 HydrophobicContact CE1-CB 4.34Å; F570-E601 HydrophobicContact CE1-CG 4.12Å; F570-E601 HydrophobicContact CZ-CB 4.4Å; K586-E601 WeakPolarHBondContact CD-OE1 3.44Å; K586-E601 VanDerWaalsContact NZ-CD 3.3Å; K586-E601 IonicContact NZ-OE1 2.65Å; K586-E601 PolarHBondContact NZ-OE1 2.72Å; K586-E601 IonicContact NZ-OE2 3.67Å; K586-E601 PolarHBondContact NZ-OE2 3.14Å; N598-E601 WeakPolarHBondContact O-CA 3.26Å; N598-E601 VanDerWaalsContact O-CB 3.26Å; N598-E601 WeakPolarHBondContact O-CB 3.44Å; N598-E601 PolarHBondContact O-N 3.32Å; R599-E601 VanDerWaalsContact C-N 3.33Å; E601-V603 PolarHBondContact O-N 3.42Å; E601-Q604 PolarHBondContact O-N 3.38Å; E601-L605 HydrophobicContact CG-CD1 4.04Å; E601-L605 HydrophobicContact CG-CG 4.44Å; E601-L605 WeakPolarHBondContact O-CB 3.05Å; E601-L605 WeakPolarHBondContact O-CG 3.49Å; E601-L605 PolarHBondContact O-N 3.4Å
602	Y	97.6	Very high	96.5	Very high	11 Å²	11	43.2 Å²	43.2	4%	0.043	21%	0.206	C	C	.	.	H	α-helix	trans	-55.2	-52.9	176.6	173.2	-98.1	0	0	0	111.5	L552 L555 L568 T569 F570 V572 L585 V594 N598 R599 Q604 L605 Y606	L552-Y602 HydrophobicContact CD2-CE1 4.29Å; L555-Y602 HydrophobicContact CD2-CD1 3.8Å; L555-Y602 HydrophobicContact CD2-CE1 3.93Å; L568-Y602 HydrophobicContact CD1-CE1 4.38Å; T569-Y602 WeakPolarHBondContact O-CE2 3.47Å; F570-Y602 HydrophobicContact CD1-CD2 4.15Å; F570-Y602 VanDerWaalsContact CE1-CA 3.5Å; F570-Y602 HydrophobicContact CE1-CD2 4.42Å; F570-Y602 HydrophobicContact CG-CD2 4.22Å; V572-Y602 HydrophobicContact CG1-CE2 4.37Å; L585-Y602 HydrophobicContact CD1-CD2 3.92Å; L585-Y602 HydrophobicContact CD1-CE2 3.83Å; V594-Y602 HydrophobicContact CG1-CD1 4.35Å; V594-Y602 HydrophobicContact CG1-CG 4.1Å; V594-Y602 HydrophobicContact CG2-CD1 4.33Å; V594-Y602 HydrophobicContact CG2-CD2 3.45Å; V594-Y602 VanDerWaalsContact CG2-CD2 3.45Å; V594-Y602 HydrophobicContact CG2-CE2 3.9Å; V594-Y602 HydrophobicContact CG2-CG 3.69Å; N598-Y602 PolarHBondContact O-N 3.46Å; R599-Y602 PolarHBondContact O-N 2.8Å; Y602-Q604 PolarHBondContact O-N 3.24Å; Y602-L605 PolarHBondContact O-N 3.3Å; Y602-Y606 HydrophobicContact CE1-CD1 4.05Å; Y602-Y606 WeakPolarHBondContact O-CB 3.21Å; Y602-Y606 PolarHBondContact O-N 2.85Å
603	V	97.6	Very high	96.3	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.036	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-45.7	180	172	0	0	0	0	111	L538 L552 L555 L556 R599 E601 L605 Y606 I607	L538-V603 HydrophobicContact CD1-CG1 4.47Å; L552-V603 HydrophobicContact CB-CG1 4.18Å; L552-V603 HydrophobicContact CB-CG2 4.31Å; L552-V603 HydrophobicContact CD1-CG1 4.37Å; L552-V603 HydrophobicContact CD2-CG2 4.23Å; L555-V603 HydrophobicContact CD2-CG2 4.07Å; L556-V603 HydrophobicContact CD1-CG1 4.08Å; L556-V603 HydrophobicContact CD2-CB 4.25Å; L556-V603 HydrophobicContact CD2-CG2 3.94Å; L556-V603 HydrophobicContact CG-CB 4.48Å; L556-V603 HydrophobicContact CG-CG1 4.42Å; L556-V603 HydrophobicContact CG-CG2 3.99Å; R599-V603 VanDerWaalsContact O-CG2 3.3Å; R599-V603 WeakPolarHBondContact O-CG2 3.34Å; R599-V603 PolarHBondContact O-N 3.31Å; E601-V603 PolarHBondContact O-N 3.42Å; V603-L605 PolarHBondContact O-N 3.22Å; V603-Y606 PolarHBondContact O-N 3.13Å; V603-I607 HydrophobicContact CG1-CD1 3.66Å; V603-I607 HydrophobicContact CG1-CG1 4.36Å; V603-I607 WeakPolarHBondContact O-CD1 3.33Å; V603-I607 WeakPolarHBondContact O-CG1 3.32Å; V603-I607 PolarHBondContact O-N 3.11Å
604	Q	97.3	Very high	96	Very high	85 Å²	85	44.9 Å²	44.9	40%	0.397	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-41.9	179.1	-173.7	60.5	57.2	0	0	112.6	A536 K600 E601 Y602 D608	A536-Q604 PolarHBondContact O-NE2 2.8Å; K600-Q604 WeakPolarHBondContact O-CB 3.38Å; K600-Q604 PolarHBondContact O-N 3.41Å; K600-Q604 VanDerWaalsContact O-N 3.07Å; E601-Q604 PolarHBondContact O-N 3.38Å; Y602-Q604 PolarHBondContact O-N 3.24Å; Q604-D608 WeakPolarHBondContact O-CB 3.36Å; Q604-D608 PolarHBondContact O-N 3.45Å
605	L	97.6	Very high	95.9	Very high	36 Å²	36	45 Å²	45	19%	0.188	21%	0.21	C	C	.	.	H	α-helix	trans	-68.9	-34.7	177.4	-71.9	176	0	0	0	112.1	F570 L585 K586 E601 Y602 V603 F609	F570-L605 HydrophobicContact CD1-CD1 3.94Å; F570-L605 HydrophobicContact CE1-CD1 3.93Å; L585-L605 HydrophobicContact CB-CB 4.07Å; L585-L605 HydrophobicContact CB-CD1 4.37Å; L585-L605 HydrophobicContact CD1-CB 4.2Å; K586-L605 HydrophobicContact CB-CD1 4.19Å; K586-L605 HydrophobicContact CD-CD1 4.3Å; E601-L605 HydrophobicContact CG-CD1 4.04Å; E601-L605 HydrophobicContact CG-CG 4.44Å; E601-L605 WeakPolarHBondContact O-CB 3.05Å; E601-L605 WeakPolarHBondContact O-CG 3.49Å; E601-L605 PolarHBondContact O-N 3.4Å; Y602-L605 PolarHBondContact O-N 3.3Å; V603-L605 PolarHBondContact O-N 3.22Å; L605-F609 VanDerWaalsContact O-CB 3.31Å; L605-F609 WeakPolarHBondContact O-CB 3.3Å; L605-F609 PolarHBondContact O-N 3.01Å
606	Y	97.3	Very high	95.7	Very high	36 Å²	36	46.7 Å²	46.7	14%	0.141	21%	0.214	C	C	.	.	H	α-helix	trans	-69	-45.7	177.6	-165.6	-178.4	0	0	0	111	L548 L552 V572 Y602 V603 D608 F609 L610	L548-Y606 HydrophobicContact CD1-CE1 4.28Å; L552-Y606 HydrophobicContact CD1-CD1 4.19Å; L552-Y606 HydrophobicContact CD2-CD1 3.91Å; L552-Y606 HydrophobicContact CD2-CE1 4.32Å; V572-Y606 HydrophobicContact CB-CD2 4.4Å; V572-Y606 HydrophobicContact CB-CE2 3.98Å; V572-Y606 HydrophobicContact CG1-CD1 4.14Å; V572-Y606 HydrophobicContact CG1-CD2 3.83Å; V572-Y606 HydrophobicContact CG1-CE1 4.09Å; V572-Y606 HydrophobicContact CG1-CE2 3.78Å; V572-Y606 HydrophobicContact CG1-CG 4.03Å; V572-Y606 HydrophobicContact CG2-CD2 4.44Å; V572-Y606 HydrophobicContact CG2-CE2 4.23Å; Y602-Y606 HydrophobicContact CE1-CD1 4.05Å; Y602-Y606 WeakPolarHBondContact O-CB 3.21Å; Y602-Y606 PolarHBondContact O-N 2.85Å; V603-Y606 PolarHBondContact O-N 3.13Å; Y606-D608 PolarHBondContact O-N 2.93Å; Y606-F609 HydrophobicContact CD2-CD1 4.42Å; Y606-F609 WeakPolarHBondContact O-CB 3.35Å; Y606-F609 PolarHBondContact O-N 2.72Å; Y606-L610 HydrophobicContact CD2-CD1 3.83Å; Y606-L610 HydrophobicContact CD2-CG 3.9Å; Y606-L610 HydrophobicContact CE2-CD1 3.59Å; Y606-L610 HydrophobicContact CE2-CD2 4.06Å; Y606-L610 HydrophobicContact CE2-CG 3.79Å; Y606-L610 WeakPolarHBondContact O-CG 3.44Å; Y606-L610 PolarHBondContact O-N 3.19Å
607	I	96.9	Very high	95.7	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-58.2	-48.3	173.9	-64.9	163.7	0	0	0	110.4	A536 L538 L541 L552 V603 F609 L610 L611	A536-I607 HydrophobicContact CB-CG2 3.44Å; A536-I607 VanDerWaalsContact CB-CG2 3.44Å; L538-I607 HydrophobicContact CB-CD1 4.22Å; L538-I607 HydrophobicContact CD1-CD1 4.02Å; L541-I607 HydrophobicContact CB-CG1 4.36Å; L541-I607 HydrophobicContact CB-CG2 4.37Å; L541-I607 HydrophobicContact CD2-CG1 3.92Å; L552-I607 HydrophobicContact CD1-CG1 4.36Å; V603-I607 HydrophobicContact CG1-CD1 3.66Å; V603-I607 HydrophobicContact CG1-CG1 4.36Å; V603-I607 WeakPolarHBondContact O-CD1 3.33Å; V603-I607 WeakPolarHBondContact O-CG1 3.32Å; V603-I607 PolarHBondContact O-N 3.11Å; I607-F609 VanDerWaalsContact C-N 3.32Å; I607-F609 PolarHBondContact O-N 3.41Å; I607-L610 PolarHBondContact O-N 2.91Å; I607-L611 HydrophobicContact CG2-CD1 3.94Å; I607-L611 HydrophobicContact CG2-CG 4.47Å; I607-L611 WeakPolarHBondContact O-CB 3.38Å; I607-L611 PolarHBondContact O-N 3.03Å
608	D	96.6	Very high	95.6	Very high	35 Å²	35	41 Å²	41	19%	0.187	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-37.8	178	177.3	62.2	0	0	0	112.4	Q604 Y606 N612 K613	Q604-D608 WeakPolarHBondContact O-CB 3.36Å; Q604-D608 PolarHBondContact O-N 3.45Å; Y606-D608 PolarHBondContact O-N 2.93Å; D608-N612 WeakPolarHBondContact O-CA 3.2Å; D608-N612 VanDerWaalsContact O-CB 3.26Å; D608-N612 WeakPolarHBondContact O-CB 3.49Å; D608-N612 PolarHBondContact O-N 3.29Å; D608-N612 WeakPolarHBondContact OD1-CB 3.33Å; D608-N612 PolarHBondContact OD1-ND2 3.33Å; D608-K613 PolarHBondContact O-N 3.45Å; D608-K613 WeakPolarHBondContact OD2-CE 3.2Å; D608-K613 IonicContact OD2-NZ 3.46Å; D608-K613 PolarHBondContact OD2-NZ 2.94Å
609	F	95.4	Very high	95.5	Very high	18 Å²	18	39.7 Å²	39.7	8%	0.079	18%	0.18	C	C	.	.	I	π-helix	trans	-60.9	-49.4	174.7	170.7	-101.5	0	0	0	111.9	V572 Y583 L585 L605 Y606 I607 K613 S614	V572-F609 HydrophobicContact CG2-CD1 3.89Å; V572-F609 HydrophobicContact CG2-CE1 3.85Å; V572-F609 HydrophobicContact CG2-CZ 4.47Å; Y583-F609 HydrophobicContact CD1-CE2 4Å; Y583-F609 HydrophobicContact CD1-CZ 4.1Å; Y583-F609 HydrophobicContact CD2-CE1 4.42Å; Y583-F609 HydrophobicContact CD2-CE2 4.32Å; Y583-F609 AromaticContact CD2-CZ 3.61Å; Y583-F609 HydrophobicContact CD2-CZ 3.61Å; Y583-F609 HydrophobicContact CE2-CZ 4.2Å; Y583-F609 AromaticContact CG-CE2 3.8Å; Y583-F609 HydrophobicContact CG-CE2 3.8Å; Y583-F609 AromaticContact CG-CZ 3.54Å; Y583-F609 HydrophobicContact CG-CZ 3.54Å; L585-F609 HydrophobicContact CD2-CB 3.59Å; L585-F609 HydrophobicContact CD2-CD1 4.34Å; L585-F609 HydrophobicContact CD2-CD2 4.47Å; L585-F609 HydrophobicContact CD2-CG 3.89Å; L605-F609 VanDerWaalsContact O-CB 3.31Å; L605-F609 WeakPolarHBondContact O-CB 3.3Å; L605-F609 PolarHBondContact O-N 3.01Å; Y606-F609 HydrophobicContact CD2-CD1 4.42Å; Y606-F609 WeakPolarHBondContact O-CB 3.35Å; Y606-F609 PolarHBondContact O-N 2.72Å; I607-F609 VanDerWaalsContact C-N 3.32Å; I607-F609 PolarHBondContact O-N 3.41Å; F609-K613 HydrophobicContact CD2-CB 4.27Å; F609-K613 PolarHBondContact O-N 3.48Å; F609-S614 VanDerWaalsContact O-CB 3.27Å; F609-S614 WeakPolarHBondContact O-CB 3.27Å; F609-S614 PolarHBondContact O-N 3.14Å; F609-S614 PolarHBondContact O-OG 3.39Å
610	L	94.3	Very high	95.5	Very high	13 Å²	13	39.2 Å²	39.2	7%	0.068	18%	0.181	C	C	.	.	I	π-helix	trans	-69.7	-44.6	-177.3	-68	173.3	0	0	0	112.8	L541 M545 L548 Y606 I607 S614	L541-L610 HydrophobicContact CD1-CD1 4.17Å; M545-L610 HydrophobicContact CE-CB 4.08Å; M545-L610 HydrophobicContact CE-CD1 4.07Å; M545-L610 HydrophobicContact SD-CD1 4.21Å; L548-L610 HydrophobicContact CD2-CD1 3.43Å; L548-L610 VanDerWaalsContact CD2-CD1 3.43Å; Y606-L610 HydrophobicContact CD2-CD1 3.83Å; Y606-L610 HydrophobicContact CD2-CG 3.9Å; Y606-L610 HydrophobicContact CE2-CD1 3.59Å; Y606-L610 HydrophobicContact CE2-CD2 4.06Å; Y606-L610 HydrophobicContact CE2-CG 3.79Å; Y606-L610 WeakPolarHBondContact O-CG 3.44Å; Y606-L610 PolarHBondContact O-N 3.19Å; I607-L610 PolarHBondContact O-N 2.91Å; L610-S614 PolarHBondContact O-OG 3.02Å
611	L	95.2	Very high	95.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-93.5	-16.3	-171	-59.6	-175.9	0	0	0	114	W476 Y512 K516 A536 D540 L541 V544 M545 I607	W476-L611 HydrophobicContact CH2-CD2 4.16Å; W476-L611 HydrophobicContact CZ2-CB 4.36Å; W476-L611 HydrophobicContact CZ2-CD2 3.6Å; Y512-L611 HydrophobicContact CD1-CB 4.07Å; Y512-L611 HydrophobicContact CD1-CD1 4.1Å; Y512-L611 HydrophobicContact CE1-CB 3.53Å; Y512-L611 HydrophobicContact CE1-CD1 4.15Å; Y512-L611 HydrophobicContact CE1-CG 4.41Å; K516-L611 WeakPolarHBondContact CE-O 3.38Å; K516-L611 PolarHBondContact NZ-O 3.29Å; A536-L611 HydrophobicContact CB-CB 4.32Å; A536-L611 HydrophobicContact CB-CD1 4.06Å; D540-L611 HydrophobicContact CB-CD1 4.23Å; L541-L611 HydrophobicContact CB-CD1 4.31Å; L541-L611 HydrophobicContact CD1-CD1 4.38Å; L541-L611 HydrophobicContact CD1-CD2 4.31Å; L541-L611 HydrophobicContact CD1-CG 4.32Å; V544-L611 HydrophobicContact CB-CD2 4.34Å; V544-L611 HydrophobicContact CG2-CD2 3.95Å; M545-L611 HydrophobicContact CE-CD2 4.02Å; I607-L611 HydrophobicContact CG2-CD1 3.94Å; I607-L611 HydrophobicContact CG2-CG 4.47Å; I607-L611 WeakPolarHBondContact O-CB 3.38Å; I607-L611 PolarHBondContact O-N 3.03Å
612	N	95	Very high	95.2	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	14%	0.136	C	C	.	.	I	π-helix	trans	-121.8	-64.7	177.6	-63	-41.8	0	0	0	113.1	Y512 K516 T533 A534 D608 Y616	Y512-N612 PolarHBondContact OH-ND2 2.7Å; Y512-N612 PolarHBondContact OH-OD1 2.92Å; K516-N612 PolarHBondContact NZ-OD1 3.46Å; T533-N612 HydrophobicContact CG2-CB 4.16Å; A534-N612 PolarHBondContact O-ND2 2.93Å; D608-N612 WeakPolarHBondContact O-CA 3.2Å; D608-N612 VanDerWaalsContact O-CB 3.26Å; D608-N612 WeakPolarHBondContact O-CB 3.49Å; D608-N612 PolarHBondContact O-N 3.29Å; D608-N612 WeakPolarHBondContact OD1-CB 3.33Å; D608-N612 PolarHBondContact OD1-ND2 3.33Å; N612-Y616 WeakPolarHBondContact O-CA 3.43Å; N612-Y616 WeakPolarHBondContact O-CB 3.41Å; N612-Y616 PolarHBondContact O-N 2.78Å; N612-Y616 VanDerWaalsContact O-N 3.13Å
613	K	93.7	Very high	95.1	Very high	107 Å²	107	28.1 Å²	28.1	47%	0.465	13%	0.134	S	C	.	.	I	π-helix	trans	-68.8	-44.4	-164.6	-62.5	175.8	170.3	135.8	0	113.6	D608 F609 I615 Y616	D608-K613 PolarHBondContact O-N 3.45Å; D608-K613 WeakPolarHBondContact OD2-CE 3.2Å; D608-K613 IonicContact OD2-NZ 3.46Å; D608-K613 PolarHBondContact OD2-NZ 2.94Å; F609-K613 HydrophobicContact CD2-CB 4.27Å; F609-K613 PolarHBondContact O-N 3.48Å; K613-I615 VanDerWaalsContact C-N 3.25Å; K613-I615 PolarHBondContact O-N 3.05Å; K613-Y616 PolarHBondContact O-N 3.21Å
614	S	92.1	Very high	95	Very high	24 Å²	24	31.4 Å²	31.4	17%	0.168	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.6	-174.8	62.1	0	0	0	0	113.2	F609 L610	F609-S614 VanDerWaalsContact O-CB 3.27Å; F609-S614 WeakPolarHBondContact O-CB 3.27Å; F609-S614 PolarHBondContact O-N 3.14Å; F609-S614 PolarHBondContact O-OG 3.39Å; L610-S614 PolarHBondContact O-OG 3.02Å
615	I	93.2	Very high	94.8	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	9	-177.5	63.2	158	0	0	0	113.3	W476 F477 K613 K617 Q618 F619	W476-I615 HydrophobicContact CH2-CD1 4.14Å; W476-I615 HydrophobicContact CZ2-CD1 3.46Å; W476-I615 VanDerWaalsContact CZ2-CD1 3.46Å; F477-I615 HydrophobicContact CB-CB 3.98Å; F477-I615 HydrophobicContact CB-CD1 3.92Å; F477-I615 HydrophobicContact CB-CG2 3.77Å; F477-I615 HydrophobicContact CD2-CD1 4.08Å; F477-I615 HydrophobicContact CG-CD1 4.1Å; K613-I615 VanDerWaalsContact C-N 3.25Å; K613-I615 PolarHBondContact O-N 3.05Å; I615-K617 VanDerWaalsContact C-N 3.32Å; I615-K617 PolarHBondContact O-N 3.32Å; I615-Q618 VanDerWaalsContact C-OE1 3.23Å; I615-Q618 PolarHBondContact O-N 3.48Å; I615-Q618 PolarHBondContact O-OE1 3.17Å; I615-F619 HydrophobicContact CD1-CB 4.34Å; I615-F619 HydrophobicContact CD1-CD2 4.26Å; I615-F619 WeakPolarHBondContact O-CB 3.46Å; I615-F619 PolarHBondContact O-N 2.77Å
616	Y	93.9	Very high	94.7	Very high	62 Å²	62	25.7 Å²	25.7	24%	0.243	12%	0.121	C	C	.	.	H	α-helix	trans	-56.2	-44.2	-167	174.9	-103.7	0	0	0	112.7	F530 V531 N612 K613 F619 A620	F530-Y616 HydrophobicContact CD1-CE1 4.33Å; F530-Y616 AromaticContact CD1-CE2 3.8Å; F530-Y616 HydrophobicContact CD1-CE2 3.8Å; F530-Y616 AromaticContact CD1-CZ 3.55Å; F530-Y616 VanDerWaalsContact CD1-OH 3.24Å; F530-Y616 WeakPolarHBondContact CD1-OH 3.47Å; F530-Y616 HydrophobicContact CE1-CE1 4.34Å; F530-Y616 HydrophobicContact CE1-CE2 4.48Å; V531-Y616 WeakPolarHBondContact O-CE2 3.35Å; N612-Y616 WeakPolarHBondContact O-CA 3.43Å; N612-Y616 WeakPolarHBondContact O-CB 3.41Å; N612-Y616 PolarHBondContact O-N 2.78Å; N612-Y616 VanDerWaalsContact O-N 3.13Å; K613-Y616 PolarHBondContact O-N 3.21Å; Y616-F619 PolarHBondContact O-N 3.4Å; Y616-A620 WeakPolarHBondContact O-CB 3.49Å; Y616-A620 PolarHBondContact O-N 2.98Å
617	K	93.1	Very high	94.5	Very high	128 Å²	128	24 Å²	24	56%	0.557	12%	0.115	S	C	*	.	H	α-helix	trans	-68.8	-43.6	-176.8	-64.9	-175.6	177.9	-176.5	0	112.1	Y485 I615 A620 A621	Y485-K617 HydrophobicContact CD1-CB 3.98Å; Y485-K617 HydrophobicContact CE1-CB 3.44Å; Y485-K617 VanDerWaalsContact CE1-CB 3.44Å; Y485-K617 HydrophobicContact CE1-CD 4.39Å; Y485-K617 HydrophobicContact CE2-CB 4.18Å; Y485-K617 HydrophobicContact CE2-CD 4.07Å; Y485-K617 WeakPolarHBondContact OH-CD 3.38Å; I615-K617 VanDerWaalsContact C-N 3.32Å; I615-K617 PolarHBondContact O-N 3.32Å; K617-A620 PolarHBondContact O-N 3.19Å; K617-A621 PolarHBondContact O-N 2.92Å; K617-A621 VanDerWaalsContact O-N 3.11Å
618	Q	94	Very high	94.3	Very high	6 Å²	6	26.1 Å²	26.1	3%	0.028	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-49.4	175.7	-61.2	84.6	-23.1	0	0	109.8	F477 W480 Y485 F488 I615 A621 F622	F477-Q618 HydrophobicContact CD1-CB 4.09Å; W480-Q618 PolarHBondContact O-NE2 3.46Å; Y485-Q618 HydrophobicContact CD1-CG 4.1Å; Y485-Q618 HydrophobicContact CE1-CG 3.97Å; F488-Q618 WeakPolarHBondContact CB-O 3.37Å; F488-Q618 HydrophobicContact CD1-CB 4Å; F488-Q618 HydrophobicContact CD2-CB 3.93Å; F488-Q618 HydrophobicContact CD2-CG 3.97Å; F488-Q618 HydrophobicContact CE1-CB 3.95Å; F488-Q618 HydrophobicContact CE1-CG 4.27Å; F488-Q618 HydrophobicContact CE2-CB 3.87Å; F488-Q618 HydrophobicContact CE2-CG 3.51Å; F488-Q618 HydrophobicContact CG-CB 4Å; F488-Q618 HydrophobicContact CZ-CB 3.89Å; F488-Q618 HydrophobicContact CZ-CG 3.69Å; I615-Q618 VanDerWaalsContact C-OE1 3.23Å; I615-Q618 PolarHBondContact O-N 3.48Å; I615-Q618 PolarHBondContact O-OE1 3.17Å; Q618-A621 PolarHBondContact O-N 3.37Å; Q618-F622 WeakPolarHBondContact O-CB 3.27Å; Q618-F622 PolarHBondContact O-N 2.77Å
619	F	95.3	Very high	94	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	12%	0.121	C	C	.	.	H	α-helix	trans	-68.6	-39.1	-179.1	-162.8	-79.6	0	0	0	112.5	F477 K516 L517 I615 Y616 A621 F622 Y623	F477-F619 HydrophobicContact CD2-CD2 4Å; F477-F619 HydrophobicContact CE1-CD2 4.11Å; F477-F619 AromaticContact CE2-CD2 3.48Å; F477-F619 HydrophobicContact CE2-CD2 3.48Å; F477-F619 VanDerWaalsContact CE2-CD2 3.48Å; F477-F619 AromaticContact CE2-CE2 3.69Å; F477-F619 HydrophobicContact CE2-CE2 3.69Å; F477-F619 AromaticContact CZ-CD2 3.54Å; F477-F619 HydrophobicContact CZ-CD2 3.54Å; F477-F619 AromaticContact CZ-CE2 3.86Å; F477-F619 HydrophobicContact CZ-CE2 3.86Å; K516-F619 HydrophobicContact CB-CD1 4.22Å; K516-F619 HydrophobicContact CB-CE1 3.38Å; K516-F619 HydrophobicContact CB-CE2 3.91Å; K516-F619 HydrophobicContact CB-CZ 3.19Å; K516-F619 HydrophobicContact CD-CD2 4.1Å; K516-F619 HydrophobicContact CD-CE1 4.39Å; K516-F619 HydrophobicContact CD-CE2 3.83Å; K516-F619 HydrophobicContact CD-CG 4.49Å; K516-F619 HydrophobicContact CD-CZ 4.01Å; K516-F619 VanDerWaalsContact CE-CG 3.4Å; K516-F619 HydrophobicContact CG-CE1 4.47Å; K516-F619 HydrophobicContact CG-CZ 4.25Å; L517-F619 HydrophobicContact CD2-CZ 4.28Å; L517-F619 HydrophobicContact CG-CZ 4.05Å; I615-F619 HydrophobicContact CD1-CB 4.34Å; I615-F619 HydrophobicContact CD1-CD2 4.26Å; I615-F619 WeakPolarHBondContact O-CB 3.46Å; I615-F619 PolarHBondContact O-N 2.77Å; Y616-F619 PolarHBondContact O-N 3.4Å; F619-A621 VanDerWaalsContact C-N 3.35Å; F619-A621 PolarHBondContact O-N 2.93Å; F619-F622 HydrophobicContact CD2-CD1 4.47Å; F619-F622 HydrophobicContact CE2-CD1 4.15Å; F619-F622 HydrophobicContact CE2-CE1 4.38Å; F619-F622 HydrophobicContact CZ-CD1 4.22Å; F619-F622 HydrophobicContact CZ-CE1 4.45Å; F619-F622 WeakPolarHBondContact O-CB 3.26Å; F619-F622 PolarHBondContact O-N 3.13Å; F619-Y623 VanDerWaalsContact O-CB 3.31Å; F619-Y623 WeakPolarHBondContact O-CB 2.98Å; F619-Y623 PolarHBondContact O-N 3.41Å
620	A	94.8	Very high	93.5	Very high	12 Å²	12	24.1 Å²	24.1	10%	0.099	12%	0.12	C	C	.	.	H	α-helix	trans	-62.7	-42.1	177.4	0	0	0	0	0	111.5	V531 Y616 K617 Y623 H624	V531-A620 HydrophobicContact CG2-CB 4.26Å; Y616-A620 WeakPolarHBondContact O-CB 3.49Å; Y616-A620 PolarHBondContact O-N 2.98Å; K617-A620 PolarHBondContact O-N 3.19Å; A620-Y623 WeakPolarHBondContact O-CB 3.24Å; A620-Y623 PolarHBondContact O-N 3.3Å; A620-H624 PolarHBondContact O-CD2 2.87Å; A620-H624 PolarHBondContact O-N 3.45Å
621	A	94	Very high	92.7	Very high	15 Å²	15	25.6 Å²	25.6	12%	0.124	14%	0.135	C	C	.	.	H	α-helix	trans	-61.6	-46.9	173.8	0	0	0	0	0	111.6	Y485 F488 Q489 K617 Q618 F619 Y623 H624 G625	Y485-A621 WeakPolarHBondContact O-CB 3.23Å; F488-A621 HydrophobicContact CB-CB 4.1Å; Q489-A621 VanDerWaalsContact CA-O 3.29Å; Q489-A621 WeakPolarHBondContact CA-O 3.46Å; Q489-A621 HydrophobicContact CB-CB 4.29Å; K617-A621 PolarHBondContact O-N 2.92Å; K617-A621 VanDerWaalsContact O-N 3.11Å; Q618-A621 PolarHBondContact O-N 3.37Å; F619-A621 VanDerWaalsContact C-N 3.35Å; F619-A621 PolarHBondContact O-N 2.93Å; A621-Y623 PolarHBondContact O-N 2.88Å; A621-H624 PolarHBondContact O-N 3.34Å; A621-G625 PolarHBondContact O-N 3.45Å
622	F	95.2	Very high	92.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-57.3	-45.4	174.2	174.9	-101.9	0	0	0	112.8	F477 F488 V491 G492 M495 F509 L517 Q618 F619 H624 G625 F626	F477-F622 HydrophobicContact CE1-CB 3.97Å; F477-F622 HydrophobicContact CE1-CD1 4.29Å; F477-F622 HydrophobicContact CE1-CD2 4.46Å; F477-F622 HydrophobicContact CE1-CG 4.01Å; F477-F622 HydrophobicContact CZ-CB 4.22Å; F477-F622 AromaticContact CZ-CD1 3.67Å; F477-F622 HydrophobicContact CZ-CD1 3.67Å; F477-F622 HydrophobicContact CZ-CD2 4.27Å; F477-F622 AromaticContact CZ-CE1 3.97Å; F477-F622 HydrophobicContact CZ-CE1 3.97Å; F477-F622 AromaticContact CZ-CG 3.81Å; F477-F622 HydrophobicContact CZ-CG 3.81Å; F477-F622 HydrophobicContact CZ-CZ 4.4Å; F488-F622 HydrophobicContact CB-CB 4.39Å; F488-F622 VanDerWaalsContact O-CA 3.29Å; F488-F622 WeakPolarHBondContact O-CA 3.42Å; V491-F622 HydrophobicContact CB-CD2 4.21Å; V491-F622 HydrophobicContact CB-CE2 4.36Å; V491-F622 HydrophobicContact CG1-CD2 4.28Å; V491-F622 HydrophobicContact CG1-CE2 3.96Å; G492-F622 VanDerWaalsContact CA-CD2 3.46Å; G492-F622 VanDerWaalsContact CA-O 3.32Å; G492-F622 WeakPolarHBondContact CA-O 3.35Å; G492-F622 VanDerWaalsContact N-CD2 3.3Å; M495-F622 HydrophobicContact SD-CE1 4.34Å; M495-F622 HydrophobicContact SD-CE2 4.2Å; M495-F622 HydrophobicContact SD-CZ 3.47Å; M495-F622 WeakPolarHBondContact SD-CZ 3.15Å; F509-F622 HydrophobicContact CE2-CZ 4.31Å; L517-F622 HydrophobicContact CD1-CE1 3.87Å; L517-F622 HydrophobicContact CD1-CZ 4.38Å; L517-F622 HydrophobicContact CD2-CD1 3.81Å; L517-F622 HydrophobicContact CD2-CE1 3.56Å; L517-F622 HydrophobicContact CG-CD1 4.49Å; L517-F622 HydrophobicContact CG-CE1 3.88Å; Q618-F622 WeakPolarHBondContact O-CB 3.27Å; Q618-F622 PolarHBondContact O-N 2.77Å; F619-F622 HydrophobicContact CD2-CD1 4.47Å; F619-F622 HydrophobicContact CE2-CD1 4.15Å; F619-F622 HydrophobicContact CE2-CE1 4.38Å; F619-F622 HydrophobicContact CZ-CD1 4.22Å; F619-F622 HydrophobicContact CZ-CE1 4.45Å; F619-F622 WeakPolarHBondContact O-CB 3.26Å; F619-F622 PolarHBondContact O-N 3.13Å; F622-H624 PolarHBondContact O-N 2.89Å; F622-G625 WeakPolarHBondContact O-CA 3.37Å; F622-G625 PolarHBondContact O-N 3.46Å; F622-F626 PolarHBondContact O-N 3.22Å
623	Y	95.7	Very high	91.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-50.1	174.6	171.6	-82.4	0	0	0	111.4	L517 P520 V523 V531 F619 A620 A621 G625 F626 H627	L517-Y623 VanDerWaalsContact O-CE2 3.26Å; L517-Y623 WeakPolarHBondContact O-CE2 3.46Å; P520-Y623 VanDerWaalsContact O-CE2 3.26Å; P520-Y623 WeakPolarHBondContact O-CE2 3.45Å; P520-Y623 PolarHBondContact O-OH 3.18Å; V523-Y623 HydrophobicContact CG2-CE1 4.05Å; V531-Y623 HydrophobicContact CB-CD1 3.67Å; V531-Y623 HydrophobicContact CB-CD2 4.38Å; V531-Y623 HydrophobicContact CB-CE1 3.53Å; V531-Y623 HydrophobicContact CB-CE2 4.22Å; V531-Y623 HydrophobicContact CB-CG 4.13Å; V531-Y623 HydrophobicContact CG1-CD1 4.23Å; V531-Y623 HydrophobicContact CG1-CE1 3.65Å; V531-Y623 HydrophobicContact CG2-CD1 3.5Å; V531-Y623 VanDerWaalsContact CG2-CD1 3.5Å; V531-Y623 HydrophobicContact CG2-CE1 3.83Å; V531-Y623 HydrophobicContact CG2-CG 4.03Å; F619-Y623 VanDerWaalsContact O-CB 3.31Å; F619-Y623 WeakPolarHBondContact O-CB 2.98Å; F619-Y623 PolarHBondContact O-N 3.41Å; A620-Y623 WeakPolarHBondContact O-CB 3.24Å; A620-Y623 PolarHBondContact O-N 3.3Å; A621-Y623 PolarHBondContact O-N 2.88Å; Y623-G625 VanDerWaalsContact C-N 3.27Å; Y623-G625 PolarHBondContact O-N 3.26Å; Y623-F626 PolarHBondContact O-N 3.3Å; Y623-H627 AromaticContact CD1-CD2 3.87Å; Y623-H627 AromaticContact CD2-CD2 3.59Å; Y623-H627 AromaticContact CD2-NE2 3.7Å; Y623-H627 AromaticContact CE1-CD2 3.59Å; Y623-H627 AromaticContact CE2-CD2 3.33Å; Y623-H627 WeakPolarHBondContact CE2-CD2 3.29Å; Y623-H627 AromaticContact CE2-NE2 3.15Å; Y623-H627 WeakPolarHBondContact CE2-NE2 3.38Å; Y623-H627 AromaticContact CG-CD2 3.84Å; Y623-H627 AromaticContact CZ-CD2 3.3Å; Y623-H627 AromaticContact CZ-NE2 3.41Å; Y623-H627 PolarHBondContact O-CD2 3.24Å; Y623-H627 VanDerWaalsContact O-CD2 3.24Å; Y623-H627 PolarHBondContact O-N 2.97Å
624	H	94.1	Very high	91.5	Very high	76 Å²	76	23.1 Å²	23.1	35%	0.352	13%	0.128	S	C	.	.	H	α-helix	trans	-64.1	-34.3	178.3	-73.2	-59.9	0	0	0	112.4	A620 A621 F622 S628	A620-H624 PolarHBondContact O-CD2 2.87Å; A620-H624 PolarHBondContact O-N 3.45Å; A621-H624 PolarHBondContact O-N 3.34Å; F622-H624 PolarHBondContact O-N 2.89Å; H624-S628 WeakPolarHBondContact O-CB 3.42Å; H624-S628 PolarHBondContact O-N 3.39Å
625	G	94.2	Very high	91.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-58.2	-55.4	171.1	0	0	0	0	0	112.1	Q489 T493 A621 F622 Y623 H627 S628	Q489-G625 WeakPolarHBondContact O-CA 3.33Å; T493-G625 WeakPolarHBondContact CA-O 3.35Å; T493-G625 VanDerWaalsContact N-C 3.26Å; T493-G625 PolarHBondContact N-O 2.83Å; T493-G625 WeakPolarHBondContact OG1-CA 3.47Å; T493-G625 PolarHBondContact OG1-O 3.4Å; A621-G625 PolarHBondContact O-N 3.45Å; F622-G625 WeakPolarHBondContact O-CA 3.37Å; F622-G625 PolarHBondContact O-N 3.46Å; Y623-G625 VanDerWaalsContact C-N 3.27Å; Y623-G625 PolarHBondContact O-N 3.26Å; G625-H627 PolarHBondContact O-N 3.25Å; G625-S628 WeakPolarHBondContact O-CB 3.38Å; G625-S628 PolarHBondContact O-N 2.78Å; G625-S628 PolarHBondContact O-OG 2.78Å
626	F	95.2	Very high	91.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-57.3	-49	-179.9	178.6	-96.4	0	0	0	111.9	G492 M495 V499 L517 F622 Y623 S628 V629 C630 L635 V643	G492-F626 WeakPolarHBondContact O-CA 3.4Å; G492-F626 PolarHBondContact O-N 2.93Å; M495-F626 HydrophobicContact CB-CD2 4.17Å; M495-F626 HydrophobicContact CE-CE2 4.3Å; M495-F626 HydrophobicContact CG-CD2 3.93Å; M495-F626 HydrophobicContact CG-CE2 4.09Å; M495-F626 HydrophobicContact SD-CD2 4.24Å; V499-F626 HydrophobicContact CG2-CE2 4.32Å; L517-F626 HydrophobicContact CD1-CD2 4.49Å; L517-F626 HydrophobicContact CD2-CB 3.93Å; L517-F626 HydrophobicContact CD2-CD1 4.11Å; L517-F626 HydrophobicContact CD2-CG 3.99Å; F622-F626 PolarHBondContact O-N 3.22Å; Y623-F626 PolarHBondContact O-N 3.3Å; F626-S628 VanDerWaalsContact C-N 3.3Å; F626-S628 PolarHBondContact O-N 3.42Å; F626-V629 PolarHBondContact O-N 3.36Å; F626-C630 HydrophobicContact CD1-CB 4.45Å; F626-C630 HydrophobicContact CE1-CB 4.01Å; F626-C630 HydrophobicContact CZ-CB 4.1Å; F626-C630 PolarHBondContact O-N 3.28Å; F626-L635 HydrophobicContact CE1-CD1 3.89Å; F626-L635 HydrophobicContact CE1-CD2 4.43Å; F626-L635 HydrophobicContact CZ-CD2 4.45Å; F626-V643 HydrophobicContact CZ-CG1 4.42Å
627	H	93.1	Very high	91.2	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-72.1	-19.2	-179.3	-77.1	-77	0	0	0	113.9	L517 P521 V523 Y623 G625 V629 A631	L517-H627 PolarHBondContact O-NE2 2.99Å; P521-H627 PolarHBondContact O-CE1 3.18Å; V523-H627 HydrophobicContact CG2-CB 3.3Å; Y623-H627 AromaticContact CD1-CD2 3.87Å; Y623-H627 AromaticContact CD2-CD2 3.59Å; Y623-H627 AromaticContact CD2-NE2 3.7Å; Y623-H627 AromaticContact CE1-CD2 3.59Å; Y623-H627 AromaticContact CE2-CD2 3.33Å; Y623-H627 WeakPolarHBondContact CE2-CD2 3.29Å; Y623-H627 AromaticContact CE2-NE2 3.15Å; Y623-H627 WeakPolarHBondContact CE2-NE2 3.38Å; Y623-H627 AromaticContact CG-CD2 3.84Å; Y623-H627 AromaticContact CZ-CD2 3.3Å; Y623-H627 AromaticContact CZ-NE2 3.41Å; Y623-H627 PolarHBondContact O-CD2 3.24Å; Y623-H627 VanDerWaalsContact O-CD2 3.24Å; Y623-H627 PolarHBondContact O-N 2.97Å; G625-H627 PolarHBondContact O-N 3.25Å; H627-V629 PolarHBondContact O-N 2.55Å; H627-V629 VanDerWaalsContact O-N 3.13Å; H627-A631 WeakPolarHBondContact O-CB 3.47Å; H627-A631 PolarHBondContact O-N 2.88Å
628	S	91.9	Very high	91.2	Very high	46 Å²	46	17.9 Å²	17.9	32%	0.322	11%	0.107	S	C	.	.	H	α-helix	trans	-59.4	-26.4	174.8	71.7	0	0	0	0	113	T493 H624 G625 F626	T493-S628 PolarHBondContact OG1-OG 2.83Å; H624-S628 WeakPolarHBondContact O-CB 3.42Å; H624-S628 PolarHBondContact O-N 3.39Å; G625-S628 WeakPolarHBondContact O-CB 3.38Å; G625-S628 PolarHBondContact O-N 2.78Å; G625-S628 PolarHBondContact O-OG 2.78Å; F626-S628 VanDerWaalsContact C-N 3.3Å; F626-S628 PolarHBondContact O-N 3.42Å
629	V	90	Very high	91.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-104.7	-50.8	178.1	-168.7	0	0	0	0	110.6	L427 K428 T493 L497 Y500 F626 H627 A631	L427-V629 HydrophobicContact CB-CG2 4.26Å; L427-V629 HydrophobicContact CD1-CG2 4.33Å; K428-V629 VanDerWaalsContact CE-O 3.26Å; K428-V629 WeakPolarHBondContact CE-O 3.07Å; T493-V629 HydrophobicContact CG2-CG2 3.95Å; L497-V629 HydrophobicContact CD2-CG1 3.98Å; L497-V629 HydrophobicContact CD2-CG2 4.18Å; L497-V629 HydrophobicContact CG-CG1 4.46Å; L497-V629 HydrophobicContact CG-CG2 4.09Å; Y500-V629 HydrophobicContact CD1-CG1 3.91Å; Y500-V629 HydrophobicContact CD2-CG1 4.1Å; Y500-V629 HydrophobicContact CG-CG1 3.62Å; F626-V629 PolarHBondContact O-N 3.36Å; H627-V629 PolarHBondContact O-N 2.55Å; H627-V629 VanDerWaalsContact O-N 3.13Å; V629-A631 VanDerWaalsContact C-N 3.34Å; V629-A631 PolarHBondContact O-N 2.79Å
630	C	86.7	Confident	91	Very high	10 Å²	10	22 Å²	22	7%	0.068	13%	0.126	C	C	.	.	H	α-helix	trans	-85.9	6.4	-172.5	-69.8	0	0	0	0	114.7	G496 F626 S632 L635	G496-C630 VanDerWaalsContact CA-SG 3.57Å; G496-C630 PolarHBondContact O-SG 2.87Å; F626-C630 HydrophobicContact CD1-CB 4.45Å; F626-C630 HydrophobicContact CE1-CB 4.01Å; F626-C630 HydrophobicContact CZ-CB 4.1Å; F626-C630 PolarHBondContact O-N 3.28Å; C630-S632 VanDerWaalsContact C-N 3.29Å; C630-S632 PolarHBondContact O-N 3.28Å; C630-L635 HydrophobicContact CB-CD1 3.79Å; C630-L635 HydrophobicContact CB-CD2 4.41Å; C630-L635 HydrophobicContact CB-CG 4.32Å; C630-L635 WeakPolarHBondContact O-CD1 3.34Å; C630-L635 WeakPolarHBondContact O-CG 3.5Å
631	A	77.2	Confident	90.9	Very high	45 Å²	45	23.8 Å²	23.8	37%	0.372	13%	0.132	S	C	.	.			trans	-62.2	89.4	174.6	0	0	0	0	0	111.3	K428 H627 V629	K428-A631 PolarHBondContact NZ-O 2.98Å; K428-A631 VanDerWaalsContact NZ-O 3.14Å; H627-A631 WeakPolarHBondContact O-CB 3.47Å; H627-A631 PolarHBondContact O-N 2.88Å; V629-A631 VanDerWaalsContact C-N 3.34Å; V629-A631 PolarHBondContact O-N 2.79Å
632	S	82.2	Confident	90.9	Very high	17 Å²	17	23.1 Å²	23.1	12%	0.119	13%	0.126	C	C	.	.	S	Bend	trans	-142.4	149.1	175.1	-178.8	0	0	0	0	109	Y340 D373 C630 A634 L635	Y340-S632 PolarHBondContact OH-OG 3.38Å; D373-S632 WeakPolarHBondContact OD2-CB 3.4Å; D373-S632 PolarHBondContact OD2-OG 3.07Å; C630-S632 VanDerWaalsContact C-N 3.29Å; C630-S632 PolarHBondContact O-N 3.28Å; S632-A634 PolarHBondContact O-N 3.36Å; S632-A634 VanDerWaalsContact O-N 3.15Å; S632-A634 PolarHBondContact OG-N 3.13Å; S632-L635 PolarHBondContact O-N 3.03Å; S632-L635 VanDerWaalsContact O-N 3.17Å
633	D	85.5	Confident	90.8	Very high	39 Å²	39	23.2 Å²	23.2	21%	0.209	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-58.7	-25.3	173.1	-68.3	-18.4	0	0	0	110.4	K34 W343 L635 M636	K34-D633 IonicContact NZ-OD2 3.17Å; W343-D633 HydrophobicContact CH2-CB 3.92Å; W343-D633 VanDerWaalsContact CH2-O 3.25Å; W343-D633 WeakPolarHBondContact CH2-O 3.3Å; W343-D633 HydrophobicContact CZ3-CB 3.66Å; D633-L635 VanDerWaalsContact C-N 3.25Å; D633-L635 PolarHBondContact O-N 3.31Å; D633-M636 WeakPolarHBondContact O-CB 3.43Å; D633-M636 WeakPolarHBondContact O-CG 3.37Å; D633-M636 PolarHBondContact O-N 2.81Å
634	A	89.5	Confident	90.7	Very high	2 Å²	2	25.1 Å²	25.1	2%	0.017	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-57.4	-31	176.2	0	0	0	0	0	114.3	Y340 I369 I370 S632 M636 L637	Y340-A634 HydrophobicContact CE2-CB 4.02Å; Y340-A634 WeakPolarHBondContact OH-CB 3.32Å; Y340-A634 PolarHBondContact OH-N 3.35Å; I369-A634 HydrophobicContact CG2-CB 4.19Å; I370-A634 HydrophobicContact CG1-CB 3.81Å; S632-A634 PolarHBondContact O-N 3.36Å; S632-A634 VanDerWaalsContact O-N 3.15Å; S632-A634 PolarHBondContact OG-N 3.13Å; A634-M636 PolarHBondContact O-N 3.27Å; A634-L637 WeakPolarHBondContact O-CB 3.47Å; A634-L637 WeakPolarHBondContact O-CG 3.32Å; A634-L637 PolarHBondContact O-N 3.25Å; A634-L637 VanDerWaalsContact O-N 3.13Å
635	L	89.8	Confident	90.5	Very high	5 Å²	5	23.3 Å²	23.3	3%	0.026	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-62.9	-27.4	176.2	-80	-174.6	0	0	0	112.4	F626 C630 S632 D633 L637 L638	F626-L635 HydrophobicContact CE1-CD1 3.89Å; F626-L635 HydrophobicContact CE1-CD2 4.43Å; F626-L635 HydrophobicContact CZ-CD2 4.45Å; C630-L635 HydrophobicContact CB-CD1 3.79Å; C630-L635 HydrophobicContact CB-CD2 4.41Å; C630-L635 HydrophobicContact CB-CG 4.32Å; C630-L635 WeakPolarHBondContact O-CD1 3.34Å; C630-L635 WeakPolarHBondContact O-CG 3.5Å; S632-L635 PolarHBondContact O-N 3.03Å; S632-L635 VanDerWaalsContact O-N 3.17Å; D633-L635 VanDerWaalsContact C-N 3.25Å; D633-L635 PolarHBondContact O-N 3.31Å; L635-L637 PolarHBondContact O-N 3.14Å; L635-L638 HydrophobicContact CD2-CD1 3.93Å; L635-L638 PolarHBondContact O-N 3.42Å
636	M	90	Very high	90.4	Very high	82 Å²	82	24.5 Å²	24.5	40%	0.404	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-68.3	-13	178.9	-51	-160.9	-38.6	0	0	113	W343 P521 T522 D633 A634 L638	W343-M636 HydrophobicContact CH2-CB 4.24Å; W343-M636 HydrophobicContact CH2-CE 3.52Å; W343-M636 HydrophobicContact CZ2-CE 3.4Å; W343-M636 VanDerWaalsContact CZ2-CE 3.4Å; P521-M636 HydrophobicContact CB-CG 4.47Å; P521-M636 HydrophobicContact CG-CG 4.25Å; T522-M636 HydrophobicContact CG2-CG 3.99Å; T522-M636 HydrophobicContact CG2-SD 3.97Å; D633-M636 WeakPolarHBondContact O-CB 3.43Å; D633-M636 WeakPolarHBondContact O-CG 3.37Å; D633-M636 PolarHBondContact O-N 2.81Å; A634-M636 PolarHBondContact O-N 3.27Å; M636-L638 VanDerWaalsContact C-N 3.33Å
637	L	92.9	Very high	90.2	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-81.2	-16.8	177.5	-54.4	178.4	0	0	0	112.4	Y340 W343 C355 P358 K366 I369 A634 L635	Y340-L637 HydrophobicContact CD2-CD1 4.16Å; Y340-L637 HydrophobicContact CE2-CD1 4.31Å; W343-L637 HydrophobicContact CH2-CD2 3.98Å; W343-L637 HydrophobicContact CH2-CG 4.44Å; W343-L637 HydrophobicContact CZ2-CD2 4.14Å; W343-L637 HydrophobicContact CZ3-CD2 4.22Å; C355-L637 HydrophobicContact CB-CD2 3.93Å; C355-L637 WeakPolarHBondContact O-CD2 3.39Å; P358-L637 HydrophobicContact CB-CB 4.23Å; P358-L637 HydrophobicContact CB-CD2 4.23Å; P358-L637 VanDerWaalsContact CB-O 3.29Å; P358-L637 WeakPolarHBondContact CB-O 3.31Å; P358-L637 HydrophobicContact CG-CD2 3.79Å; K366-L637 HydrophobicContact CD-CB 4.49Å; K366-L637 WeakPolarHBondContact CD-O 3.32Å; K366-L637 WeakPolarHBondContact CE-O 3.32Å; K366-L637 PolarHBondContact NZ-O 2.97Å; I369-L637 HydrophobicContact CD1-CD1 4Å; I369-L637 HydrophobicContact CG2-CD1 4.04Å; A634-L637 WeakPolarHBondContact O-CB 3.47Å; A634-L637 WeakPolarHBondContact O-CG 3.32Å; A634-L637 PolarHBondContact O-N 3.25Å; A634-L637 VanDerWaalsContact O-N 3.13Å; L635-L637 PolarHBondContact O-N 3.14Å
638	L	93.3	Very high	90	Very high	15 Å²	15	24.4 Å²	24.4	8%	0.079	13%	0.134	C	C	.	.			trans	-93.3	145.5	-171.1	-61.8	175.8	0	0	0	113.1	K366 I370 L635 M636 E642 V643 L646	K366-L638 HydrophobicContact CB-CD2 3.88Å; K366-L638 HydrophobicContact CD-CD2 4.01Å; I370-L638 HydrophobicContact CD1-CD1 3.5Å; I370-L638 HydrophobicContact CD1-CD2 3.75Å; I370-L638 HydrophobicContact CD1-CG 3.78Å; L635-L638 HydrophobicContact CD2-CD1 3.93Å; L635-L638 PolarHBondContact O-N 3.42Å; M636-L638 VanDerWaalsContact C-N 3.33Å; L638-E642 WeakPolarHBondContact CA-OE2 2.98Å; L638-E642 HydrophobicContact CB-CB 4.43Å; L638-E642 HydrophobicContact CD2-CB 3.91Å; L638-V643 HydrophobicContact CB-CG2 3.9Å; L638-V643 HydrophobicContact CD1-CG2 3.74Å; L638-L646 HydrophobicContact CD1-CD1 3.49Å; L638-L646 VanDerWaalsContact CD1-CD1 3.49Å; L638-L646 HydrophobicContact CD2-CD1 3.86Å; L638-L646 HydrophobicContact CG-CD1 4.33Å
639	R	93	Very high	89.8	Confident	66 Å²	66	22.3 Å²	22.3	25%	0.249	12%	0.12	C	C	.	.			trans	-90	159.4	163.3	-52.9	177.7	95.6	-115.8	8.2	109.9	E641 E642 V643	R639-E641 WeakPolarHBondContact CB-OE2 3.14Å; R639-E641 IonicContact NH1-OE1 3.84Å; R639-E641 PolarHBondContact NH1-OE1 2.92Å; R639-E641 IonicContact NH1-OE2 2.87Å; R639-E641 PolarHBondContact NH1-OE2 3.24Å; R639-E641 VanDerWaalsContact NH1-OE2 3.12Å; R639-E641 PolarHBondContact O-N 2.96Å; R639-E642 HydrophobicContact CB-CG 4.28Å; R639-E642 PolarHBondContact N-OE2 3.49Å; R639-E642 WeakPolarHBondContact O-CA 3.15Å; R639-E642 WeakPolarHBondContact O-CB 3.33Å; R639-E642 PolarHBondContact O-N 2.93Å; R639-V643 PolarHBondContact O-N 2.89Å
640	P	93.2	Very high	89.6	Confident	27 Å²	27	23.1 Å²	23.1	18%	0.175	13%	0.125	C	C	.	.	H	α-helix	trans	-52.7	-40.2	177.7	-27.9	36.3	0	0	0	113.7	L511 Y514 R515 L518 E642 V643 E644	L511-P640 HydrophobicContact CD1-CB 3.84Å; L511-P640 HydrophobicContact CG-CB 4.43Å; Y514-P640 WeakPolarHBondContact CB-O 3.33Å; R515-P640 HydrophobicContact CB-CB 4.27Å; R515-P640 HydrophobicContact CB-CG 4.02Å; R515-P640 HydrophobicContact CG-CG 4.15Å; L518-P640 HydrophobicContact CD1-CG 4.16Å; P640-E642 VanDerWaalsContact C-N 3.28Å; P640-E642 PolarHBondContact O-N 3.32Å; P640-V643 PolarHBondContact O-N 2.95Å; P640-E644 PolarHBondContact O-N 2.94Å
641	E	92.4	Very high	89.4	Confident	50 Å²	50	25.9 Å²	25.9	23%	0.234	14%	0.143	C	C	.	.	H	α-helix	trans	-64.7	-34.9	178.6	-53.8	83.3	170.5	0	0	111.3	F323 L511 R639 E644 M645	F323-E641 HydrophobicContact CE1-CB 4.35Å; F323-E641 HydrophobicContact CE1-CG 4.06Å; F323-E641 HydrophobicContact CZ-CB 3.95Å; F323-E641 HydrophobicContact CZ-CG 4.18Å; L511-E641 HydrophobicContact CD1-CB 4.31Å; L511-E641 HydrophobicContact CD1-CG 3.86Å; L511-E641 HydrophobicContact CD2-CG 3.93Å; R639-E641 WeakPolarHBondContact CB-OE2 3.14Å; R639-E641 IonicContact NH1-OE1 3.84Å; R639-E641 PolarHBondContact NH1-OE1 2.92Å; R639-E641 IonicContact NH1-OE2 2.87Å; R639-E641 PolarHBondContact NH1-OE2 3.24Å; R639-E641 VanDerWaalsContact NH1-OE2 3.12Å; R639-E641 PolarHBondContact O-N 2.96Å; E641-E644 PolarHBondContact O-N 3.46Å; E641-M645 WeakPolarHBondContact O-CG 3.44Å; E641-M645 PolarHBondContact O-N 3.43Å
642	E	93.4	Very high	89.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-74.2	-34.7	178	-60.5	172.3	139.5	0	0	111.7	Y327 T363 K366 L638 R639 P640 M645 L646	Y327-E642 PolarHBondContact OH-OE1 3.25Å; T363-E642 HydrophobicContact CG2-CB 4.37Å; T363-E642 HydrophobicContact CG2-CG 4.26Å; K366-E642 WeakPolarHBondContact CD-OE1 3.43Å; K366-E642 WeakPolarHBondContact CE-OE1 3.2Å; K366-E642 IonicContact NZ-OE1 2.93Å; K366-E642 PolarHBondContact NZ-OE1 3.38Å; K366-E642 IonicContact NZ-OE2 3.41Å; K366-E642 PolarHBondContact NZ-OE2 3.14Å; L638-E642 WeakPolarHBondContact CA-OE2 2.98Å; L638-E642 HydrophobicContact CB-CB 4.43Å; L638-E642 HydrophobicContact CD2-CB 3.91Å; R639-E642 HydrophobicContact CB-CG 4.28Å; R639-E642 PolarHBondContact N-OE2 3.49Å; R639-E642 WeakPolarHBondContact O-CA 3.15Å; R639-E642 WeakPolarHBondContact O-CB 3.33Å; R639-E642 PolarHBondContact O-N 2.93Å; P640-E642 VanDerWaalsContact C-N 3.28Å; P640-E642 PolarHBondContact O-N 3.32Å; E642-M645 HydrophobicContact CB-CE 4.27Å; E642-M645 HydrophobicContact CG-CE 3.92Å; E642-M645 PolarHBondContact O-N 2.96Å; E642-L646 VanDerWaalsContact O-CG 3.3Å; E642-L646 WeakPolarHBondContact O-CG 3.32Å; E642-L646 PolarHBondContact O-N 2.93Å
643	V	93.1	Very high	89.9	Confident	2 Å²	2	32 Å²	32	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-42.9	172	-176.4	0	0	0	0	110.5	Y514 L518 F626 L638 R639 P640 M645 L646 V647	Y514-V643 HydrophobicContact CD1-CB 4.18Å; Y514-V643 HydrophobicContact CD1-CG1 3.83Å; L518-V643 HydrophobicContact CD1-CG2 3.72Å; L518-V643 HydrophobicContact CD2-CG2 3.97Å; L518-V643 HydrophobicContact CG-CG2 4.03Å; F626-V643 HydrophobicContact CZ-CG1 4.42Å; L638-V643 HydrophobicContact CB-CG2 3.9Å; L638-V643 HydrophobicContact CD1-CG2 3.74Å; R639-V643 PolarHBondContact O-N 2.89Å; P640-V643 PolarHBondContact O-N 2.95Å; V643-M645 VanDerWaalsContact C-N 3.33Å; V643-M645 PolarHBondContact O-N 3.27Å; V643-L646 PolarHBondContact O-N 3.35Å; V643-V647 HydrophobicContact CG1-CG2 4.2Å; V643-V647 WeakPolarHBondContact O-CG2 3.35Å; V643-V647 PolarHBondContact O-N 3.41Å
644	E	93.3	Very high	90.1	Very high	41 Å²	41	34.1 Å²	34.1	19%	0.192	17%	0.174	C	C	.	.	H	α-helix	trans	-55.9	-49.7	173.4	-176.3	-168.7	164.5	0	0	110.6	Y514 P640 E641 L646 V647 C648 R701	Y514-E644 HydrophobicContact CD1-CB 4.2Å; Y514-E644 HydrophobicContact CD2-CB 3.91Å; Y514-E644 HydrophobicContact CD2-CG 4.28Å; Y514-E644 HydrophobicContact CE1-CB 4.03Å; Y514-E644 HydrophobicContact CE1-CG 4.37Å; Y514-E644 HydrophobicContact CE2-CB 3.77Å; Y514-E644 HydrophobicContact CE2-CG 3.67Å; Y514-E644 HydrophobicContact CG-CB 4.12Å; P640-E644 PolarHBondContact O-N 2.94Å; E641-E644 PolarHBondContact O-N 3.46Å; E644-L646 VanDerWaalsContact C-N 3.31Å; E644-L646 PolarHBondContact O-N 2.91Å; E644-V647 PolarHBondContact O-N 2.78Å; E644-V647 VanDerWaalsContact O-N 3.15Å; E644-C648 WeakPolarHBondContact O-CB 3.19Å; E644-C648 PolarHBondContact O-N 3.35Å; E644-R701 IonicContact OE1-CZ 3.16Å; E644-R701 IonicContact OE1-NH1 3.45Å; E644-R701 PolarHBondContact OE1-NH1 3.46Å; E644-R701 IonicContact OE1-NH2 3.77Å; E644-R701 PolarHBondContact OE1-NH2 3.45Å; E644-R701 VanDerWaalsContact OE1-NH2 3.1Å
645	M	91	Very high	90.3	Very high	37 Å²	37	34.4 Å²	34.4	18%	0.182	18%	0.175	C	C	.	.	H	α-helix	trans	-59.8	-39	178.5	-74.2	-172.9	-73.4	0	0	112.8	T363 E641 E642 V643 V647 G649 V704	T363-M645 HydrophobicContact CG2-CE 3.76Å; T363-M645 HydrophobicContact CG2-SD 4.46Å; E641-M645 WeakPolarHBondContact O-CG 3.44Å; E641-M645 PolarHBondContact O-N 3.43Å; E642-M645 HydrophobicContact CB-CE 4.27Å; E642-M645 HydrophobicContact CG-CE 3.92Å; E642-M645 PolarHBondContact O-N 2.96Å; V643-M645 VanDerWaalsContact C-N 3.33Å; V643-M645 PolarHBondContact O-N 3.27Å; M645-V647 VanDerWaalsContact C-N 3.34Å; M645-G649 CarbonylContact O-C 3.59Å; M645-G649 WeakPolarHBondContact O-CA 3.5Å; M645-G649 PolarHBondContact O-N 3.21Å; M645-V704 HydrophobicContact CB-CG2 4.02Å; M645-V704 WeakPolarHBondContact O-CG2 3.29Å
646	L	90.9	Very high	90.4	Very high	25 Å²	25	36.8 Å²	36.8	13%	0.131	19%	0.192	C	C	.	.	H	α-helix	trans	-68.2	-33.9	177.1	-70.7	176.4	0	0	0	113	K367 I370 L638 E642 V643 E644 V704	K367-L646 HydrophobicContact CB-CD2 3.77Å; K367-L646 HydrophobicContact CG-CD2 3.67Å; I370-L646 HydrophobicContact CD1-CD1 3.54Å; L638-L646 HydrophobicContact CD1-CD1 3.49Å; L638-L646 VanDerWaalsContact CD1-CD1 3.49Å; L638-L646 HydrophobicContact CD2-CD1 3.86Å; L638-L646 HydrophobicContact CG-CD1 4.33Å; E642-L646 VanDerWaalsContact O-CG 3.3Å; E642-L646 WeakPolarHBondContact O-CG 3.32Å; E642-L646 PolarHBondContact O-N 2.93Å; V643-L646 PolarHBondContact O-N 3.35Å; E644-L646 VanDerWaalsContact C-N 3.31Å; E644-L646 PolarHBondContact O-N 2.91Å; L646-V704 HydrophobicContact CD2-CG2 4.31Å
647	V	91.4	Very high	90.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-82.7	-45.9	-177.9	177	0	0	0	0	111	M495 V499 A504 L505 I507 Y514 V643 E644 M645	M495-V647 HydrophobicContact CE-CB 4.12Å; M495-V647 HydrophobicContact CE-CG1 3.89Å; M495-V647 HydrophobicContact CE-CG2 3.43Å; M495-V647 VanDerWaalsContact CE-CG2 3.43Å; M495-V647 HydrophobicContact CG-CG1 3.86Å; M495-V647 HydrophobicContact CG-CG2 4.12Å; M495-V647 HydrophobicContact SD-CG1 4.41Å; V499-V647 HydrophobicContact CG2-CB 4.48Å; V499-V647 HydrophobicContact CG2-CG2 3.46Å; V499-V647 VanDerWaalsContact CG2-CG2 3.46Å; A504-V647 CarbonylContact C-O 3.45Å; A504-V647 VanDerWaalsContact CA-O 3.31Å; A504-V647 WeakPolarHBondContact CA-O 3.38Å; L505-V647 HydrophobicContact CB-CG1 4.37Å; L505-V647 HydrophobicContact CD1-CG1 4.25Å; L505-V647 PolarHBondContact N-O 3.38Å; I507-V647 HydrophobicContact CD1-CG1 3.57Å; I507-V647 HydrophobicContact CG1-CG1 4.12Å; Y514-V647 HydrophobicContact CE1-CB 4.29Å; Y514-V647 HydrophobicContact CE1-CG2 4.29Å; V643-V647 HydrophobicContact CG1-CG2 4.2Å; V643-V647 WeakPolarHBondContact O-CG2 3.35Å; V643-V647 PolarHBondContact O-N 3.41Å; E644-V647 PolarHBondContact O-N 2.78Å; E644-V647 VanDerWaalsContact O-N 3.15Å; M645-V647 VanDerWaalsContact C-N 3.34Å
648	C	89.1	Confident	90.4	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-101.7	-17.3	-169.8	-59.3	0	0	0	0	113	I507 Y514 E644 R701	I507-C648 PolarHBondContact O-SG 3.2Å; Y514-C648 PolarHBondContact OH-SG 3.2Å; E644-C648 WeakPolarHBondContact O-CB 3.19Å; E644-C648 PolarHBondContact O-N 3.35Å; C648-R701 VanDerWaalsContact O-CB 3.27Å; C648-R701 WeakPolarHBondContact O-CB 3.49Å; C648-R701 VanDerWaalsContact O-CD 3.23Å; C648-R701 WeakPolarHBondContact O-CD 3.43Å
649	G	88.1	Confident	90.5	Very high	2 Å²	2	35.6 Å²	35.6	2%	0.021	19%	0.189	C	C	.	.			trans	90.5	170.4	-167.6	0	0	0	0	0	113	M645 V702	M645-G649 CarbonylContact O-C 3.59Å; M645-G649 WeakPolarHBondContact O-CA 3.5Å; M645-G649 PolarHBondContact O-N 3.21Å; G649-V702 CarbonylContact C-O 3.5Å; G649-V702 WeakPolarHBondContact CA-O 3.34Å
650	S	85.8	Confident	90.5	Very high	16 Å²	16	40.4 Å²	40.4	11%	0.112	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-79.9	137.9	176.3	178.8	0	0	0	0	111.3	E652 R701 V702	S650-E652 VanDerWaalsContact C-N 3.3Å; S650-E652 PolarHBondContact OG-N 2.77Å; S650-R701 WeakPolarHBondContact O-CA 3.46Å; S650-R701 WeakPolarHBondContact O-CB 3.26Å; S650-V702 PolarHBondContact N-O 2.83Å; S650-V702 WeakPolarHBondContact O-CG2 3.34Å; S650-V702 PolarHBondContact O-N 3.26Å
651	P	81.5	Confident	90.5	Very high	68 Å²	68	40.7 Å²	40.7	44%	0.442	22%	0.216	S	C	.	.			trans	-79.4	-10.8	173.8	33.7	-35.9	0	0	0	113.5	L653	P651-L653 PolarHBondContact O-N 2.85Å
652	E	83.7	Confident	90.6	Very high	157 Å²	157	38.8 Å²	38.8	73%	0.734	21%	0.209	S	C	*	.			trans	-78.7	118.8	-176.2	-65.5	-175.5	173.4	0	0	111.4	S650 V702	S650-E652 VanDerWaalsContact C-N 3.3Å; S650-E652 PolarHBondContact OG-N 2.77Å; E652-V702 WeakPolarHBondContact O-CG2 3.36Å
653	L	87.3	Confident	90.7	Very high	34 Å²	34	43.2 Å²	43.2	18%	0.178	23%	0.229	C	C	.	.			trans	-104.3	120.7	-178.7	-56.6	-172.5	0	0	0	111	P651 M655 L686 Q689 K690 L693 V702 M707	P651-L653 PolarHBondContact O-N 2.85Å; L653-M655 HydrophobicContact CD1-CE 4.26Å; L653-L686 HydrophobicContact CB-CD1 4.39Å; L653-L686 HydrophobicContact CD1-CD1 3.86Å; L653-L686 HydrophobicContact CG-CD1 4.31Å; L653-Q689 HydrophobicContact CD1-CB 4.23Å; L653-K690 HydrophobicContact CD1-CG 3.75Å; L653-L693 HydrophobicContact CD2-CD2 3.82Å; L653-V702 HydrophobicContact CD2-CG1 3.47Å; L653-V702 VanDerWaalsContact CD2-CG1 3.47Å; L653-M707 HydrophobicContact CB-SD 4.16Å; L653-M707 HydrophobicContact CD2-CE 4.11Å; L653-M707 HydrophobicContact CD2-SD 4.27Å
654	D	90.1	Very high	90.9	Very high	84 Å²	84	45.4 Å²	45.4	45%	0.449	24%	0.238	S	C	.	.			trans	-116.8	88.7	165.9	-177.9	-4.5	0	0	0	110	S656 A657 L658 M707	D654-S656 PolarHBondContact O-N 3.46Å; D654-S656 WeakPolarHBondContact OD1-CA 3.36Å; D654-S656 VanDerWaalsContact OD1-CB 3.26Å; D654-S656 WeakPolarHBondContact OD1-CB 3.45Å; D654-S656 PolarHBondContact OD1-N 2.5Å; D654-A657 HydrophobicContact CB-CB 3.99Å; D654-A657 WeakPolarHBondContact O-CB 3.42Å; D654-A657 PolarHBondContact O-N 3.48Å; D654-A657 VanDerWaalsContact O-N 3.15Å; D654-A657 PolarHBondContact OD1-N 2.93Å; D654-A657 WeakPolarHBondContact OD2-CB 3.21Å; D654-L658 PolarHBondContact O-N 3.29Å; D654-M707 PolarHBondContact N-SD 2.94Å
655	M	92.1	Very high	90.9	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.039	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-21.6	178.7	-70.4	-62.5	177.4	0	0	113.1	L653 L658 Q659 V681 L682 Q689 M707	L653-M655 HydrophobicContact CD1-CE 4.26Å; M655-L658 HydrophobicContact SD-CD2 3.81Å; M655-Q659 PolarHBondContact O-N 3.31Å; M655-V681 HydrophobicContact CG-CG1 4.34Å; M655-V681 HydrophobicContact SD-CG1 3.99Å; M655-L682 HydrophobicContact CB-CD2 3.8Å; M655-Q689 HydrophobicContact CE-CB 3.48Å; M655-Q689 VanDerWaalsContact CE-CB 3.48Å; M655-Q689 HydrophobicContact CE-CG 3.89Å; M655-Q689 WeakPolarHBondContact CE-O 3.29Å; M655-Q689 HydrophobicContact CG-CG 4.07Å; M655-M707 HydrophobicContact CE-CE 3.93Å; M655-M707 HydrophobicContact SD-CE 3.83Å; M655-M707 HydrophobicContact SD-SD 4.18Å
656	S	92.1	Very high	91	Very high	55 Å²	55	48.7 Å²	48.7	39%	0.385	27%	0.271	S	S	.	.	H	α-helix	trans	-74.6	-39.8	176.1	-55.7	0	0	0	0	110.9	D654 L658 Q659 K660	D654-S656 PolarHBondContact O-N 3.46Å; D654-S656 WeakPolarHBondContact OD1-CA 3.36Å; D654-S656 VanDerWaalsContact OD1-CB 3.26Å; D654-S656 WeakPolarHBondContact OD1-CB 3.45Å; D654-S656 PolarHBondContact OD1-N 2.5Å; S656-L658 VanDerWaalsContact C-N 3.34Å; S656-Q659 PolarHBondContact O-N 2.87Å; S656-K660 WeakPolarHBondContact O-CG 3.25Å; S656-K660 PolarHBondContact O-N 3.08Å
657	A	91.9	Very high	91.2	Very high	19 Å²	19	48.4 Å²	48.4	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-42.1	170.4	0	0	0	0	0	111.3	D654 Q659 K660 A661 M707	D654-A657 HydrophobicContact CB-CB 3.99Å; D654-A657 WeakPolarHBondContact O-CB 3.42Å; D654-A657 PolarHBondContact O-N 3.48Å; D654-A657 VanDerWaalsContact O-N 3.15Å; D654-A657 PolarHBondContact OD1-N 2.93Å; D654-A657 WeakPolarHBondContact OD2-CB 3.21Å; A657-Q659 PolarHBondContact O-N 3.37Å; A657-K660 PolarHBondContact O-N 3.2Å; A657-A661 PolarHBondContact O-N 3.06Å; A657-A661 VanDerWaalsContact O-N 3.16Å; A657-M707 HydrophobicContact CB-CB 4.46Å
658	L	92.4	Very high	91.3	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-58	-47.7	175.6	-170.9	68.6	0	0	0	111.8	D654 M655 S656 K660 A661 A662 W678 M707 L710 F712	D654-L658 PolarHBondContact O-N 3.29Å; M655-L658 HydrophobicContact SD-CD2 3.81Å; S656-L658 VanDerWaalsContact C-N 3.34Å; L658-K660 VanDerWaalsContact C-N 3.26Å; L658-K660 PolarHBondContact O-N 3.12Å; L658-A661 PolarHBondContact O-N 3.23Å; L658-A662 WeakPolarHBondContact O-CB 3.31Å; L658-A662 PolarHBondContact O-N 2.99Å; L658-W678 HydrophobicContact CB-CH2 4.49Å; L658-W678 HydrophobicContact CD2-CH2 4.05Å; L658-W678 HydrophobicContact CD2-CZ3 4.26Å; L658-W678 HydrophobicContact CG-CH2 4.01Å; L658-W678 HydrophobicContact CG-CZ3 4.46Å; L658-M707 HydrophobicContact CB-CB 3.99Å; L658-M707 HydrophobicContact CB-CE 4.22Å; L658-M707 HydrophobicContact CB-SD 4.14Å; L658-M707 HydrophobicContact CD1-CB 4.27Å; L658-M707 HydrophobicContact CD1-CE 4.27Å; L658-M707 HydrophobicContact CD2-CE 3.8Å; L658-M707 HydrophobicContact CG-CE 4.31Å; L658-L710 HydrophobicContact CD1-CB 4.25Å; L658-L710 HydrophobicContact CD1-CD2 3.83Å; L658-L710 HydrophobicContact CD1-CG 4.44Å; L658-F712 HydrophobicContact CD1-CB 3.64Å; L658-F712 HydrophobicContact CD1-CD1 4.44Å; L658-F712 HydrophobicContact CD1-CD2 4.43Å; L658-F712 HydrophobicContact CD1-CG 3.95Å; L658-F712 HydrophobicContact CD2-CD1 4.36Å; L658-F712 HydrophobicContact CD2-CD2 4.42Å; L658-F712 HydrophobicContact CD2-CE1 4.5Å; L658-F712 HydrophobicContact CD2-CG 4.32Å; L658-F712 HydrophobicContact CG-CB 4.42Å; L658-F712 HydrophobicContact CG-CD1 4.35Å; L658-F712 HydrophobicContact CG-CG 4.31Å
659	Q	94.6	Very high	91.5	Very high	54 Å²	54	56.4 Å²	56.4	25%	0.252	31%	0.31	S	S	.	.	H	α-helix	trans	-57.7	-39.2	178.2	179.6	-176.8	37.5	0	0	112.6	M655 S656 A657 W678	M655-Q659 PolarHBondContact O-N 3.31Å; S656-Q659 PolarHBondContact O-N 2.87Å; A657-Q659 PolarHBondContact O-N 3.37Å; Q659-W678 HydrophobicContact CB-CD2 3.77Å; Q659-W678 HydrophobicContact CB-CE3 3.65Å; Q659-W678 HydrophobicContact CB-CG 4.44Å; Q659-W678 HydrophobicContact CB-CH2 4.09Å; Q659-W678 HydrophobicContact CB-CZ2 4.18Å; Q659-W678 HydrophobicContact CB-CZ3 3.81Å; Q659-W678 HydrophobicContact CG-CB 4.42Å; Q659-W678 HydrophobicContact CG-CD2 3.54Å; Q659-W678 HydrophobicContact CG-CE3 3.96Å; Q659-W678 HydrophobicContact CG-CG 3.73Å; Q659-W678 HydrophobicContact CG-CZ2 4.33Å; Q659-W678 VanDerWaalsContact NE2-CG 3.29Å
660	K	93.4	Very high	91.7	Very high	166 Å²	166	62.7 Å²	62.7	72%	0.722	34%	0.34	S	S	*	.	H	α-helix	trans	-67.9	-36.8	-179.6	-71.9	171.7	-175.3	174.2	0	111.9	S656 A657 L658	S656-K660 WeakPolarHBondContact O-CG 3.25Å; S656-K660 PolarHBondContact O-N 3.08Å; A657-K660 PolarHBondContact O-N 3.2Å; L658-K660 VanDerWaalsContact C-N 3.26Å; L658-K660 PolarHBondContact O-N 3.12Å
661	A	93	Very high	92.2	Very high	34 Å²	34	64.8 Å²	64.8	28%	0.281	35%	0.35	S	S	.	.	H	α-helix	trans	-89.6	-14.7	-178	0	0	0	0	0	114.3	A657 L658 A708	A657-A661 PolarHBondContact O-N 3.06Å; A657-A661 VanDerWaalsContact O-N 3.16Å; L658-A661 PolarHBondContact O-N 3.23Å; A661-A708 HydrophobicContact CB-CB 4.24Å; A661-A708 WeakPolarHBondContact CB-O 3.45Å
662	A	94.9	Very high	92.8	Very high	10 Å²	10	63.6 Å²	63.6	8%	0.083	35%	0.346	C	S	.	.			trans	-60.6	137.7	-175.6	0	0	0	0	0	113.2	L658 Y664 W678 F712	L658-A662 WeakPolarHBondContact O-CB 3.31Å; L658-A662 PolarHBondContact O-N 2.99Å; A662-Y664 VanDerWaalsContact O-CE2 3.24Å; A662-Y664 WeakPolarHBondContact O-CE2 3.44Å; A662-W678 HydrophobicContact CB-CH2 4.17Å; A662-W678 HydrophobicContact CB-CZ2 3.55Å; A662-F712 WeakPolarHBondContact CA-O 3.47Å; A662-F712 HydrophobicContact CB-CD1 4.03Å
663	Q	95.5	Very high	93.3	Very high	92 Å²	92	56.6 Å²	56.6	43%	0.43	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	150.5	176.8	-64.2	173.7	16.9	0	0	110.5	N711 F712 K713 I714	Q663-N711 VanDerWaalsContact CD-OD1 3.23Å; Q663-N711 PolarHBondContact NE2-OD1 3.32Å; Q663-N711 PolarHBondContact OE1-OD1 3.36Å; Q663-F712 PolarHBondContact N-O 3.02Å; Q663-K713 HydrophobicContact CB-CG 4.22Å; Q663-K713 WeakPolarHBondContact O-CA 3.49Å; Q663-I714 PolarHBondContact O-N 2.92Å
664	Y	96.2	Very high	93.8	Very high	49 Å²	49	55 Å²	55	19%	0.192	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.4	-176.5	-53.1	-87	0	0	0	110.2	A662 Y667 K669 V674 W678 I714	A662-Y664 VanDerWaalsContact O-CE2 3.24Å; A662-Y664 WeakPolarHBondContact O-CE2 3.44Å; Y664-Y667 WeakPolarHBondContact CB-O 3.32Å; Y664-K669 HydrophobicContact CD2-CB 4.32Å; Y664-K669 HydrophobicContact CE2-CB 3.99Å; Y664-K669 HydrophobicContact CE2-CG 4.2Å; Y664-V674 HydrophobicContact CD1-CG1 3.96Å; Y664-V674 HydrophobicContact CD1-CG2 3.9Å; Y664-V674 HydrophobicContact CE1-CB 4.31Å; Y664-V674 HydrophobicContact CE1-CG1 3.28Å; Y664-V674 HydrophobicContact CE1-CG2 4.04Å; Y664-W678 AromaticContact CE1-NE1 3.95Å; Y664-W678 AromaticContact CZ-NE1 3.85Å; Y664-W678 PolarHBondContact OH-NE1 3.45Å; Y664-I714 VanDerWaalsContact CA-O 3.32Å; Y664-I714 WeakPolarHBondContact CA-O 3.45Å; Y664-I714 HydrophobicContact CD1-CB 3.94Å; Y664-I714 HydrophobicContact CD1-CD1 4.38Å; Y664-I714 HydrophobicContact CD1-CG2 4.41Å; Y664-I714 HydrophobicContact CE1-CB 4.22Å; Y664-I714 HydrophobicContact CE1-CD1 3.79Å; Y664-I714 HydrophobicContact CE1-CG1 4.49Å
665	E	94.6	Very high	94.1	Very high	79 Å²	79	57.5 Å²	57.5	37%	0.369	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.2	176.6	-58.2	177.5	176.4	0	0	109	Y667 K713 I714 C715 K716	E665-Y667 PolarHBondContact O-N 3.47Å; E665-K713 IonicContact OE1-NZ 3.91Å; E665-K713 PolarHBondContact OE1-NZ 3.29Å; E665-I714 PolarHBondContact N-O 3.01Å; E665-C715 HydrophobicContact CB-CB 4.29Å; E665-C715 CarbonylContact O-C 3.48Å; E665-C715 VanDerWaalsContact O-CA 3.29Å; E665-C715 WeakPolarHBondContact O-CA 3.32Å; E665-C715 PolarHBondContact OE2-SG 2.64Å; E665-K716 PolarHBondContact O-N 3.32Å
666	G	92.6	Very high	94.3	Very high	67 Å²	67	59.3 Å²	59.3	69%	0.691	32%	0.317	S	S	*	.	S	Bend	trans	71.8	-9.4	-174.7	0	0	0	0	0	115.2	K716	G666-K716 VanDerWaalsContact O-CD 3.32Å; G666-K716 WeakPolarHBondContact O-CD 3.5Å
667	Y	94.7	Very high	94.5	Very high	20 Å²	20	56.7 Å²	56.7	8%	0.078	30%	0.298	C	S	.	.	S	Bend	trans	-114.3	158.2	164.2	-76.1	-57.6	0	0	0	110.9	Y664 E665 D671 V674 I714 K716 L736 P737 P738	Y664-Y667 WeakPolarHBondContact CB-O 3.32Å; E665-Y667 PolarHBondContact O-N 3.47Å; Y667-D671 WeakPolarHBondContact CA-OD2 3.46Å; Y667-D671 HydrophobicContact CD1-CB 4.05Å; Y667-D671 WeakPolarHBondContact CD1-OD2 3.44Å; Y667-V674 HydrophobicContact CD1-CG2 4.48Å; Y667-V674 HydrophobicContact CD2-CG2 4.26Å; Y667-V674 HydrophobicContact CG-CG2 3.93Å; Y667-I714 HydrophobicContact CD2-CG2 4.32Å; Y667-K716 HydrophobicContact CD1-CB 4.25Å; Y667-K716 HydrophobicContact CD1-CD 4.11Å; Y667-K716 HydrophobicContact CD1-CG 4.35Å; Y667-K716 HydrophobicContact CD2-CB 3.58Å; Y667-K716 HydrophobicContact CD2-CG 4.28Å; Y667-K716 HydrophobicContact CE1-CB 4.18Å; Y667-K716 HydrophobicContact CE1-CD 3.78Å; Y667-K716 HydrophobicContact CE1-CG 3.87Å; Y667-K716 HydrophobicContact CE2-CB 3.49Å; Y667-K716 VanDerWaalsContact CE2-CB 3.49Å; Y667-K716 HydrophobicContact CE2-CG 3.79Å; Y667-K716 HydrophobicContact CG-CB 3.96Å; Y667-L736 HydrophobicContact CE2-CB 4.02Å; Y667-L736 WeakPolarHBondContact CE2-O 3.42Å; Y667-L736 PolarHBondContact OH-O 2.87Å; Y667-P737 PolarHBondContact OH-O 3.26Å; Y667-P738 WeakPolarHBondContact OH-CA 3.26Å
668	S	93.4	Very high	94.8	Very high	56 Å²	56	56 Å²	56	39%	0.392	29%	0.291	S	S	.	.			trans	-103.1	153.4	164.2	171.3	0	0	0	0	110.3	M670 D671	S668-M670 PolarHBondContact O-N 3.11Å; S668-M670 PolarHBondContact OG-N 3.49Å; S668-D671 PolarHBondContact N-OD2 2.8Å; S668-D671 WeakPolarHBondContact O-CB 3.45Å; S668-D671 PolarHBondContact O-N 3.23Å
669	K	92.7	Very high	95	Very high	112 Å²	112	59.6 Å²	59.6	49%	0.487	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-25.4	170.5	-171.2	175.8	-179.1	175.9	0	112.8	Y664	Y664-K669 HydrophobicContact CD2-CB 4.32Å; Y664-K669 HydrophobicContact CE2-CB 3.99Å; Y664-K669 HydrophobicContact CE2-CG 4.2Å
670	M	93.3	Very high	95.1	Very high	135 Å²	135	57.1 Å²	57.1	67%	0.665	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-7.8	-179.9	-60	-56.7	-179.1	0	0	113.8	S668 R675	S668-M670 PolarHBondContact O-N 3.11Å; S668-M670 PolarHBondContact OG-N 3.49Å; M670-R675 PolarHBondContact O-NE 3.46Å; M670-R675 PolarHBondContact O-NH2 3.36Å
671	D	95.3	Very high	95.2	Very high	60 Å²	60	49.2 Å²	49.2	32%	0.321	27%	0.265	S	S	.	.	S	Bend	trans	-67.8	145.5	-178.3	-69.6	-27	0	0	0	111.8	Y667 S668 T673 V674 R675	Y667-D671 WeakPolarHBondContact CA-OD2 3.46Å; Y667-D671 HydrophobicContact CD1-CB 4.05Å; Y667-D671 WeakPolarHBondContact CD1-OD2 3.44Å; S668-D671 PolarHBondContact N-OD2 2.8Å; S668-D671 WeakPolarHBondContact O-CB 3.45Å; S668-D671 PolarHBondContact O-N 3.23Å; D671-T673 VanDerWaalsContact C-N 3.33Å; D671-T673 PolarHBondContact O-N 3.3Å; D671-V674 HydrophobicContact CB-CG2 4.43Å; D671-V674 PolarHBondContact O-N 2.9Å; D671-R675 PolarHBondContact O-N 3.31Å
672	A	94.5	Very high	95.3	Very high	42 Å²	42	50.9 Å²	50.9	35%	0.347	27%	0.269	S	S	.	.	H	α-helix	trans	-58.8	-44.6	-176.6	0	0	0	0	0	111.5	V674 R675 F676	A672-V674 VanDerWaalsContact C-N 3.32Å; A672-V674 PolarHBondContact O-N 3.25Å; A672-R675 PolarHBondContact O-N 2.69Å; A672-F676 HydrophobicContact CB-CE2 3.97Å; A672-F676 HydrophobicContact CB-CZ 4.02Å; A672-F676 WeakPolarHBondContact O-CB 3.47Å; A672-F676 WeakPolarHBondContact O-CD1 3.41Å; A672-F676 VanDerWaalsContact O-CD2 3.25Å; A672-F676 WeakPolarHBondContact O-CD2 3.26Å; A672-F676 WeakPolarHBondContact O-CG 3.47Å; A672-F676 PolarHBondContact O-N 3.28Å
673	T	95.1	Very high	95.4	Very high	11 Å²	11	53.7 Å²	53.7	7%	0.067	29%	0.292	C	S	.	.	H	α-helix	trans	-57.7	-42.4	177.3	-48.4	0	0	0	0	112.4	D671 F676 F677 L736 Y739 L745	D671-T673 VanDerWaalsContact C-N 3.33Å; D671-T673 PolarHBondContact O-N 3.3Å; T673-F676 PolarHBondContact O-N 3.28Å; T673-F677 WeakPolarHBondContact O-CB 3.47Å; T673-F677 PolarHBondContact O-N 2.98Å; T673-L736 HydrophobicContact CG2-CB 4.48Å; T673-Y739 HydrophobicContact CG2-CD2 4.22Å; T673-Y739 PolarHBondContact OG1-O 2.85Å; T673-L745 HydrophobicContact CG2-CD1 4.01Å; T673-L745 WeakPolarHBondContact O-CD1 3.32Å
674	V	96.9	Very high	95.4	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-68.2	-43.1	178.9	168.6	0	0	0	0	111.3	Y664 Y667 D671 A672 F677 W678	Y664-V674 HydrophobicContact CD1-CG1 3.96Å; Y664-V674 HydrophobicContact CD1-CG2 3.9Å; Y664-V674 HydrophobicContact CE1-CB 4.31Å; Y664-V674 HydrophobicContact CE1-CG1 3.28Å; Y664-V674 HydrophobicContact CE1-CG2 4.04Å; Y667-V674 HydrophobicContact CD1-CG2 4.48Å; Y667-V674 HydrophobicContact CD2-CG2 4.26Å; Y667-V674 HydrophobicContact CG-CG2 3.93Å; D671-V674 HydrophobicContact CB-CG2 4.43Å; D671-V674 PolarHBondContact O-N 2.9Å; A672-V674 VanDerWaalsContact C-N 3.32Å; A672-V674 PolarHBondContact O-N 3.25Å; V674-F677 WeakPolarHBondContact O-CB 3.18Å; V674-F677 PolarHBondContact O-N 3.26Å; V674-W678 VanDerWaalsContact O-CD1 3.25Å; V674-W678 PolarHBondContact O-N 3.08Å; V674-W678 VanDerWaalsContact O-N 3.13Å
675	R	96.4	Very high	95.3	Very high	136 Å²	136	51.4 Å²	51.4	51%	0.513	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-45.2	174.8	-73.4	-175.8	-88.8	141.8	-11	111.2	M670 D671 A672 F677 W678 D679	M670-R675 PolarHBondContact O-NE 3.46Å; M670-R675 PolarHBondContact O-NH2 3.36Å; D671-R675 PolarHBondContact O-N 3.31Å; A672-R675 PolarHBondContact O-N 2.69Å; R675-F677 VanDerWaalsContact C-N 3.3Å; R675-F677 PolarHBondContact O-N 3.03Å; R675-W678 PolarHBondContact O-N 2.85Å; R675-D679 WeakPolarHBondContact O-CB 3.43Å; R675-D679 VanDerWaalsContact O-CG 3.22Å; R675-D679 PolarHBondContact O-N 3.33Å
676	F	96.8	Very high	95.2	Very high	46 Å²	46	51.8 Å²	51.8	20%	0.202	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-39.9	174.9	-62.1	-22.1	0	0	0	112.5	A672 T673 V680 R742 L745	A672-F676 HydrophobicContact CB-CE2 3.97Å; A672-F676 HydrophobicContact CB-CZ 4.02Å; A672-F676 WeakPolarHBondContact O-CB 3.47Å; A672-F676 WeakPolarHBondContact O-CD1 3.41Å; A672-F676 VanDerWaalsContact O-CD2 3.25Å; A672-F676 WeakPolarHBondContact O-CD2 3.26Å; A672-F676 WeakPolarHBondContact O-CG 3.47Å; A672-F676 PolarHBondContact O-N 3.28Å; T673-F676 PolarHBondContact O-N 3.28Å; F676-V680 WeakPolarHBondContact O-CB 3.46Å; F676-V680 WeakPolarHBondContact O-CG2 3.18Å; F676-V680 PolarHBondContact O-N 2.93Å; F676-V680 VanDerWaalsContact O-N 3.08Å; F676-R742 HydrophobicContact CB-CB 4.26Å; F676-R742 HydrophobicContact CB-CG 4.41Å; F676-R742 HydrophobicContact CD1-CB 3.89Å; F676-R742 HydrophobicContact CD1-CG 4.5Å; F676-R742 HydrophobicContact CE1-CB 4.41Å; F676-R742 HydrophobicContact CG-CB 3.99Å; F676-L745 HydrophobicContact CB-CD1 3.93Å
677	F	97.2	Very high	95.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.2	-54.6	176.5	175.9	-93	0	0	0	110.9	T673 V674 R675 D679 V680 V681 L692 F712 I714 I734 L736 L745 L749	T673-F677 WeakPolarHBondContact O-CB 3.47Å; T673-F677 PolarHBondContact O-N 2.98Å; V674-F677 WeakPolarHBondContact O-CB 3.18Å; V674-F677 PolarHBondContact O-N 3.26Å; R675-F677 VanDerWaalsContact C-N 3.3Å; R675-F677 PolarHBondContact O-N 3.03Å; F677-D679 PolarHBondContact O-N 3.48Å; F677-V680 WeakPolarHBondContact O-CB 3.48Å; F677-V680 PolarHBondContact O-N 3.04Å; F677-V680 VanDerWaalsContact O-N 3.1Å; F677-V681 HydrophobicContact CD1-CG2 4.16Å; F677-V681 HydrophobicContact CD2-CG2 4.22Å; F677-V681 HydrophobicContact CE1-CG2 3.8Å; F677-V681 HydrophobicContact CE2-CG2 3.88Å; F677-V681 HydrophobicContact CG-CG2 4.36Å; F677-V681 HydrophobicContact CZ-CG2 3.66Å; F677-V681 WeakPolarHBondContact O-CG2 3.38Å; F677-V681 PolarHBondContact O-N 2.92Å; F677-L692 HydrophobicContact CE2-CD1 4.27Å; F677-L692 HydrophobicContact CZ-CD1 4.28Å; F677-L692 HydrophobicContact CZ-CD2 4.27Å; F677-F712 HydrophobicContact CE1-CE1 4.34Å; F677-F712 HydrophobicContact CZ-CE1 4.38Å; F677-F712 HydrophobicContact CZ-CZ 4.19Å; F677-I714 HydrophobicContact CD1-CD1 3.64Å; F677-I714 HydrophobicContact CE1-CD1 3.6Å; F677-I714 HydrophobicContact CE1-CG1 4.48Å; F677-I714 HydrophobicContact CG-CD1 4.4Å; F677-I714 HydrophobicContact CZ-CD1 4.31Å; F677-I734 HydrophobicContact CE2-CD1 4.28Å; F677-I734 HydrophobicContact CZ-CD1 4.2Å; F677-L736 HydrophobicContact CB-CD1 4.11Å; F677-L736 HydrophobicContact CD2-CD1 3.73Å; F677-L736 HydrophobicContact CD2-CD2 4.32Å; F677-L736 HydrophobicContact CE2-CD1 4.41Å; F677-L736 HydrophobicContact CG-CD1 4.04Å; F677-L745 HydrophobicContact CB-CD1 4.02Å; F677-L745 HydrophobicContact CB-CD2 4.41Å; F677-L745 HydrophobicContact CD2-CD2 4.49Å; F677-L749 HydrophobicContact CD2-CD2 3.97Å; F677-L749 HydrophobicContact CE2-CD1 4.33Å; F677-L749 HydrophobicContact CE2-CD2 3.86Å
678	W	97.2	Very high	95.1	Very high	3 Å²	3	54.9 Å²	54.9	1%	0.011	29%	0.292	C	S	.	.	H	α-helix	trans	-67.3	-37.8	-178.3	-68.9	116	0	0	0	113.2	L658 Q659 A662 Y664 V674 R675 V680 V681 L682 F712 I714	L658-W678 HydrophobicContact CB-CH2 4.49Å; L658-W678 HydrophobicContact CD2-CH2 4.05Å; L658-W678 HydrophobicContact CD2-CZ3 4.26Å; L658-W678 HydrophobicContact CG-CH2 4.01Å; L658-W678 HydrophobicContact CG-CZ3 4.46Å; Q659-W678 HydrophobicContact CB-CD2 3.77Å; Q659-W678 HydrophobicContact CB-CE3 3.65Å; Q659-W678 HydrophobicContact CB-CG 4.44Å; Q659-W678 HydrophobicContact CB-CH2 4.09Å; Q659-W678 HydrophobicContact CB-CZ2 4.18Å; Q659-W678 HydrophobicContact CB-CZ3 3.81Å; Q659-W678 HydrophobicContact CG-CB 4.42Å; Q659-W678 HydrophobicContact CG-CD2 3.54Å; Q659-W678 HydrophobicContact CG-CE3 3.96Å; Q659-W678 HydrophobicContact CG-CG 3.73Å; Q659-W678 HydrophobicContact CG-CZ2 4.33Å; Q659-W678 VanDerWaalsContact NE2-CG 3.29Å; A662-W678 HydrophobicContact CB-CH2 4.17Å; A662-W678 HydrophobicContact CB-CZ2 3.55Å; Y664-W678 AromaticContact CE1-NE1 3.95Å; Y664-W678 AromaticContact CZ-NE1 3.85Å; Y664-W678 PolarHBondContact OH-NE1 3.45Å; V674-W678 VanDerWaalsContact O-CD1 3.25Å; V674-W678 PolarHBondContact O-N 3.08Å; V674-W678 VanDerWaalsContact O-N 3.13Å; R675-W678 PolarHBondContact O-N 2.85Å; W678-V680 PolarHBondContact O-N 2.98Å; W678-V681 HydrophobicContact CE3-CB 4.41Å; W678-V681 HydrophobicContact CE3-CG1 4.38Å; W678-V681 HydrophobicContact CZ3-CG1 4.3Å; W678-V681 PolarHBondContact O-N 3.19Å; W678-L682 VanDerWaalsContact O-CB 3.3Å; W678-L682 WeakPolarHBondContact O-CB 3.24Å; W678-L682 VanDerWaalsContact O-CG 3.31Å; W678-L682 WeakPolarHBondContact O-CG 3.22Å; W678-L682 PolarHBondContact O-N 3.34Å; W678-F712 HydrophobicContact CH2-CD1 4.29Å; W678-F712 HydrophobicContact CH2-CE1 4.03Å; W678-F712 HydrophobicContact CZ2-CE1 4.27Å; W678-I714 HydrophobicContact CZ2-CD1 3.66Å
679	D	96.1	Very high	95.1	Very high	78 Å²	78	53.5 Å²	53.5	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-28.1	173.2	-73.9	-10.8	0	0	0	112.8	R675 F677 A683 R742	R675-D679 WeakPolarHBondContact O-CB 3.43Å; R675-D679 VanDerWaalsContact O-CG 3.22Å; R675-D679 PolarHBondContact O-N 3.33Å; F677-D679 PolarHBondContact O-N 3.48Å; D679-A683 WeakPolarHBondContact O-CB 3.33Å; D679-R742 PolarHBondContact O-NH2 3Å
680	V	96.9	Very high	95	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-83.9	-48.5	176.9	167.8	0	0	0	0	110.5	F676 F677 W678 A683 F684 R742 L745 K746 L749	F676-V680 WeakPolarHBondContact O-CB 3.46Å; F676-V680 WeakPolarHBondContact O-CG2 3.18Å; F676-V680 PolarHBondContact O-N 2.93Å; F676-V680 VanDerWaalsContact O-N 3.08Å; F677-V680 WeakPolarHBondContact O-CB 3.48Å; F677-V680 PolarHBondContact O-N 3.04Å; F677-V680 VanDerWaalsContact O-N 3.1Å; W678-V680 PolarHBondContact O-N 2.98Å; V680-A683 CarbonylContact O-C 3.05Å; V680-A683 PolarHBondContact O-N 3.28Å; V680-F684 HydrophobicContact CG1-CD1 4.03Å; V680-F684 HydrophobicContact CG1-CE1 3.31Å; V680-F684 HydrophobicContact CG1-CE2 4.14Å; V680-F684 HydrophobicContact CG1-CZ 3.38Å; V680-F684 VanDerWaalsContact O-CD1 3.3Å; V680-F684 WeakPolarHBondContact O-CD1 3.35Å; V680-F684 PolarHBondContact O-N 3.43Å; V680-F684 VanDerWaalsContact O-N 3.11Å; V680-R742 HydrophobicContact CG2-CG 3.81Å; V680-L745 HydrophobicContact CB-CD2 4.21Å; V680-L745 HydrophobicContact CG1-CD2 4.41Å; V680-L745 HydrophobicContact CG2-CD2 4.15Å; V680-K746 HydrophobicContact CG1-CB 4.03Å; V680-K746 HydrophobicContact CG1-CG 3.92Å; V680-K746 HydrophobicContact CG2-CB 3.8Å; V680-K746 HydrophobicContact CG2-CG 4.32Å; V680-L749 HydrophobicContact CG1-CD2 4.36Å
681	V	96	Very high	94.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.5	-43	-175.9	170.9	0	0	0	0	112.3	M655 F677 W678 A683 F684 Q689 L692 L749	M655-V681 HydrophobicContact CG-CG1 4.34Å; M655-V681 HydrophobicContact SD-CG1 3.99Å; F677-V681 HydrophobicContact CD1-CG2 4.16Å; F677-V681 HydrophobicContact CD2-CG2 4.22Å; F677-V681 HydrophobicContact CE1-CG2 3.8Å; F677-V681 HydrophobicContact CE2-CG2 3.88Å; F677-V681 HydrophobicContact CG-CG2 4.36Å; F677-V681 HydrophobicContact CZ-CG2 3.66Å; F677-V681 WeakPolarHBondContact O-CG2 3.38Å; F677-V681 PolarHBondContact O-N 2.92Å; W678-V681 HydrophobicContact CE3-CB 4.41Å; W678-V681 HydrophobicContact CE3-CG1 4.38Å; W678-V681 HydrophobicContact CZ3-CG1 4.3Å; W678-V681 PolarHBondContact O-N 3.19Å; V681-A683 PolarHBondContact O-N 2.97Å; V681-F684 WeakPolarHBondContact O-CB 3.39Å; V681-F684 PolarHBondContact O-N 2.88Å; V681-F684 VanDerWaalsContact O-N 3.12Å; V681-Q689 PolarHBondContact O-NE2 2.82Å; V681-L692 HydrophobicContact CB-CD2 4.13Å; V681-L692 HydrophobicContact CG1-CD2 3.45Å; V681-L692 VanDerWaalsContact CG1-CD2 3.45Å; V681-L692 HydrophobicContact CG2-CD2 3.5Å; V681-L749 HydrophobicContact CG2-CD2 4.11Å
682	L	95.7	Very high	94.8	Very high	69 Å²	69	45.9 Å²	45.9	36%	0.361	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.6	176.1	-67.5	170.7	0	0	0	112.3	M655 W678	M655-L682 HydrophobicContact CB-CD2 3.8Å; W678-L682 VanDerWaalsContact O-CB 3.3Å; W678-L682 WeakPolarHBondContact O-CB 3.24Å; W678-L682 VanDerWaalsContact O-CG 3.31Å; W678-L682 WeakPolarHBondContact O-CG 3.22Å; W678-L682 PolarHBondContact O-N 3.34Å
683	A	95.8	Very high	94.6	Very high	69 Å²	69	44 Å²	44	57%	0.57	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.1	176.7	0	0	0	0	0	113.6	D679 V680 V681	D679-A683 WeakPolarHBondContact O-CB 3.33Å; V680-A683 CarbonylContact O-C 3.05Å; V680-A683 PolarHBondContact O-N 3.28Å; V681-A683 PolarHBondContact O-N 2.97Å
684	F	95.7	Very high	94.2	Very high	12 Å²	12	45 Å²	45	5%	0.053	23%	0.228	C	C	.	.	S	Bend	trans	-71.9	144.3	177.1	-81.6	-10.6	0	0	0	111.7	V680 V681 L688 Q689 K746 L749 I753	V680-F684 HydrophobicContact CG1-CD1 4.03Å; V680-F684 HydrophobicContact CG1-CE1 3.31Å; V680-F684 HydrophobicContact CG1-CE2 4.14Å; V680-F684 HydrophobicContact CG1-CZ 3.38Å; V680-F684 VanDerWaalsContact O-CD1 3.3Å; V680-F684 WeakPolarHBondContact O-CD1 3.35Å; V680-F684 PolarHBondContact O-N 3.43Å; V680-F684 VanDerWaalsContact O-N 3.11Å; V681-F684 WeakPolarHBondContact O-CB 3.39Å; V681-F684 PolarHBondContact O-N 2.88Å; V681-F684 VanDerWaalsContact O-N 3.12Å; F684-L688 HydrophobicContact CB-CB 3.94Å; F684-L688 HydrophobicContact CD1-CB 4.45Å; F684-L688 HydrophobicContact CD1-CD1 4.07Å; F684-L688 HydrophobicContact CD2-CB 3.85Å; F684-L688 HydrophobicContact CE1-CD1 4.2Å; F684-L688 HydrophobicContact CE2-CB 4.42Å; F684-L688 HydrophobicContact CG-CB 3.86Å; F684-L688 HydrophobicContact CG-CD1 4.32Å; F684-Q689 HydrophobicContact CB-CG 3.84Å; F684-Q689 PolarHBondContact O-NE2 3.46Å; F684-Q689 VanDerWaalsContact O-NE2 3.08Å; F684-K746 HydrophobicContact CE1-CG 4.38Å; F684-L749 HydrophobicContact CE2-CD2 4.02Å; F684-L749 HydrophobicContact CE2-CG 4.45Å; F684-L749 HydrophobicContact CZ-CD2 4.18Å; F684-I753 HydrophobicContact CD2-CD1 4.44Å; F684-I753 HydrophobicContact CE2-CD1 3.75Å; F684-I753 HydrophobicContact CZ-CD1 4.33Å
685	P	95.1	Very high	93.9	Very high	80 Å²	80	45.8 Å²	45.8	52%	0.519	23%	0.231	S	C	.	.			trans	-63.9	158.1	165.4	30.5	-35.5	0	0	0	110.3	E687 L688 Q689	P685-E687 PolarHBondContact O-N 2.59Å; P685-E687 VanDerWaalsContact O-N 3.1Å; P685-L688 HydrophobicContact CG-CB 4.17Å; P685-L688 HydrophobicContact CG-CD1 4.07Å; P685-L688 HydrophobicContact CG-CG 3.99Å; P685-L688 PolarHBondContact O-N 3.18Å; P685-Q689 PolarHBondContact O-N 2.96Å
686	L	91.8	Very high	93.6	Very high	87 Å²	87	39.3 Å²	39.3	46%	0.455	21%	0.207	S	C	.	.	H	α-helix	trans	-51.2	-38.9	-177.4	-176.4	64.1	0	0	0	113	L653 L688 Q689 K690	L653-L686 HydrophobicContact CB-CD1 4.39Å; L653-L686 HydrophobicContact CD1-CD1 3.86Å; L653-L686 HydrophobicContact CG-CD1 4.31Å; L686-L688 PolarHBondContact O-N 3.49Å; L686-Q689 WeakPolarHBondContact O-CB 3.45Å; L686-Q689 PolarHBondContact O-N 2.89Å; L686-K690 WeakPolarHBondContact O-CG 3.29Å; L686-K690 PolarHBondContact O-N 3.43Å
687	E	91.1	Very high	93	Very high	117 Å²	117	37.6 Å²	37.6	55%	0.547	20%	0.2	S	C	.	.	H	α-helix	trans	-62	-42	178.1	-63.2	-53.9	132.2	0	0	113.1	P685 K690 K691	P685-E687 PolarHBondContact O-N 2.59Å; P685-E687 VanDerWaalsContact O-N 3.1Å; E687-K690 PolarHBondContact O-N 3.13Å; E687-K691 WeakPolarHBondContact O-CG 3.46Å; E687-K691 PolarHBondContact O-N 3.19Å
688	L	93.3	Very high	92.2	Very high	36 Å²	36	37.7 Å²	37.7	19%	0.188	20%	0.202	C	C	.	.	H	α-helix	trans	-75.2	-30.3	176.6	-70.3	-175.4	0	0	0	111.8	F684 P685 L686 K691 L692 T750 I753	F684-L688 HydrophobicContact CB-CB 3.94Å; F684-L688 HydrophobicContact CD1-CB 4.45Å; F684-L688 HydrophobicContact CD1-CD1 4.07Å; F684-L688 HydrophobicContact CD2-CB 3.85Å; F684-L688 HydrophobicContact CE1-CD1 4.2Å; F684-L688 HydrophobicContact CE2-CB 4.42Å; F684-L688 HydrophobicContact CG-CB 3.86Å; F684-L688 HydrophobicContact CG-CD1 4.32Å; P685-L688 HydrophobicContact CG-CB 4.17Å; P685-L688 HydrophobicContact CG-CD1 4.07Å; P685-L688 HydrophobicContact CG-CG 3.99Å; P685-L688 PolarHBondContact O-N 3.18Å; L686-L688 PolarHBondContact O-N 3.49Å; L688-K691 HydrophobicContact CD2-CD 4.27Å; L688-K691 PolarHBondContact O-N 2.89Å; L688-L692 WeakPolarHBondContact O-CB 3.24Å; L688-L692 PolarHBondContact O-N 2.83Å; L688-T750 HydrophobicContact CD1-CG2 4.49Å; L688-I753 HydrophobicContact CB-CD1 4.35Å; L688-I753 HydrophobicContact CD2-CD1 4.2Å
689	Q	93.8	Very high	91.4	Very high	26 Å²	26	38.3 Å²	38.3	12%	0.121	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-43.3	171.5	-75	-176.6	-0.4	0	0	111.8	L653 M655 V681 F684 P685 L686 L692 L693	L653-Q689 HydrophobicContact CD1-CB 4.23Å; M655-Q689 HydrophobicContact CE-CB 3.48Å; M655-Q689 VanDerWaalsContact CE-CB 3.48Å; M655-Q689 HydrophobicContact CE-CG 3.89Å; M655-Q689 WeakPolarHBondContact CE-O 3.29Å; M655-Q689 HydrophobicContact CG-CG 4.07Å; V681-Q689 PolarHBondContact O-NE2 2.82Å; F684-Q689 HydrophobicContact CB-CG 3.84Å; F684-Q689 PolarHBondContact O-NE2 3.46Å; F684-Q689 VanDerWaalsContact O-NE2 3.08Å; P685-Q689 PolarHBondContact O-N 2.96Å; L686-Q689 WeakPolarHBondContact O-CB 3.45Å; L686-Q689 PolarHBondContact O-N 2.89Å; Q689-L692 WeakPolarHBondContact O-CB 3.31Å; Q689-L692 PolarHBondContact O-N 3.35Å; Q689-L693 PolarHBondContact O-N 3.01Å
690	K	90.3	Very high	90.7	Very high	51 Å²	51	36.4 Å²	36.4	22%	0.222	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-46.3	172.8	-77.9	-176.6	174.8	-169.1	0	112.4	L653 L686 E687 L692 L693 H694 D700	L653-K690 HydrophobicContact CD1-CG 3.75Å; L686-K690 WeakPolarHBondContact O-CG 3.29Å; L686-K690 PolarHBondContact O-N 3.43Å; E687-K690 PolarHBondContact O-N 3.13Å; K690-L692 VanDerWaalsContact C-N 3.33Å; K690-L692 PolarHBondContact O-N 3.38Å; K690-L693 PolarHBondContact O-N 3.34Å; K690-L693 VanDerWaalsContact O-N 3.16Å; K690-H694 PolarHBondContact O-N 3.16Å; K690-D700 HydrophobicContact CB-CB 4.04Å; K690-D700 HydrophobicContact CG-CB 4.31Å
691	K	91.4	Very high	90.1	Very high	94 Å²	94	37.9 Å²	37.9	41%	0.409	20%	0.201	S	C	.	.	H	α-helix	trans	-61.3	-39.5	175.6	-73.4	-173.7	-177.7	-169.7	0	112.9	E687 L688 L693 H694 F695 I753	E687-K691 WeakPolarHBondContact O-CG 3.46Å; E687-K691 PolarHBondContact O-N 3.19Å; L688-K691 HydrophobicContact CD2-CD 4.27Å; L688-K691 PolarHBondContact O-N 2.89Å; K691-L693 VanDerWaalsContact C-N 3.34Å; K691-H694 PolarHBondContact O-N 3.15Å; K691-F695 VanDerWaalsContact O-CB 3.25Å; K691-F695 WeakPolarHBondContact O-CB 3.41Å; K691-F695 PolarHBondContact O-N 2.98Å; K691-I753 HydrophobicContact CB-CB 4.22Å; K691-I753 HydrophobicContact CB-CD1 4.42Å; K691-I753 HydrophobicContact CB-CG1 4.28Å
692	L	93.1	Very high	89.5	Confident	2 Å²	2	38 Å²	38	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-45.7	173.7	175.6	73.7	0	0	0	111.1	F677 V681 L688 Q689 K690 F695 A696 I734 L749 I753	F677-L692 HydrophobicContact CE2-CD1 4.27Å; F677-L692 HydrophobicContact CZ-CD1 4.28Å; F677-L692 HydrophobicContact CZ-CD2 4.27Å; V681-L692 HydrophobicContact CB-CD2 4.13Å; V681-L692 HydrophobicContact CG1-CD2 3.45Å; V681-L692 VanDerWaalsContact CG1-CD2 3.45Å; V681-L692 HydrophobicContact CG2-CD2 3.5Å; L688-L692 WeakPolarHBondContact O-CB 3.24Å; L688-L692 PolarHBondContact O-N 2.83Å; Q689-L692 WeakPolarHBondContact O-CB 3.31Å; Q689-L692 PolarHBondContact O-N 3.35Å; K690-L692 VanDerWaalsContact C-N 3.33Å; K690-L692 PolarHBondContact O-N 3.38Å; L692-F695 WeakPolarHBondContact O-CB 3.35Å; L692-F695 PolarHBondContact O-N 3.41Å; L692-A696 WeakPolarHBondContact O-CB 3.42Å; L692-A696 PolarHBondContact O-N 2.88Å; L692-I734 HydrophobicContact CD1-CD1 3.61Å; L692-I734 HydrophobicContact CG-CD1 4.45Å; L692-L749 HydrophobicContact CD1-CD1 3.94Å; L692-L749 HydrophobicContact CD1-CD2 4.36Å; L692-L749 HydrophobicContact CD1-CG 4.47Å; L692-I753 HydrophobicContact CB-CD1 4.45Å; L692-I753 HydrophobicContact CB-CG2 4.37Å; L692-I753 HydrophobicContact CD1-CG2 3.97Å
693	L	90.4	Very high	88.9	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-44.3	179.6	-167.6	66.6	0	0	0	110.9	L653 Q689 K690 K691 F695 A696 T697 S699 V702 M707 L710	L653-L693 HydrophobicContact CD2-CD2 3.82Å; Q689-L693 PolarHBondContact O-N 3.01Å; K690-L693 PolarHBondContact O-N 3.34Å; K690-L693 VanDerWaalsContact O-N 3.16Å; K691-L693 VanDerWaalsContact C-N 3.34Å; L693-F695 PolarHBondContact O-N 3.45Å; L693-A696 PolarHBondContact O-N 2.89Å; L693-A696 VanDerWaalsContact O-N 3.17Å; L693-T697 HydrophobicContact CD1-CG2 3.65Å; L693-T697 HydrophobicContact CG-CG2 4.2Å; L693-T697 WeakPolarHBondContact O-CB 3.4Å; L693-T697 WeakPolarHBondContact O-CG2 3.33Å; L693-T697 PolarHBondContact O-N 3Å; L693-T697 PolarHBondContact O-OG1 3.2Å; L693-S699 CarbonylContact C-O 3.59Å; L693-S699 WeakPolarHBondContact CG-O 3.24Å; L693-V702 HydrophobicContact CD2-CG1 3.44Å; L693-V702 VanDerWaalsContact CD2-CG1 3.44Å; L693-M707 HydrophobicContact CD1-CE 3.92Å; L693-M707 HydrophobicContact CD2-CE 4.25Å; L693-L710 HydrophobicContact CD1-CD2 3.67Å
694	H	88.1	Confident	88.1	Confident	31 Å²	31	33.8 Å²	33.8	14%	0.144	17%	0.172	C	C	.	.	H	α-helix	trans	-59.8	-46.1	175.1	-172.2	84.8	0	0	0	111.3	D506 K690 K691 A696 G698 S699 E757	D506-H694 IonicContact OD2-CE1 3.4Å; K690-H694 PolarHBondContact O-N 3.16Å; K691-H694 PolarHBondContact O-N 3.15Å; H694-A696 VanDerWaalsContact C-N 3.28Å; H694-A696 PolarHBondContact O-N 3.04Å; H694-G698 VanDerWaalsContact O-CA 3.25Å; H694-G698 WeakPolarHBondContact O-CA 3.4Å; H694-G698 PolarHBondContact O-N 3.28Å; H694-S699 VanDerWaalsContact CA-O 3.23Å; H694-S699 WeakPolarHBondContact CA-O 3.46Å; H694-S699 PolarHBondContact N-O 3.23Å; H694-S699 VanDerWaalsContact N-O 3.07Å; H694-E757 IonicContact NE2-OE1 3.69Å
695	F	90.1	Very high	87	Confident	19 Å²	19	35.2 Å²	35.2	8%	0.083	19%	0.191	C	C	.	.	H	α-helix	trans	-57.2	-40.6	175.5	176.4	-107.8	0	0	0	112.2	K691 L692 L693 P725 S727 T729 I734 A752 I753 A756	K691-F695 VanDerWaalsContact O-CB 3.25Å; K691-F695 WeakPolarHBondContact O-CB 3.41Å; K691-F695 PolarHBondContact O-N 2.98Å; L692-F695 WeakPolarHBondContact O-CB 3.35Å; L692-F695 PolarHBondContact O-N 3.41Å; L693-F695 PolarHBondContact O-N 3.45Å; F695-P725 HydrophobicContact CE1-CB 4.32Å; F695-P725 HydrophobicContact CZ-CB 4.43Å; F695-S727 WeakPolarHBondContact O-CB 3.38Å; F695-S727 PolarHBondContact O-OG 3.47Å; F695-T729 WeakPolarHBondContact O-CG2 3.22Å; F695-I734 HydrophobicContact CD1-CD1 4.2Å; F695-I734 HydrophobicContact CD1-CG1 4.39Å; F695-I734 HydrophobicContact CE1-CD1 4.49Å; F695-I734 HydrophobicContact CE1-CG1 4.43Å; F695-I734 HydrophobicContact CE1-CG2 4.36Å; F695-A752 HydrophobicContact CE2-CB 4.29Å; F695-A752 HydrophobicContact CZ-CB 4.12Å; F695-I753 HydrophobicContact CB-CB 4.31Å; F695-I753 HydrophobicContact CB-CG2 3.89Å; F695-I753 HydrophobicContact CD1-CG2 3.91Å; F695-I753 HydrophobicContact CG-CG2 3.93Å; F695-A756 HydrophobicContact CB-CB 4.45Å; F695-A756 HydrophobicContact CD2-CB 3.75Å
696	A	89.6	Confident	86.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-86.2	-31.1	-175.1	0	0	0	0	0	114.8	L692 L693 H694 F712 T729 N732 I734	L692-A696 WeakPolarHBondContact O-CB 3.42Å; L692-A696 PolarHBondContact O-N 2.88Å; L693-A696 PolarHBondContact O-N 2.89Å; L693-A696 VanDerWaalsContact O-N 3.17Å; H694-A696 VanDerWaalsContact C-N 3.28Å; H694-A696 PolarHBondContact O-N 3.04Å; A696-F712 HydrophobicContact CB-CD2 4.31Å; A696-F712 HydrophobicContact CB-CE2 3.53Å; A696-F712 HydrophobicContact CB-CZ 4.44Å; A696-T729 WeakPolarHBondContact O-CA 3.19Å; A696-N732 CarbonylContact O-C 3.38Å; A696-N732 WeakPolarHBondContact O-CA 3.42Å; A696-I734 HydrophobicContact CB-CD1 3.76Å; A696-I734 HydrophobicContact CB-CG1 3.56Å
697	T	84.4	Confident	86	Confident	9 Å²	9	28.7 Å²	28.7	6%	0.055	16%	0.159	C	C	.	.	H	α-helix	trans	-121.4	-16	-167.8	77.4	0	0	0	0	113.6	K448 L693 S699 L710 N732	K448-T697 PolarHBondContact NZ-O 2.87Å; L693-T697 HydrophobicContact CD1-CG2 3.65Å; L693-T697 HydrophobicContact CG-CG2 4.2Å; L693-T697 WeakPolarHBondContact O-CB 3.4Å; L693-T697 WeakPolarHBondContact O-CG2 3.33Å; L693-T697 PolarHBondContact O-N 3Å; L693-T697 PolarHBondContact O-OG1 3.2Å; T697-S699 VanDerWaalsContact C-N 3.33Å; T697-S699 PolarHBondContact OG1-N 3.43Å; T697-S699 VanDerWaalsContact OG1-N 3.14Å; T697-S699 PolarHBondContact OG1-O 2.98Å; T697-L710 HydrophobicContact CG2-CD1 4.18Å; T697-L710 HydrophobicContact CG2-CD2 3.84Å; T697-N732 HydrophobicContact CG2-CB 4.31Å
698	G	79.5	Confident	85.7	Confident	3 Å²	3	25.8 Å²	25.8	3%	0.031	16%	0.155	C	C	.	.	S	Bend	trans	80.4	9.2	-170.5	0	0	0	0	0	114.2	H694	H694-G698 VanDerWaalsContact O-CA 3.25Å; H694-G698 WeakPolarHBondContact O-CA 3.4Å; H694-G698 PolarHBondContact O-N 3.28Å
699	S	81.4	Confident	85.1	Confident	15 Å²	15	28.8 Å²	28.8	11%	0.105	17%	0.171	C	C	.	.			trans	-145.2	148.2	176.4	-179.7	0	0	0	0	110.7	L693 H694 T697 R701	L693-S699 CarbonylContact C-O 3.59Å; L693-S699 WeakPolarHBondContact CG-O 3.24Å; H694-S699 VanDerWaalsContact CA-O 3.23Å; H694-S699 WeakPolarHBondContact CA-O 3.46Å; H694-S699 PolarHBondContact N-O 3.23Å; H694-S699 VanDerWaalsContact N-O 3.07Å; T697-S699 VanDerWaalsContact C-N 3.33Å; T697-S699 PolarHBondContact OG1-N 3.43Å; T697-S699 VanDerWaalsContact OG1-N 3.14Å; T697-S699 PolarHBondContact OG1-O 2.98Å; S699-R701 VanDerWaalsContact C-N 3.28Å; S699-R701 PolarHBondContact OG-N 3.29Å; S699-R701 VanDerWaalsContact OG-N 3.14Å
700	D	81.1	Confident	84.7	Confident	38 Å²	38	28.1 Å²	28.1	20%	0.203	17%	0.168	C	C	.	.	S	Bend	trans	-87.9	4.5	171.7	74.3	-27.8	0	0	0	113.3	K690	K690-D700 HydrophobicContact CB-CB 4.04Å; K690-D700 HydrophobicContact CG-CB 4.31Å
701	R	84.2	Confident	84.5	Confident	34 Å²	34	29.3 Å²	29.3	13%	0.128	18%	0.177	C	C	.	.	S	Bend	trans	-114.4	160.2	178.3	-63	-176.5	-177.2	-150.1	7.6	111.8	H508 E644 C648 S650 S699	H508-R701 PolarHBondContact NE2-NH2 2.83Å; H508-R701 VanDerWaalsContact NE2-NH2 3.11Å; E644-R701 IonicContact OE1-CZ 3.16Å; E644-R701 IonicContact OE1-NH1 3.45Å; E644-R701 PolarHBondContact OE1-NH1 3.46Å; E644-R701 IonicContact OE1-NH2 3.77Å; E644-R701 PolarHBondContact OE1-NH2 3.45Å; E644-R701 VanDerWaalsContact OE1-NH2 3.1Å; C648-R701 VanDerWaalsContact O-CB 3.27Å; C648-R701 WeakPolarHBondContact O-CB 3.49Å; C648-R701 VanDerWaalsContact O-CD 3.23Å; C648-R701 WeakPolarHBondContact O-CD 3.43Å; S650-R701 WeakPolarHBondContact O-CA 3.46Å; S650-R701 WeakPolarHBondContact O-CB 3.26Å; S699-R701 VanDerWaalsContact C-N 3.28Å; S699-R701 PolarHBondContact OG-N 3.29Å; S699-R701 VanDerWaalsContact OG-N 3.14Å
702	V	84.3	Confident	84.6	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.012	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-113.8	160.9	-174.1	-56.7	0	0	0	0	111.5	G649 S650 E652 L653 L693 M707	G649-V702 CarbonylContact C-O 3.5Å; G649-V702 WeakPolarHBondContact CA-O 3.34Å; S650-V702 PolarHBondContact N-O 2.83Å; S650-V702 WeakPolarHBondContact O-CG2 3.34Å; S650-V702 PolarHBondContact O-N 3.26Å; E652-V702 WeakPolarHBondContact O-CG2 3.36Å; L653-V702 HydrophobicContact CD2-CG1 3.47Å; L653-V702 VanDerWaalsContact CD2-CG1 3.47Å; L693-V702 HydrophobicContact CD2-CG1 3.44Å; L693-V702 VanDerWaalsContact CD2-CG1 3.44Å; V702-M707 HydrophobicContact CB-CG 4.08Å; V702-M707 HydrophobicContact CG1-CE 3.64Å; V702-M707 HydrophobicContact CG1-CG 3.55Å; V702-M707 HydrophobicContact CG1-SD 4.14Å; V702-M707 HydrophobicContact CG2-CG 4.22Å
703	P	81.8	Confident	84.6	Confident	37 Å²	37	26.6 Å²	26.6	24%	0.24	17%	0.165	C	C	.	.			trans	-57.1	144.8	174.6	-24.1	34.8	0	0	0	112.4	G705 G706 D709 L710	P703-G705 PolarHBondContact O-N 2.85Å; P703-G706 PolarHBondContact O-N 2.68Å; P703-D709 HydrophobicContact CB-CB 4.4Å; P703-L710 HydrophobicContact CG-CB 4.38Å; P703-L710 HydrophobicContact CG-CD1 4.2Å
704	V	79.4	Confident	84.9	Confident	13 Å²	13	26.5 Å²	26.5	8%	0.079	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	119.1	171.4	178.7	0	0	0	0	108.7	T363 K367 M645 L646	T363-V704 HydrophobicContact CG2-CG1 3.77Å; K367-V704 HydrophobicContact CB-CG1 4.2Å; K367-V704 HydrophobicContact CD-CB 3.88Å; K367-V704 HydrophobicContact CD-CG1 3.98Å; K367-V704 WeakPolarHBondContact CD-O 3.37Å; K367-V704 WeakPolarHBondContact CE-O 3.44Å; K367-V704 HydrophobicContact CG-CB 4.47Å; K367-V704 HydrophobicContact CG-CG1 4.38Å; K367-V704 PolarHBondContact NZ-O 3.16Å; M645-V704 HydrophobicContact CB-CG2 4.02Å; M645-V704 WeakPolarHBondContact O-CG2 3.29Å; L646-V704 HydrophobicContact CD2-CG2 4.31Å
705	G	73.8	Confident	85.3	Confident	43 Å²	43	25.3 Å²	25.3	44%	0.443	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	121.2	-16	-167.2	0	0	0	0	0	113.2	P703	P703-G705 PolarHBondContact O-N 2.85Å
706	G	81.8	Confident	85.5	Confident	27 Å²	27	28.2 Å²	28.2	28%	0.278	17%	0.172	S	C	.	.			trans	105	178.7	172	0	0	0	0	0	113.5	P703 A708 D709	P703-G706 PolarHBondContact O-N 2.68Å; G706-A708 PolarHBondContact O-N 2.64Å; G706-D709 PolarHBondContact O-N 3.03Å
707	M	84	Confident	85.6	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.015	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-69.4	-18.6	-173.7	-69.6	-166.7	99.4	0	0	114.4	L653 D654 M655 A657 L658 L693 V702 D709 L710	L653-M707 HydrophobicContact CB-SD 4.16Å; L653-M707 HydrophobicContact CD2-CE 4.11Å; L653-M707 HydrophobicContact CD2-SD 4.27Å; D654-M707 PolarHBondContact N-SD 2.94Å; M655-M707 HydrophobicContact CE-CE 3.93Å; M655-M707 HydrophobicContact SD-CE 3.83Å; M655-M707 HydrophobicContact SD-SD 4.18Å; A657-M707 HydrophobicContact CB-CB 4.46Å; L658-M707 HydrophobicContact CB-CB 3.99Å; L658-M707 HydrophobicContact CB-CE 4.22Å; L658-M707 HydrophobicContact CB-SD 4.14Å; L658-M707 HydrophobicContact CD1-CB 4.27Å; L658-M707 HydrophobicContact CD1-CE 4.27Å; L658-M707 HydrophobicContact CD2-CE 3.8Å; L658-M707 HydrophobicContact CG-CE 4.31Å; L693-M707 HydrophobicContact CD1-CE 3.92Å; L693-M707 HydrophobicContact CD2-CE 4.25Å; V702-M707 HydrophobicContact CB-CG 4.08Å; V702-M707 HydrophobicContact CG1-CE 3.64Å; V702-M707 HydrophobicContact CG1-CG 3.55Å; V702-M707 HydrophobicContact CG1-SD 4.14Å; V702-M707 HydrophobicContact CG2-CG 4.22Å; M707-D709 PolarHBondContact O-N 2.93Å; M707-L710 WeakPolarHBondContact O-CB 3.33Å; M707-L710 PolarHBondContact O-N 3.12Å
708	A	83.5	Confident	85.7	Confident	56 Å²	56	36 Å²	36	46%	0.463	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-67.2	-27.4	177.3	0	0	0	0	0	112.8	A661 G706 L710	A661-A708 HydrophobicContact CB-CB 4.24Å; A661-A708 WeakPolarHBondContact CB-O 3.45Å; G706-A708 PolarHBondContact O-N 2.64Å; A708-L710 VanDerWaalsContact C-N 3.25Å; A708-L710 PolarHBondContact O-N 3.21Å
709	D	81.9	Confident	86.1	Confident	98 Å²	98	37.8 Å²	37.8	52%	0.524	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-78.8	-10.9	176.9	-73.9	-5.8	0	0	0	112.4	P703 G706 M707 N711	P703-D709 HydrophobicContact CB-CB 4.4Å; G706-D709 PolarHBondContact O-N 3.03Å; M707-D709 PolarHBondContact O-N 2.93Å; D709-N711 PolarHBondContact O-N 3.39Å
710	L	84.4	Confident	86.4	Confident	12 Å²	12	40.9 Å²	40.9	6%	0.063	24%	0.243	C	C	.	.	S	Bend	trans	-77	114.8	174.7	-173.9	67.5	0	0	0	109	L658 L693 T697 P703 M707 A708 F712 N732	L658-L710 HydrophobicContact CD1-CB 4.25Å; L658-L710 HydrophobicContact CD1-CD2 3.83Å; L658-L710 HydrophobicContact CD1-CG 4.44Å; L693-L710 HydrophobicContact CD1-CD2 3.67Å; T697-L710 HydrophobicContact CG2-CD1 4.18Å; T697-L710 HydrophobicContact CG2-CD2 3.84Å; P703-L710 HydrophobicContact CG-CB 4.38Å; P703-L710 HydrophobicContact CG-CD1 4.2Å; M707-L710 WeakPolarHBondContact O-CB 3.33Å; M707-L710 PolarHBondContact O-N 3.12Å; A708-L710 VanDerWaalsContact C-N 3.25Å; A708-L710 PolarHBondContact O-N 3.21Å; L710-F712 HydrophobicContact CD2-CB 4.28Å; L710-F712 HydrophobicContact CD2-CD2 4.32Å; L710-F712 HydrophobicContact CG-CB 4.25Å; L710-F712 PolarHBondContact O-N 2.91Å; L710-N732 HydrophobicContact CD1-CB 4.38Å; L710-N732 WeakPolarHBondContact CD1-ND2 3.18Å
711	N	86.1	Confident	86.5	Confident	76 Å²	76	40 Å²	40	41%	0.406	24%	0.241	S	C	.	.			trans	-70.4	67.6	173.2	-172.6	20.6	0	0	0	111.3	Q663 D709 N732	Q663-N711 VanDerWaalsContact CD-OD1 3.23Å; Q663-N711 PolarHBondContact NE2-OD1 3.32Å; Q663-N711 PolarHBondContact OE1-OD1 3.36Å; D709-N711 PolarHBondContact O-N 3.39Å; N711-N732 WeakPolarHBondContact O-CB 3.46Å
712	F	92.8	Very high	86.7	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	27%	0.265	C	S	.	.			trans	-84.7	128.3	-175.2	-175.7	-96.7	0	0	0	111	L658 A662 Q663 F677 W678 A696 L710 I714 N732 I734	L658-F712 HydrophobicContact CD1-CB 3.64Å; L658-F712 HydrophobicContact CD1-CD1 4.44Å; L658-F712 HydrophobicContact CD1-CD2 4.43Å; L658-F712 HydrophobicContact CD1-CG 3.95Å; L658-F712 HydrophobicContact CD2-CD1 4.36Å; L658-F712 HydrophobicContact CD2-CD2 4.42Å; L658-F712 HydrophobicContact CD2-CE1 4.5Å; L658-F712 HydrophobicContact CD2-CG 4.32Å; L658-F712 HydrophobicContact CG-CB 4.42Å; L658-F712 HydrophobicContact CG-CD1 4.35Å; L658-F712 HydrophobicContact CG-CG 4.31Å; A662-F712 WeakPolarHBondContact CA-O 3.47Å; A662-F712 HydrophobicContact CB-CD1 4.03Å; Q663-F712 PolarHBondContact N-O 3.02Å; F677-F712 HydrophobicContact CE1-CE1 4.34Å; F677-F712 HydrophobicContact CZ-CE1 4.38Å; F677-F712 HydrophobicContact CZ-CZ 4.19Å; W678-F712 HydrophobicContact CH2-CD1 4.29Å; W678-F712 HydrophobicContact CH2-CE1 4.03Å; W678-F712 HydrophobicContact CZ2-CE1 4.27Å; A696-F712 HydrophobicContact CB-CD2 4.31Å; A696-F712 HydrophobicContact CB-CE2 3.53Å; A696-F712 HydrophobicContact CB-CZ 4.44Å; L710-F712 HydrophobicContact CD2-CB 4.28Å; L710-F712 HydrophobicContact CD2-CD2 4.32Å; L710-F712 HydrophobicContact CG-CB 4.25Å; L710-F712 PolarHBondContact O-N 2.91Å; F712-I714 HydrophobicContact CD1-CG1 4.34Å; F712-I714 HydrophobicContact CE1-CD1 3.99Å; F712-I714 HydrophobicContact CE1-CG1 3.71Å; F712-N732 WeakPolarHBondContact CA-O 3.41Å; F712-I734 HydrophobicContact CE2-CD1 4.11Å; F712-I734 HydrophobicContact CE2-CG1 4.25Å; F712-I734 HydrophobicContact CZ-CD1 3.71Å; F712-I734 HydrophobicContact CZ-CG1 4.07Å
713	K	94.6	Very high	87	Confident	39 Å²	39	51.1 Å²	51.1	17%	0.17	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.5	-173.9	-64.5	-177.3	168.1	-156.6	0	111.9	Q663 E665 N732 Q733 I734	Q663-K713 HydrophobicContact CB-CG 4.22Å; Q663-K713 WeakPolarHBondContact O-CA 3.49Å; E665-K713 IonicContact OE1-NZ 3.91Å; E665-K713 PolarHBondContact OE1-NZ 3.29Å; K713-N732 PolarHBondContact N-O 3.5Å; K713-Q733 HydrophobicContact CB-CB 4.09Å; K713-Q733 HydrophobicContact CB-CG 4.09Å; K713-Q733 CarbonylContact O-C 3.34Å; K713-Q733 WeakPolarHBondContact O-CA 3.44Å; K713-I734 PolarHBondContact O-N 3.17Å
714	I	96.6	Very high	87.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	115.5	169.8	-63	170.2	0	0	0	108.2	Q663 Y664 E665 Y667 F677 W678 F712 I734 L736	Q663-I714 PolarHBondContact O-N 2.92Å; Y664-I714 VanDerWaalsContact CA-O 3.32Å; Y664-I714 WeakPolarHBondContact CA-O 3.45Å; Y664-I714 HydrophobicContact CD1-CB 3.94Å; Y664-I714 HydrophobicContact CD1-CD1 4.38Å; Y664-I714 HydrophobicContact CD1-CG2 4.41Å; Y664-I714 HydrophobicContact CE1-CB 4.22Å; Y664-I714 HydrophobicContact CE1-CD1 3.79Å; Y664-I714 HydrophobicContact CE1-CG1 4.49Å; E665-I714 PolarHBondContact N-O 3.01Å; Y667-I714 HydrophobicContact CD2-CG2 4.32Å; F677-I714 HydrophobicContact CD1-CD1 3.64Å; F677-I714 HydrophobicContact CE1-CD1 3.6Å; F677-I714 HydrophobicContact CE1-CG1 4.48Å; F677-I714 HydrophobicContact CG-CD1 4.4Å; F677-I714 HydrophobicContact CZ-CD1 4.31Å; W678-I714 HydrophobicContact CZ2-CD1 3.66Å; F712-I714 HydrophobicContact CD1-CG1 4.34Å; F712-I714 HydrophobicContact CE1-CD1 3.99Å; F712-I714 HydrophobicContact CE1-CG1 3.71Å; I714-I734 CarbonylContact C-O 3.53Å; I714-I734 WeakPolarHBondContact CA-O 3.34Å; I714-L736 HydrophobicContact CG2-CD1 3.61Å; I714-L736 HydrophobicContact CG2-CG 4.12Å
715	C	95.4	Very high	88.2	Confident	6 Å²	6	52.4 Å²	52.4	4%	0.041	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142.3	-176.3	-56.9	0	0	0	0	110.9	E665 Q733 I734 C735 L736	E665-C715 HydrophobicContact CB-CB 4.29Å; E665-C715 CarbonylContact O-C 3.48Å; E665-C715 VanDerWaalsContact O-CA 3.29Å; E665-C715 WeakPolarHBondContact O-CA 3.32Å; E665-C715 PolarHBondContact OE2-SG 2.64Å; C715-Q733 HydrophobicContact CB-CG 4.26Å; C715-Q733 WeakPolarHBondContact SG-CG 3.06Å; C715-Q733 PolarHBondContact SG-NE2 3.45Å; C715-I734 PolarHBondContact N-O 3.01Å; C715-C735 CarbonylContact O-C 3.53Å; C715-C735 WeakPolarHBondContact O-CA 3.23Å; C715-L736 PolarHBondContact O-N 3.47Å
716	K	94.3	Very high	89.1	Confident	81 Å²	81	53.6 Å²	53.6	35%	0.352	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	133.1	171	-174.1	174.6	-177.4	-127.3	0	110.2	E665 G666 Y667 D718	E665-K716 PolarHBondContact O-N 3.32Å; G666-K716 VanDerWaalsContact O-CD 3.32Å; G666-K716 WeakPolarHBondContact O-CD 3.5Å; Y667-K716 HydrophobicContact CD1-CB 4.25Å; Y667-K716 HydrophobicContact CD1-CD 4.11Å; Y667-K716 HydrophobicContact CD1-CG 4.35Å; Y667-K716 HydrophobicContact CD2-CB 3.58Å; Y667-K716 HydrophobicContact CD2-CG 4.28Å; Y667-K716 HydrophobicContact CE1-CB 4.18Å; Y667-K716 HydrophobicContact CE1-CD 3.78Å; Y667-K716 HydrophobicContact CE1-CG 3.87Å; Y667-K716 HydrophobicContact CE2-CB 3.49Å; Y667-K716 VanDerWaalsContact CE2-CB 3.49Å; Y667-K716 HydrophobicContact CE2-CG 3.79Å; Y667-K716 HydrophobicContact CG-CB 3.96Å; K716-D718 VanDerWaalsContact CE-OD1 3.26Å; K716-D718 WeakPolarHBondContact CE-OD1 3.45Å; K716-D718 IonicContact NZ-OD1 2.72Å; K716-D718 PolarHBondContact NZ-OD1 3.18Å
717	I	92.3	Very high	89.5	Confident	39 Å²	39	53.6 Å²	53.6	20%	0.2	29%	0.29	C	S	.	.			trans	-114.8	127.5	165.3	49	170.1	0	0	0	109.6	V719 C735 L736 P737	I717-V719 HydrophobicContact CB-CG2 4.33Å; I717-V719 HydrophobicContact CD1-CG2 3.62Å; I717-V719 HydrophobicContact CG1-CG2 3.84Å; I717-V719 PolarHBondContact O-N 3.31Å; I717-C735 HydrophobicContact CD1-CB 4.08Å; I717-C735 HydrophobicContact CG1-CB 4.21Å; I717-C735 HydrophobicContact CG2-CB 3.61Å; I717-L736 PolarHBondContact N-O 2.82Å; I717-P737 HydrophobicContact CD1-CG 3.94Å; I717-P737 HydrophobicContact CG1-CG 4.18Å
718	D	87	Confident	89.7	Confident	134 Å²	134	57.9 Å²	57.9	72%	0.717	31%	0.31	S	S	*	.			trans	-82.1	65.8	179.5	-66.3	-46.1	0	0	0	110.4	K716	K716-D718 VanDerWaalsContact CE-OD1 3.26Å; K716-D718 WeakPolarHBondContact CE-OD1 3.45Å; K716-D718 IonicContact NZ-OD1 2.72Å; K716-D718 PolarHBondContact NZ-OD1 3.18Å
719	V	88.7	Confident	89.7	Confident	40 Å²	40	56.8 Å²	56.8	24%	0.242	30%	0.298	C	S	.	.	S	Bend	trans	-121	161.3	175.3	-60.4	0	0	0	0	110.3	I717 W723 P737	I717-V719 HydrophobicContact CB-CG2 4.33Å; I717-V719 HydrophobicContact CD1-CG2 3.62Å; I717-V719 HydrophobicContact CG1-CG2 3.84Å; I717-V719 PolarHBondContact O-N 3.31Å; V719-W723 HydrophobicContact CB-CD2 4.24Å; V719-W723 HydrophobicContact CB-CE3 4.46Å; V719-W723 HydrophobicContact CB-CG 4.3Å; V719-W723 HydrophobicContact CG1-CE3 4.44Å; V719-W723 HydrophobicContact CG2-CB 3.94Å; V719-W723 HydrophobicContact CG2-CD2 4.35Å; V719-W723 HydrophobicContact CG2-CE3 4.47Å; V719-W723 HydrophobicContact CG2-CG 4.13Å; V719-P737 HydrophobicContact CG2-CB 3.98Å; V719-P737 HydrophobicContact CG2-CG 3.78Å
720	P	87.1	Confident	89.5	Confident	80 Å²	80	53.5 Å²	53.5	52%	0.519	28%	0.282	S	S	.	.			trans	-55.3	143.8	174.6	-24.9	34.9	0	0	0	112.1	D722 W723	P720-D722 PolarHBondContact O-N 2.92Å; P720-W723 WeakPolarHBondContact O-CB 3.41Å; P720-W723 PolarHBondContact O-N 2.88Å; P720-W723 VanDerWaalsContact O-N 3.08Å
721	A	83.8	Confident	89.4	Confident	19 Å²	19	58.8 Å²	58.8	16%	0.157	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.7	-177.8	0	0	0	0	0	114.1	W723 Y739 E744	A721-W723 VanDerWaalsContact C-N 3.25Å; A721-W723 PolarHBondContact O-N 3.06Å; A721-Y739 HydrophobicContact CB-CD1 4.39Å; A721-Y739 WeakPolarHBondContact O-CD1 3.43Å; A721-Y739 WeakPolarHBondContact O-CE1 3.4Å; A721-E744 WeakPolarHBondContact CB-OE1 3.05Å
722	D	87.4	Confident	89.5	Confident	121 Å²	121	56.4 Å²	56.4	65%	0.647	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.4	174.5	-67.2	-41.5	0	0	0	113.7	P720 K748	P720-D722 PolarHBondContact O-N 2.92Å; D722-K748 WeakPolarHBondContact O-CE 3.23Å; D722-K748 PolarHBondContact O-NZ 2.68Å
723	W	90.5	Very high	89.5	Confident	148 Å²	148	57.7 Å²	57.7	56%	0.561	30%	0.298	S	S	*	.	S	Bend	trans	-70.9	153.9	179.1	-76.7	47.5	0	0	0	111.2	V719 P720 A721 P737 Y739	V719-W723 HydrophobicContact CB-CD2 4.24Å; V719-W723 HydrophobicContact CB-CE3 4.46Å; V719-W723 HydrophobicContact CB-CG 4.3Å; V719-W723 HydrophobicContact CG1-CE3 4.44Å; V719-W723 HydrophobicContact CG2-CB 3.94Å; V719-W723 HydrophobicContact CG2-CD2 4.35Å; V719-W723 HydrophobicContact CG2-CE3 4.47Å; V719-W723 HydrophobicContact CG2-CG 4.13Å; P720-W723 WeakPolarHBondContact O-CB 3.41Å; P720-W723 PolarHBondContact O-N 2.88Å; P720-W723 VanDerWaalsContact O-N 3.08Å; A721-W723 VanDerWaalsContact C-N 3.25Å; A721-W723 PolarHBondContact O-N 3.06Å; W723-P737 HydrophobicContact CB-CG 4.19Å; W723-Y739 PolarHBondContact O-OH 3.11Å
724	L	93.1	Very high	89.6	Confident	72 Å²	72	55.8 Å²	55.8	38%	0.377	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-78.2	155.1	171.4	-66.4	174.9	0	0	0	110.2	K748 I751 A752	L724-K748 HydrophobicContact CD2-CB 4.16Å; L724-K748 HydrophobicContact CD2-CD 3.75Å; L724-K748 WeakPolarHBondContact CD2-O 3.45Å; L724-I751 HydrophobicContact CD1-CG2 3.99Å; L724-I751 HydrophobicContact CD2-CB 4.03Å; L724-I751 HydrophobicContact CD2-CG2 3.8Å; L724-A752 HydrophobicContact CB-CB 4.43Å
725	P	93.6	Very high	89.5	Confident	6 Å²	6	56 Å²	56	4%	0.039	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-56.4	147.9	164.9	-23	36.9	0	0	0	110.9	F695 I734 C735 L736 Y739 L749 A752	F695-P725 HydrophobicContact CE1-CB 4.32Å; F695-P725 HydrophobicContact CZ-CB 4.43Å; P725-I734 HydrophobicContact CB-CG2 4.37Å; P725-C735 WeakPolarHBondContact CA-O 3.34Å; P725-L736 HydrophobicContact CB-CD2 3.94Å; P725-L736 HydrophobicContact CG-CD2 4.04Å; P725-Y739 WeakPolarHBondContact CD-OH 3.37Å; P725-Y739 HydrophobicContact CG-CE2 4.24Å; P725-Y739 WeakPolarHBondContact CG-OH 3.29Å; P725-L749 HydrophobicContact CG-CD1 4.14Å; P725-A752 HydrophobicContact CB-CB 4.45Å; P725-A752 HydrophobicContact CG-CB 4.37Å
726	V	91.8	Very high	89.5	Confident	67 Å²	67	55.7 Å²	55.7	41%	0.406	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152.8	174.5	-179.4	0	0	0	0	108.3	C735	V726-C735 HydrophobicContact CB-CB 4.37Å; V726-C735 PolarHBondContact N-O 2.92Å; V726-C735 VanDerWaalsContact N-O 3.13Å; V726-C735 WeakPolarHBondContact O-CB 3.44Å; V726-C735 PolarHBondContact O-N 3.47Å
727	S	90.9	Very high	89.6	Confident	28 Å²	28	51.9 Å²	51.9	20%	0.196	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152.1	175.6	62.3	0	0	0	0	112.5	F695 Q733	F695-S727 WeakPolarHBondContact O-CB 3.38Å; F695-S727 PolarHBondContact O-OG 3.47Å; S727-Q733 CarbonylContact C-O 3.52Å; S727-Q733 VanDerWaalsContact CA-O 3.23Å; S727-Q733 WeakPolarHBondContact CA-O 3.31Å; S727-Q733 WeakPolarHBondContact CB-O 3.38Å
728	H	87.9	Confident	89.6	Confident	92 Å²	92	52.4 Å²	52.4	43%	0.426	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	88.2	167.7	-58.4	-68.7	0	0	0	107.8	C730 F731 N732 Q733	H728-C730 PolarHBondContact O-N 2.94Å; H728-F731 HydrophobicContact CB-CD2 4.28Å; H728-F731 CarbonylContact O-C 3.49Å; H728-F731 PolarHBondContact O-N 3.44Å; H728-N732 PolarHBondContact O-N 3.44Å; H728-Q733 HydrophobicContact CB-CB 4.31Å; H728-Q733 PolarHBondContact N-O 2.69Å; H728-Q733 PolarHBondContact O-N 2.94Å
729	T	84.4	Confident	90	Very high	33 Å²	33	46.1 Å²	46.1	20%	0.202	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-58.7	-32.4	-173.8	55.8	0	0	0	0	113.1	K448 F695 A696 F731 N732	K448-T729 PolarHBondContact NZ-O 3.48Å; F695-T729 WeakPolarHBondContact O-CG2 3.22Å; A696-T729 WeakPolarHBondContact O-CA 3.19Å; T729-F731 PolarHBondContact O-N 2.99Å; T729-F731 VanDerWaalsContact O-N 3.14Å; T729-N732 PolarHBondContact O-N 3.44Å
730	C	76.9	Confident	90.1	Very high	30 Å²	30	54.3 Å²	54.3	20%	0.203	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-59.5	-24.8	175.9	-55.9	0	0	0	0	113.3	H728	H728-C730 PolarHBondContact O-N 2.94Å
731	F	82.4	Confident	90.4	Very high	123 Å²	123	53.8 Å²	53.8	54%	0.539	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-116.8	9.7	-178.4	-58.7	-72.6	0	0	0	113.5	H728 T729 Q733	H728-F731 HydrophobicContact CB-CD2 4.28Å; H728-F731 CarbonylContact O-C 3.49Å; H728-F731 PolarHBondContact O-N 3.44Å; T729-F731 PolarHBondContact O-N 2.99Å; T729-F731 VanDerWaalsContact O-N 3.14Å; F731-Q733 HydrophobicContact CB-CB 4.26Å; F731-Q733 PolarHBondContact O-N 2.62Å
732	N	89.1	Confident	91	Very high	25 Å²	25	58.6 Å²	58.6	13%	0.134	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	42	-176.4	-54.6	-36.2	0	0	0	112.6	K448 A696 T697 L710 N711 F712 K713 H728 T729	K448-N732 PolarHBondContact NZ-OD1 2.95Å; A696-N732 CarbonylContact O-C 3.38Å; A696-N732 WeakPolarHBondContact O-CA 3.42Å; T697-N732 HydrophobicContact CG2-CB 4.31Å; L710-N732 HydrophobicContact CD1-CB 4.38Å; L710-N732 WeakPolarHBondContact CD1-ND2 3.18Å; N711-N732 WeakPolarHBondContact O-CB 3.46Å; F712-N732 WeakPolarHBondContact CA-O 3.41Å; K713-N732 PolarHBondContact N-O 3.5Å; H728-N732 PolarHBondContact O-N 3.44Å; T729-N732 PolarHBondContact O-N 3.44Å
733	Q	92.4	Very high	91.4	Very high	28 Å²	28	61.6 Å²	61.6	13%	0.131	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.2	-167.5	177.8	178.6	-24.8	0	0	111.3	K713 C715 S727 H728 F731 C735	K713-Q733 HydrophobicContact CB-CB 4.09Å; K713-Q733 HydrophobicContact CB-CG 4.09Å; K713-Q733 CarbonylContact O-C 3.34Å; K713-Q733 WeakPolarHBondContact O-CA 3.44Å; C715-Q733 HydrophobicContact CB-CG 4.26Å; C715-Q733 WeakPolarHBondContact SG-CG 3.06Å; C715-Q733 PolarHBondContact SG-NE2 3.45Å; S727-Q733 CarbonylContact C-O 3.52Å; S727-Q733 VanDerWaalsContact CA-O 3.23Å; S727-Q733 WeakPolarHBondContact CA-O 3.31Å; S727-Q733 WeakPolarHBondContact CB-O 3.38Å; H728-Q733 HydrophobicContact CB-CB 4.31Å; H728-Q733 PolarHBondContact N-O 2.69Å; H728-Q733 PolarHBondContact O-N 2.94Å; F731-Q733 HydrophobicContact CB-CB 4.26Å; F731-Q733 PolarHBondContact O-N 2.62Å; Q733-C735 PolarHBondContact NE2-SG 3.3Å; Q733-C735 VanDerWaalsContact NE2-SG 3.42Å
734	I	95.3	Very high	91.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.9	166.7	-60.3	-175.5	0	0	0	109.3	F677 L692 F695 A696 F712 K713 I714 C715 P725 L736	F677-I734 HydrophobicContact CE2-CD1 4.28Å; F677-I734 HydrophobicContact CZ-CD1 4.2Å; L692-I734 HydrophobicContact CD1-CD1 3.61Å; L692-I734 HydrophobicContact CG-CD1 4.45Å; F695-I734 HydrophobicContact CD1-CD1 4.2Å; F695-I734 HydrophobicContact CD1-CG1 4.39Å; F695-I734 HydrophobicContact CE1-CD1 4.49Å; F695-I734 HydrophobicContact CE1-CG1 4.43Å; F695-I734 HydrophobicContact CE1-CG2 4.36Å; A696-I734 HydrophobicContact CB-CD1 3.76Å; A696-I734 HydrophobicContact CB-CG1 3.56Å; F712-I734 HydrophobicContact CE2-CD1 4.11Å; F712-I734 HydrophobicContact CE2-CG1 4.25Å; F712-I734 HydrophobicContact CZ-CD1 3.71Å; F712-I734 HydrophobicContact CZ-CG1 4.07Å; K713-I734 PolarHBondContact O-N 3.17Å; I714-I734 CarbonylContact C-O 3.53Å; I714-I734 WeakPolarHBondContact CA-O 3.34Å; C715-I734 PolarHBondContact N-O 3.01Å; P725-I734 HydrophobicContact CB-CG2 4.37Å; I734-L736 HydrophobicContact CG2-CD2 3.63Å; I734-L736 HydrophobicContact CG2-CG 4.05Å
735	C	95.2	Very high	91.7	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.027	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.6	174.6	-68.5	0	0	0	0	109.9	C715 I717 P725 V726 Q733	C715-C735 CarbonylContact O-C 3.53Å; C715-C735 WeakPolarHBondContact O-CA 3.23Å; I717-C735 HydrophobicContact CD1-CB 4.08Å; I717-C735 HydrophobicContact CG1-CB 4.21Å; I717-C735 HydrophobicContact CG2-CB 3.61Å; P725-C735 WeakPolarHBondContact CA-O 3.34Å; V726-C735 HydrophobicContact CB-CB 4.37Å; V726-C735 PolarHBondContact N-O 2.92Å; V726-C735 VanDerWaalsContact N-O 3.13Å; V726-C735 WeakPolarHBondContact O-CB 3.44Å; V726-C735 PolarHBondContact O-N 3.47Å; Q733-C735 PolarHBondContact NE2-SG 3.3Å; Q733-C735 VanDerWaalsContact NE2-SG 3.42Å
736	L	95.8	Very high	91.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.3	-177.4	-61.3	179.6	0	0	0	111.7	Y667 T673 F677 I714 C715 I717 P725 I734 Y739	Y667-L736 HydrophobicContact CE2-CB 4.02Å; Y667-L736 WeakPolarHBondContact CE2-O 3.42Å; Y667-L736 PolarHBondContact OH-O 2.87Å; T673-L736 HydrophobicContact CG2-CB 4.48Å; F677-L736 HydrophobicContact CB-CD1 4.11Å; F677-L736 HydrophobicContact CD2-CD1 3.73Å; F677-L736 HydrophobicContact CD2-CD2 4.32Å; F677-L736 HydrophobicContact CE2-CD1 4.41Å; F677-L736 HydrophobicContact CG-CD1 4.04Å; I714-L736 HydrophobicContact CG2-CD1 3.61Å; I714-L736 HydrophobicContact CG2-CG 4.12Å; C715-L736 PolarHBondContact O-N 3.47Å; I717-L736 PolarHBondContact N-O 2.82Å; P725-L736 HydrophobicContact CB-CD2 3.94Å; P725-L736 HydrophobicContact CG-CD2 4.04Å; I734-L736 HydrophobicContact CG2-CD2 3.63Å; I734-L736 HydrophobicContact CG2-CG 4.05Å; L736-Y739 HydrophobicContact CD2-CE2 4.48Å
737	P	95.1	Very high	92	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.281	C	S	.	.			trans	-58	157	161.9	-22.4	33.1	0	0	0	111.7	Y667 I717 V719 W723 Y739	Y667-P737 PolarHBondContact OH-O 3.26Å; I717-P737 HydrophobicContact CD1-CG 3.94Å; I717-P737 HydrophobicContact CG1-CG 4.18Å; V719-P737 HydrophobicContact CG2-CB 3.98Å; V719-P737 HydrophobicContact CG2-CG 3.78Å; W723-P737 HydrophobicContact CB-CG 4.19Å; P737-Y739 HydrophobicContact CB-CE1 4.12Å; P737-Y739 HydrophobicContact CB-CE2 4.31Å; P737-Y739 WeakPolarHBondContact CD-OH 3.46Å; P737-Y739 HydrophobicContact CG-CE1 4.25Å; P737-Y739 HydrophobicContact CG-CE2 4.25Å; P737-Y739 WeakPolarHBondContact O-CD2 3.34Å; P737-Y739 PolarHBondContact O-N 3.44Å
738	P	93.4	Very high	92.2	Very high	50 Å²	50	61.5 Å²	61.5	33%	0.325	28%	0.281	S	S	.	.			trans	-76.1	68.6	178.9	32.4	-35.9	0	0	0	111.9	Y667	Y667-P738 WeakPolarHBondContact OH-CA 3.26Å
739	Y	94.2	Very high	92.6	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.012	26%	0.261	C	S	.	.			trans	-58.9	137	178.3	-60.1	-64.9	0	0	0	112	T673 A721 W723 P725 L736 P737 E744 L745 K748	T673-Y739 HydrophobicContact CG2-CD2 4.22Å; T673-Y739 PolarHBondContact OG1-O 2.85Å; A721-Y739 HydrophobicContact CB-CD1 4.39Å; A721-Y739 WeakPolarHBondContact O-CD1 3.43Å; A721-Y739 WeakPolarHBondContact O-CE1 3.4Å; W723-Y739 PolarHBondContact O-OH 3.11Å; P725-Y739 WeakPolarHBondContact CD-OH 3.37Å; P725-Y739 HydrophobicContact CG-CE2 4.24Å; P725-Y739 WeakPolarHBondContact CG-OH 3.29Å; L736-Y739 HydrophobicContact CD2-CE2 4.48Å; P737-Y739 HydrophobicContact CB-CE1 4.12Å; P737-Y739 HydrophobicContact CB-CE2 4.31Å; P737-Y739 WeakPolarHBondContact CD-OH 3.46Å; P737-Y739 HydrophobicContact CG-CE1 4.25Å; P737-Y739 HydrophobicContact CG-CE2 4.25Å; P737-Y739 WeakPolarHBondContact O-CD2 3.34Å; P737-Y739 PolarHBondContact O-N 3.44Å; Y739-E744 HydrophobicContact CD1-CG 3.84Å; Y739-L745 HydrophobicContact CD2-CB 3.97Å; Y739-L745 HydrophobicContact CD2-CD1 3.93Å; Y739-L745 HydrophobicContact CD2-CG 3.85Å; Y739-L745 HydrophobicContact CE2-CG 4.37Å; Y739-L745 HydrophobicContact CG-CB 4.15Å; Y739-K748 HydrophobicContact CE1-CB 3.93Å; Y739-K748 HydrophobicContact CE1-CG 3.82Å
740	R	91.6	Very high	93.1	Very high	212 Å²	212	57.4 Å²	57.4	80%	0.8	26%	0.263	S	S	*	.	S	Bend	trans	-87.1	-25	-172.4	-63.5	-178.8	179.3	176.9	0.8	112.5	E744	R740-E744 PolarHBondContact N-OE2 3.18Å
741	T	94.3	Very high	93.8	Very high	69 Å²	69	58.7 Å²	58.7	42%	0.423	27%	0.267	S	S	.	.	S	Bend	trans	-133.6	151.7	-177	73.7	0	0	0	0	112.9	K743 E744 L745	T741-K743 VanDerWaalsContact C-N 3.26Å; T741-K743 PolarHBondContact O-N 2.91Å; T741-E744 PolarHBondContact N-OE2 2.9Å; T741-E744 PolarHBondContact O-N 2.98Å; T741-E744 VanDerWaalsContact OG1-CB 3.24Å; T741-E744 WeakPolarHBondContact OG1-CB 3.1Å; T741-E744 PolarHBondContact OG1-N 3.14Å; T741-L745 PolarHBondContact O-N 3.41Å; T741-L745 VanDerWaalsContact O-N 3.11Å
742	R	95.4	Very high	94.3	Very high	119 Å²	119	53.2 Å²	53.2	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-58.2	-36.5	173.4	-174.7	-179.6	173.8	-166.9	1.9	112.9	F676 D679 V680 K746	F676-R742 HydrophobicContact CB-CB 4.26Å; F676-R742 HydrophobicContact CB-CG 4.41Å; F676-R742 HydrophobicContact CD1-CB 3.89Å; F676-R742 HydrophobicContact CD1-CG 4.5Å; F676-R742 HydrophobicContact CE1-CB 4.41Å; F676-R742 HydrophobicContact CG-CB 3.99Å; D679-R742 PolarHBondContact O-NH2 3Å; V680-R742 HydrophobicContact CG2-CG 3.81Å; R742-K746 WeakPolarHBondContact O-CB 3.02Å; R742-K746 PolarHBondContact O-N 3.02Å
743	K	95.5	Very high	94.6	Very high	184 Å²	184	52.3 Å²	52.3	80%	0.8	24%	0.239	S	C	*	.	H	α-helix	trans	-66.2	-45.2	-179.8	-72.8	-176.2	179.8	-179.1	0	111.5	T741 K746 H747	T741-K743 VanDerWaalsContact C-N 3.26Å; T741-K743 PolarHBondContact O-N 2.91Å; K743-K746 PolarHBondContact O-N 3.16Å; K743-H747 WeakPolarHBondContact O-CB 3.5Å; K743-H747 PolarHBondContact O-N 2.7Å
744	E	94.3	Very high	94.4	Very high	45 Å²	45	53.4 Å²	53.4	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-51.2	176.6	-178.9	-174.7	-164.8	0	0	111.2	A721 Y739 R740 T741 K746 H747 K748	A721-E744 WeakPolarHBondContact CB-OE1 3.05Å; Y739-E744 HydrophobicContact CD1-CG 3.84Å; R740-E744 PolarHBondContact N-OE2 3.18Å; T741-E744 PolarHBondContact N-OE2 2.9Å; T741-E744 PolarHBondContact O-N 2.98Å; T741-E744 VanDerWaalsContact OG1-CB 3.24Å; T741-E744 WeakPolarHBondContact OG1-CB 3.1Å; T741-E744 PolarHBondContact OG1-N 3.14Å; E744-K746 VanDerWaalsContact C-N 3.34Å; E744-K746 PolarHBondContact O-N 2.94Å; E744-H747 PolarHBondContact O-N 3Å; E744-K748 WeakPolarHBondContact O-CG 2.85Å; E744-K748 PolarHBondContact O-N 3.21Å
745	L	96	Very high	93.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.8	-48.5	176.6	-174	154.3	0	0	0	111.2	T673 F676 F677 V680 Y739 T741 H747 K748 L749	T673-L745 HydrophobicContact CG2-CD1 4.01Å; T673-L745 WeakPolarHBondContact O-CD1 3.32Å; F676-L745 HydrophobicContact CB-CD1 3.93Å; F677-L745 HydrophobicContact CB-CD1 4.02Å; F677-L745 HydrophobicContact CB-CD2 4.41Å; F677-L745 HydrophobicContact CD2-CD2 4.49Å; V680-L745 HydrophobicContact CB-CD2 4.21Å; V680-L745 HydrophobicContact CG1-CD2 4.41Å; V680-L745 HydrophobicContact CG2-CD2 4.15Å; Y739-L745 HydrophobicContact CD2-CB 3.97Å; Y739-L745 HydrophobicContact CD2-CD1 3.93Å; Y739-L745 HydrophobicContact CD2-CG 3.85Å; Y739-L745 HydrophobicContact CE2-CG 4.37Å; Y739-L745 HydrophobicContact CG-CB 4.15Å; T741-L745 PolarHBondContact O-N 3.41Å; T741-L745 VanDerWaalsContact O-N 3.11Å; L745-H747 VanDerWaalsContact C-N 3.32Å; L745-H747 PolarHBondContact O-N 2.96Å; L745-K748 PolarHBondContact O-N 2.95Å; L745-L749 HydrophobicContact CD2-CB 4.33Å; L745-L749 HydrophobicContact CD2-CD2 4.1Å; L745-L749 WeakPolarHBondContact O-CB 3.36Å; L745-L749 PolarHBondContact O-N 2.95Å
746	K	96.4	Very high	92.8	Very high	113 Å²	113	59.5 Å²	59.5	49%	0.491	29%	0.289	S	S	.	.	H	α-helix	trans	-56.8	-47.2	179.3	-177.5	174.4	179	178.8	0	111.4	V680 F684 R742 K743 E744 T750	V680-K746 HydrophobicContact CG1-CB 4.03Å; V680-K746 HydrophobicContact CG1-CG 3.92Å; V680-K746 HydrophobicContact CG2-CB 3.8Å; V680-K746 HydrophobicContact CG2-CG 4.32Å; F684-K746 HydrophobicContact CE1-CG 4.38Å; R742-K746 WeakPolarHBondContact O-CB 3.02Å; R742-K746 PolarHBondContact O-N 3.02Å; K743-K746 PolarHBondContact O-N 3.16Å; E744-K746 VanDerWaalsContact C-N 3.34Å; E744-K746 PolarHBondContact O-N 2.94Å; K746-T750 VanDerWaalsContact O-CB 3.27Å; K746-T750 WeakPolarHBondContact O-CB 3.38Å; K746-T750 PolarHBondContact O-N 3.18Å; K746-T750 PolarHBondContact O-OG1 3.36Å
747	H	95.2	Very high	91	Very high	117 Å²	117	67.5 Å²	67.5	54%	0.542	33%	0.327	S	S	.	.	H	α-helix	trans	-63.4	-52.8	-179.1	-179.8	66.1	0	0	0	111.6	K743 E744 L745 L749 T750 I751	K743-H747 WeakPolarHBondContact O-CB 3.5Å; K743-H747 PolarHBondContact O-N 2.7Å; E744-H747 PolarHBondContact O-N 3Å; L745-H747 VanDerWaalsContact C-N 3.32Å; L745-H747 PolarHBondContact O-N 2.96Å; H747-L749 PolarHBondContact O-N 2.71Å; H747-T750 PolarHBondContact O-N 3.46Å; H747-I751 VanDerWaalsContact NE2-CD1 3.35Å; H747-I751 WeakPolarHBondContact NE2-CD1 3.21Å; H747-I751 WeakPolarHBondContact O-CG1 3.31Å; H747-I751 PolarHBondContact O-N 2.76Å
748	K	95.1	Very high	88.4	Confident	45 Å²	45	70.1 Å²	70.1	20%	0.196	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-42.4	-178.6	-65.3	-76	-178.1	176	0	112.3	D722 L724 Y739 E744 L745 I751 A752	D722-K748 WeakPolarHBondContact O-CE 3.23Å; D722-K748 PolarHBondContact O-NZ 2.68Å; L724-K748 HydrophobicContact CD2-CB 4.16Å; L724-K748 HydrophobicContact CD2-CD 3.75Å; L724-K748 WeakPolarHBondContact CD2-O 3.45Å; Y739-K748 HydrophobicContact CE1-CB 3.93Å; Y739-K748 HydrophobicContact CE1-CG 3.82Å; E744-K748 WeakPolarHBondContact O-CG 2.85Å; E744-K748 PolarHBondContact O-N 3.21Å; L745-K748 PolarHBondContact O-N 2.95Å; K748-I751 PolarHBondContact O-N 2.95Å; K748-A752 PolarHBondContact O-N 2.99Å
749	L	95.4	Very high	85.5	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-63.1	-45.1	176	-176.4	63.1	0	0	0	111.5	F677 V680 V681 F684 L692 P725 L745 H747 I751 A752 I753	F677-L749 HydrophobicContact CD2-CD2 3.97Å; F677-L749 HydrophobicContact CE2-CD1 4.33Å; F677-L749 HydrophobicContact CE2-CD2 3.86Å; V680-L749 HydrophobicContact CG1-CD2 4.36Å; V681-L749 HydrophobicContact CG2-CD2 4.11Å; F684-L749 HydrophobicContact CE2-CD2 4.02Å; F684-L749 HydrophobicContact CE2-CG 4.45Å; F684-L749 HydrophobicContact CZ-CD2 4.18Å; L692-L749 HydrophobicContact CD1-CD1 3.94Å; L692-L749 HydrophobicContact CD1-CD2 4.36Å; L692-L749 HydrophobicContact CD1-CG 4.47Å; P725-L749 HydrophobicContact CG-CD1 4.14Å; L745-L749 HydrophobicContact CD2-CB 4.33Å; L745-L749 HydrophobicContact CD2-CD2 4.1Å; L745-L749 WeakPolarHBondContact O-CB 3.36Å; L745-L749 PolarHBondContact O-N 2.95Å; H747-L749 PolarHBondContact O-N 2.71Å; L749-I751 VanDerWaalsContact C-N 3.3Å; L749-I751 PolarHBondContact O-N 3Å; L749-A752 PolarHBondContact O-N 3.49Å; L749-I753 HydrophobicContact CD1-CG2 3.99Å; L749-I753 HydrophobicContact CG-CG2 4.39Å; L749-I753 WeakPolarHBondContact O-CG1 3.38Å; L749-I753 WeakPolarHBondContact O-CG2 3.45Å; L749-I753 PolarHBondContact O-N 2.86Å
750	T	94.9	Very high	82.4	Confident	39 Å²	39	79.7 Å²	79.7	24%	0.239	41%	0.411	C	S	.	.	H	α-helix	trans	-62.4	-39.6	179.1	-55.1	0	0	0	0	111.3	L688 K746 H747 S754	L688-T750 HydrophobicContact CD1-CG2 4.49Å; K746-T750 VanDerWaalsContact O-CB 3.27Å; K746-T750 WeakPolarHBondContact O-CB 3.38Å; K746-T750 PolarHBondContact O-N 3.18Å; K746-T750 PolarHBondContact O-OG1 3.36Å; H747-T750 PolarHBondContact O-N 3.46Å; T750-S754 WeakPolarHBondContact O-CB 3.48Å; T750-S754 PolarHBondContact O-N 3.05Å; T750-S754 VanDerWaalsContact O-N 3.1Å; T750-S754 PolarHBondContact O-OG 3.26Å
751	I	93.6	Very high	79.3	Confident	56 Å²	56	78.1 Å²	78.1	29%	0.287	42%	0.417	S	S	.	.	H	α-helix	trans	-61.5	-51.6	174.2	-70	167.5	0	0	0	110.3	L724 H747 K748 L749 I753 S754 N755	L724-I751 HydrophobicContact CD1-CG2 3.99Å; L724-I751 HydrophobicContact CD2-CB 4.03Å; L724-I751 HydrophobicContact CD2-CG2 3.8Å; H747-I751 VanDerWaalsContact NE2-CD1 3.35Å; H747-I751 WeakPolarHBondContact NE2-CD1 3.21Å; H747-I751 WeakPolarHBondContact O-CG1 3.31Å; H747-I751 PolarHBondContact O-N 2.76Å; K748-I751 PolarHBondContact O-N 2.95Å; L749-I751 VanDerWaalsContact C-N 3.3Å; L749-I751 PolarHBondContact O-N 3Å; I751-I753 PolarHBondContact O-N 3.37Å; I751-S754 PolarHBondContact O-N 3.21Å; I751-N755 PolarHBondContact O-N 3.23Å; I751-N755 VanDerWaalsContact O-N 3.16Å; I751-N755 PolarHBondContact O-ND2 3.28Å
752	A	92.8	Very high	76.1	Confident	8 Å²	8	87.3 Å²	87.3	7%	0.066	46%	0.455	C	S	.	.	H	α-helix	trans	-59.9	-48.9	-177	0	0	0	0	0	112.5	F695 L724 P725 K748 L749 S754 N755 A756	F695-A752 HydrophobicContact CE2-CB 4.29Å; F695-A752 HydrophobicContact CZ-CB 4.12Å; L724-A752 HydrophobicContact CB-CB 4.43Å; P725-A752 HydrophobicContact CB-CB 4.45Å; P725-A752 HydrophobicContact CG-CB 4.37Å; K748-A752 PolarHBondContact O-N 2.99Å; L749-A752 PolarHBondContact O-N 3.49Å; A752-S754 VanDerWaalsContact C-N 3.28Å; A752-S754 PolarHBondContact O-N 2.87Å; A752-N755 PolarHBondContact O-N 3.13Å; A752-A756 PolarHBondContact O-N 3.26Å
753	I	93.9	Very high	75.1	Confident	6 Å²	6	85.7 Å²	85.7	3%	0.031	46%	0.455	C	S	.	.	H	α-helix	trans	-71.1	-23.4	-178.3	71.1	-176.6	0	0	0	112.9	F684 L688 K691 L692 F695 L749 I751	F684-I753 HydrophobicContact CD2-CD1 4.44Å; F684-I753 HydrophobicContact CE2-CD1 3.75Å; F684-I753 HydrophobicContact CZ-CD1 4.33Å; L688-I753 HydrophobicContact CB-CD1 4.35Å; L688-I753 HydrophobicContact CD2-CD1 4.2Å; K691-I753 HydrophobicContact CB-CB 4.22Å; K691-I753 HydrophobicContact CB-CD1 4.42Å; K691-I753 HydrophobicContact CB-CG1 4.28Å; L692-I753 HydrophobicContact CB-CD1 4.45Å; L692-I753 HydrophobicContact CB-CG2 4.37Å; L692-I753 HydrophobicContact CD1-CG2 3.97Å; F695-I753 HydrophobicContact CB-CB 4.31Å; F695-I753 HydrophobicContact CB-CG2 3.89Å; F695-I753 HydrophobicContact CD1-CG2 3.91Å; F695-I753 HydrophobicContact CG-CG2 3.93Å; L749-I753 HydrophobicContact CD1-CG2 3.99Å; L749-I753 HydrophobicContact CG-CG2 4.39Å; L749-I753 WeakPolarHBondContact O-CG1 3.38Å; L749-I753 WeakPolarHBondContact O-CG2 3.45Å; L749-I753 PolarHBondContact O-N 2.86Å; I751-I753 PolarHBondContact O-N 3.37Å
754	S	89.8	Confident	74	Confident	52 Å²	52	80.5 Å²	80.5	36%	0.364	44%	0.437	S	S	.	.	H	α-helix	trans	-84.4	-18.8	179.1	-58.6	0	0	0	0	113.2	T750 I751 A752	T750-S754 WeakPolarHBondContact O-CB 3.48Å; T750-S754 PolarHBondContact O-N 3.05Å; T750-S754 VanDerWaalsContact O-N 3.1Å; T750-S754 PolarHBondContact O-OG 3.26Å; I751-S754 PolarHBondContact O-N 3.21Å; A752-S754 VanDerWaalsContact C-N 3.28Å; A752-S754 PolarHBondContact O-N 2.87Å
755	N	84.8	Confident	72.9	Confident	82 Å²	82	82.5 Å²	82.5	44%	0.439	45%	0.45	S	S	.	.	S	Bend	trans	-117.9	16.1	-176.7	-62	-81.6	0	0	0	112.5	I751 A752 E757 G758	I751-N755 PolarHBondContact O-N 3.23Å; I751-N755 VanDerWaalsContact O-N 3.16Å; I751-N755 PolarHBondContact O-ND2 3.28Å; A752-N755 PolarHBondContact O-N 3.13Å; N755-E757 PolarHBondContact O-N 3.36Å; N755-G758 PolarHBondContact O-N 3.04Å
756	A	70.9	Confident	71.6	Confident	49 Å²	49	87.4 Å²	87.4	41%	0.405	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.6	-175.5	0	0	0	0	0	114.1	F695 A752	F695-A756 HydrophobicContact CB-CB 4.45Å; F695-A756 HydrophobicContact CD2-CB 3.75Å; A752-A756 PolarHBondContact O-N 3.26Å
757	E	59.2	Low	70	Confident	169 Å²	169	85.8 Å²	85.8	79%	0.79	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-1.3	178.5	-65.9	176.2	172.3	0	0	112.9	H694 N755	H694-E757 IonicContact NE2-OE1 3.69Å; N755-E757 PolarHBondContact O-N 3.36Å
758	G	39.4	Very low	68.3	Low	55 Å²	55	83.7 Å²	83.7	57%	0.567	47%	0.471	S	S	*	.	S	Bend	trans	-117.2	7.2	-164.3	0	0	0	0	0	117.2	N755	N755-G758 PolarHBondContact O-N 3.04Å
759	F	32.5	Very low	66.4	Low	185 Å²	185	86.4 Å²	86.4	81%	0.811	49%	0.49	S	S	*	.			trans	-131.4	71.4	170.8	-79.2	-84.7	0	0	0	110.2	L761	F759-L761 PolarHBondContact O-N 3.15Å
760	G	29.3	Very low	64.2	Low	69 Å²	69	93.1 Å²	93.1	71%	0.711	53%	0.528	S	S	*	.			trans	-64.1	122.9	145.7	0	0	0	0	0	106.8	E762	G760-E762 PolarHBondContact O-N 2.9Å
761	L	27.1	Very low	61.6	Low	179 Å²	179	97.6 Å²	97.6	94%	0.937	55%	0.552	S	S	*	*			trans	-53.9	108.1	163.9	-76.8	141	0	0	0	107.4	F759	F759-L761 PolarHBondContact O-N 3.15Å
762	E	26.2	Very low	58.7	Low	261 Å²	261	101.4 Å²	101.4	100%	1.22	58%	0.576	S	S	*	*			trans	-65.7	0	148.8	-76.2	-172.5	159.8	0	0	109.7	G760	G760-E762 PolarHBondContact O-N 2.9Å

Retrieved 762 of 762 residues in 964.5 ms (Link to these results)

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