A0A3B3TYA4_9TELE Loading...

V-ets avian erythroblastosis virus E26 oncogene homolog 1

AlphaFold DB , UniProt , Accession A0A3B3TYA4, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 435 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.8	Very low	35	Very low	235 Å²	235	150.2 Å²	150.2	100%	1.158	84%	0.84	S	S	*	*				0	128.2	0	-80.3	179.8	171.7	0	0	107.6
2	I	36.1	Very low	34.7	Very low	156 Å²	156	147.8 Å²	147.8	80%	0.8	83%	0.833	S	S	*	*			cis	-138.5	155.1	-2.6	-85.1	146.3	0	0	0	107.6
3	M	32.9	Very low	34.4	Very low	172 Å²	172	150 Å²	150	85%	0.847	84%	0.84	S	S	*	*			trans	-89.3	129.7	172.9	-86.8	-176.1	169.3	0	0	112.3
4	T	35	Very low	34.3	Very low	129 Å²	129	147 Å²	147	79%	0.791	83%	0.827	S	S	*	*				45	136.5	126.7	-24.4	0	0	0	0	122.5
5	A	34.7	Very low	34.1	Very low	89 Å²	89	147.7 Å²	147.7	74%	0.736	83%	0.826	S	S	*	*			trans	98.8	123.1	142.5	0	0	0	0	0	120.9
6	A	34.8	Very low	34.1	Very low	100 Å²	100	148.3 Å²	148.3	83%	0.826	82%	0.824	S	S	*	*			trans	62.4	163.6	152.1	0	0	0	0	0	117.3
7	V	35.3	Very low	34.2	Very low	136 Å²	136	148.4 Å²	148.4	82%	0.824	81%	0.814	S	S	*	*			cis	-130.9	160.5	15.3	179.3	0	0	0	0	110.9
8	D	32.3	Very low	34.1	Very low	153 Å²	153	145.7 Å²	145.7	82%	0.818	82%	0.815	S	S	*	*			trans	-69.7	156.3	178.4	-167.4	14.7	0	0	0	114
9	M	34.3	Very low	34.4	Very low	161 Å²	161	146.2 Å²	146.2	79%	0.793	81%	0.81	S	S	*	*			trans	-152.7	125.3	176.5	-74.8	-163.2	78.9	0	0	112.8
10	K	31.1	Very low	34.3	Very low	202 Å²	202	148.7 Å²	148.7	88%	0.878	81%	0.812	S	S	*	*			trans	162.7	162.9	142.5	-91.9	154.3	-172.9	174.3	0	111.2
11	P	41.3	Very low	34.3	Very low	119 Å²	119	149.7 Å²	149.7	77%	0.773	81%	0.813	S	S	*	*			cis	-133.9	171.2	-39	37.2	-21.4	0	0	0	113.2
12	T	30.6	Very low	34	Very low	122 Å²	122	145.9 Å²	145.9	75%	0.748	80%	0.798	S	S	*	*			trans	-63.3	142.5	172.5	-48.4	0	0	0	0	113.7
13	L	30.7	Very low	34.1	Very low	176 Å²	176	145.9 Å²	145.9	92%	0.921	80%	0.799	S	S	*	*			trans	-134	148.6	147.4	-106.4	170.6	0	0	0	109.3
14	T	34	Very low	34.8	Very low	108 Å²	108	143.6 Å²	143.6	66%	0.663	80%	0.797	S	S	*	*			trans	-124.5	-177	-164.8	-42.6	0	0	0	0	110.7
15	I	31	Very low	35	Very low	158 Å²	158	146.7 Å²	146.7	81%	0.81	80%	0.803	S	S	*	*			trans	66.1	142.9	172.6	19.2	-176.3	0	0	0	114.6
16	I	33.4	Very low	35	Very low	156 Å²	156	148.6 Å²	148.6	80%	0.8	81%	0.809	S	S	*	*			cis	-129.8	151.6	12.6	-57.3	172.5	0	0	0	111.5
17	K	35.8	Very low	34.9	Very low	151 Å²	151	146.9 Å²	146.9	66%	0.657	80%	0.801	S	S	*	*			trans	-69.2	136.8	173.8	-177.3	-168.5	-175.1	-150.4	0	112.5	E19	K17-E19 WeakPolarHBondContact CE-OE1 2.94Å; K17-E19 WeakPolarHBondContact CE-OE2 3.25Å; K17-E19 IonicContact NZ-OE1 2.63Å; K17-E19 PolarHBondContact NZ-OE1 2.63Å; K17-E19 IonicContact NZ-OE2 2.69Å; K17-E19 PolarHBondContact NZ-OE2 3.24Å
18	A	32.8	Very low	35	Very low	99 Å²	99	148.3 Å²	148.3	82%	0.818	80%	0.804	S	S	*	*			trans	-138.4	127.3	159.2	0	0	0	0	0	109
19	E	39.6	Very low	35.6	Very low	156 Å²	156	146.3 Å²	146.3	73%	0.729	80%	0.797	S	S	*	*			trans	-83.8	142.5	-179.9	-82.6	148.1	140.1	0	0	111.8	K17	K17-E19 WeakPolarHBondContact CE-OE1 2.94Å; K17-E19 WeakPolarHBondContact CE-OE2 3.25Å; K17-E19 IonicContact NZ-OE1 2.63Å; K17-E19 PolarHBondContact NZ-OE1 2.63Å; K17-E19 IonicContact NZ-OE2 2.69Å; K17-E19 PolarHBondContact NZ-OE2 3.24Å
20	K	33.2	Very low	35.9	Very low	196 Å²	196	144 Å²	144	85%	0.852	80%	0.795	S	S	*	*			trans	-138.6	139.8	160.3	-164.6	178.5	-179.1	-170.5	0	107.4
21	M	33.8	Very low	36.5	Very low	170 Å²	170	142.3 Å²	142.3	84%	0.837	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.7	136.3	-178.3	-71.3	148	56.4	0	0	111.1
22	D	31.6	Very low	36.2	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-90.3	122.5	165	-65.6	-63.7	0	0	0	109.2
23	D	37.7	Very low	36.9	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-98.1	116.2	166.8	-98.7	-55.3	0	0	0	108.6
24	P	48.6	Very low	37.5	Very low	124 Å²	124	136.4 Å²	136.4	81%	0.805	76%	0.761	S	S	*	*			trans	-107	61.3	-167.4	40.4	-35.6	0	0	0	114
25	E	38.7	Very low	37.9	Very low	194 Å²	194	133.3 Å²	133.3	91%	0.907	75%	0.751	S	S	*	*			trans	-142	93.7	174.9	-161.5	160	-131.9	0	0	115.1
26	C	34.7	Very low	38.8	Very low	129 Å²	129	127.8 Å²	127.8	87%	0.872	73%	0.726	S	S	*	*			trans	-158	80.3	150.4	-165.3	0	0	0	0	109
27	G	32.8	Very low	39.8	Very low	64 Å²	64	126.8 Å²	126.8	66%	0.66	72%	0.716	S	S	*	*			trans	-81.9	127.2	171.1	0	0	0	0	0	110.3	V29	G27-V29 PolarHBondContact O-N 2.81Å
28	D	36.4	Very low	40.8	Very low	166 Å²	166	124.3 Å²	124.3	89%	0.888	71%	0.707	S	S	*	*			trans	-57.6	102.2	176.6	-84.3	-57.6	0	0	0	111.4	P30	D28-P30 WeakPolarHBondContact O-CD 3.27Å
29	V	45.7	Very low	41.9	Very low	111 Å²	111	126.4 Å²	126.4	67%	0.673	70%	0.701	S	S	*	*			trans	-71.8	121.7	170.5	179.7	0	0	0	0	108.1	G27 L31	G27-V29 PolarHBondContact O-N 2.81Å; V29-L31 PolarHBondContact O-N 3.17Å; V29-L31 VanDerWaalsContact O-N 3.08Å
30	P	41.5	Very low	42.6	Very low	113 Å²	113	123.3 Å²	123.3	73%	0.734	69%	0.688	S	S	*	*			trans	-59.4	117.4	-177.4	-26.3	35.6	0	0	0	112	D28 L32	D28-P30 WeakPolarHBondContact O-CD 3.27Å; P30-L32 PolarHBondContact O-N 2.7Å; P30-L32 VanDerWaalsContact O-N 3.08Å
31	L	42.2	Very low	43.9	Very low	166 Å²	166	114.5 Å²	114.5	87%	0.869	65%	0.651	S	S	*	*			trans	-57.7	114.6	177.7	-71.4	170.6	0	0	0	110.2	V29 T33	V29-L31 PolarHBondContact O-N 3.17Å; V29-L31 VanDerWaalsContact O-N 3.08Å; L31-T33 PolarHBondContact O-N 3.42Å
32	L	36.3	Very low	45.4	Very low	95 Å²	95	111.5 Å²	111.5	50%	0.497	64%	0.635	S	S	.	*			trans	-60.3	107.2	-177.8	-70.7	173.3	0	0	0	110.9	P30 K37 M40	P30-L32 PolarHBondContact O-N 2.7Å; P30-L32 VanDerWaalsContact O-N 3.08Å; L32-K37 HydrophobicContact CB-CG 4.32Å; L32-M40 HydrophobicContact CD1-CE 4.2Å
33	T	44.3	Very low	46.8	Very low	80 Å²	80	106.9 Å²	106.9	49%	0.491	62%	0.619	S	S	.	*			trans	-59	157.6	176.4	74.4	0	0	0	0	110.9	L31 G35 S36 K37	L31-T33 PolarHBondContact O-N 3.42Å; T33-G35 PolarHBondContact O-N 2.63Å; T33-G35 VanDerWaalsContact O-N 3.13Å; T33-S36 WeakPolarHBondContact O-CA 3.19Å; T33-S36 VanDerWaalsContact O-CB 3.28Å; T33-S36 WeakPolarHBondContact O-CB 3.22Å; T33-S36 PolarHBondContact O-N 2.85Å; T33-S36 PolarHBondContact OG1-N 2.64Å; T33-S36 PolarHBondContact OG1-OG 2.98Å; T33-K37 PolarHBondContact O-N 2.93Å
34	P	44.3	Very low	48.2	Very low	117 Å²	117	100.2 Å²	100.2	76%	0.76	58%	0.583	S	S	*	*	H	α-helix	trans	-53.5	-37.2	-178.8	-29.2	36.6	0	0	0	114.3	K37 E38	P34-K37 PolarHBondContact O-N 3.43Å; P34-E38 PolarHBondContact O-N 2.85Å
35	G	41.5	Very low	49.1	Very low	43 Å²	43	98.6 Å²	98.6	44%	0.443	56%	0.563	S	S	.	*	H	α-helix	trans	-69.1	-31.1	175.7	0	0	0	0	0	114	T33 K37 E38 M39	T33-G35 PolarHBondContact O-N 2.63Å; T33-G35 VanDerWaalsContact O-N 3.13Å; G35-K37 VanDerWaalsContact C-N 3.31Å; G35-K37 PolarHBondContact O-N 3.13Å; G35-E38 PolarHBondContact O-N 2.69Å; G35-M39 WeakPolarHBondContact O-CG 3.14Å; G35-M39 PolarHBondContact O-N 3Å
36	S	50.7	Low	50.5	Low	43 Å²	43	92.5 Å²	92.5	30%	0.301	55%	0.546	S	S	.	.	H	α-helix	trans	-64.9	-35.5	175.9	-49.7	0	0	0	0	111.8	T33 M40	T33-S36 WeakPolarHBondContact O-CA 3.19Å; T33-S36 VanDerWaalsContact O-CB 3.28Å; T33-S36 WeakPolarHBondContact O-CB 3.22Å; T33-S36 PolarHBondContact O-N 2.85Å; T33-S36 PolarHBondContact OG1-N 2.64Å; T33-S36 PolarHBondContact OG1-OG 2.98Å; S36-M40 WeakPolarHBondContact O-CB 3.44Å; S36-M40 PolarHBondContact O-N 3.5Å
37	K	53.7	Low	51.9	Low	135 Å²	135	88.5 Å²	88.5	59%	0.587	52%	0.517	S	S	*	.	H	α-helix	trans	-69.4	-42.6	176.5	-63.6	-169.2	178.1	-171	0	112.2	L32 T33 P34 G35 M40 S41	L32-K37 HydrophobicContact CB-CG 4.32Å; T33-K37 PolarHBondContact O-N 2.93Å; P34-K37 PolarHBondContact O-N 3.43Å; G35-K37 VanDerWaalsContact C-N 3.31Å; G35-K37 PolarHBondContact O-N 3.13Å; K37-M40 PolarHBondContact O-N 2.93Å; K37-S41 WeakPolarHBondContact O-CB 3.38Å; K37-S41 PolarHBondContact O-N 3.08Å
38	E	57.8	Low	53.8	Low	98 Å²	98	85.8 Å²	85.8	46%	0.458	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-44.1	176.5	-177.9	57.9	-153	0	0	111.7	P34 G35 M40 S41 Q42	P34-E38 PolarHBondContact O-N 2.85Å; G35-E38 PolarHBondContact O-N 2.69Å; E38-M40 VanDerWaalsContact C-N 3.31Å; E38-M40 PolarHBondContact O-N 2.9Å; E38-S41 PolarHBondContact O-N 3.13Å; E38-Q42 WeakPolarHBondContact O-CG 3.33Å; E38-Q42 PolarHBondContact O-N 3.08Å; E38-Q42 WeakPolarHBondContact OE1-CG 3.39Å; E38-Q42 PolarHBondContact OE1-NE2 2.98Å
39	M	54.3	Low	55.3	Low	143 Å²	143	81.3 Å²	81.3	70%	0.704	47%	0.469	S	S	*	.	H	α-helix	trans	-62.2	-37.7	175	-73.3	-174.9	174.1	0	0	112.5	G35 A43	G35-M39 WeakPolarHBondContact O-CG 3.14Å; G35-M39 PolarHBondContact O-N 3Å; M39-A43 WeakPolarHBondContact O-CB 3.42Å; M39-A43 PolarHBondContact O-N 3.34Å
40	M	55.2	Low	56.5	Low	92 Å²	92	77 Å²	77	45%	0.453	45%	0.447	S	S	.	.	H	α-helix	trans	-63.3	-50.4	172.6	-175.7	178.7	-73	0	0	111	L32 S36 K37 E38 Q42 A43 L44	L32-M40 HydrophobicContact CD1-CE 4.2Å; S36-M40 WeakPolarHBondContact O-CB 3.44Å; S36-M40 PolarHBondContact O-N 3.5Å; K37-M40 PolarHBondContact O-N 2.93Å; E38-M40 VanDerWaalsContact C-N 3.31Å; E38-M40 PolarHBondContact O-N 2.9Å; M40-Q42 VanDerWaalsContact C-N 3.3Å; M40-Q42 PolarHBondContact O-N 3.42Å; M40-A43 PolarHBondContact O-N 3.46Å; M40-A43 VanDerWaalsContact O-N 3.16Å; M40-L44 HydrophobicContact CG-CD1 4.13Å; M40-L44 HydrophobicContact CG-CG 4.36Å; M40-L44 WeakPolarHBondContact O-CB 3.49Å; M40-L44 VanDerWaalsContact O-CG 3.26Å; M40-L44 WeakPolarHBondContact O-CG 3.28Å; M40-L44 PolarHBondContact O-N 3.03Å
41	S	61.4	Low	58.4	Low	10 Å²	10	71.7 Å²	71.7	7%	0.07	41%	0.412	C	S	.	.	H	α-helix	trans	-58	-39.1	177.4	-175	0	0	0	0	112.5	K37 E38 K45 E122	K37-S41 WeakPolarHBondContact O-CB 3.38Å; K37-S41 PolarHBondContact O-N 3.08Å; E38-S41 PolarHBondContact O-N 3.13Å; S41-K45 WeakPolarHBondContact O-CB 3.49Å; S41-K45 WeakPolarHBondContact O-CD 3.39Å; S41-K45 WeakPolarHBondContact O-CG 3.24Å; S41-K45 PolarHBondContact O-N 3.41Å; S41-K45 PolarHBondContact OG-NZ 3.38Å; S41-E122 VanDerWaalsContact CB-OE1 3.31Å; S41-E122 WeakPolarHBondContact CB-OE1 3.23Å; S41-E122 PolarHBondContact OG-OE1 3.02Å
42	Q	63.5	Low	60.2	Low	108 Å²	108	66.6 Å²	66.6	51%	0.505	39%	0.389	S	S	.	.	H	α-helix	trans	-69.7	-38.7	175.4	-70.6	-178.3	17.2	0	0	113.3	E38 M40 K45 A46	E38-Q42 WeakPolarHBondContact O-CG 3.33Å; E38-Q42 PolarHBondContact O-N 3.08Å; E38-Q42 WeakPolarHBondContact OE1-CG 3.39Å; E38-Q42 PolarHBondContact OE1-NE2 2.98Å; M40-Q42 VanDerWaalsContact C-N 3.3Å; M40-Q42 PolarHBondContact O-N 3.42Å; Q42-K45 WeakPolarHBondContact O-CB 3.45Å; Q42-K45 PolarHBondContact O-N 3.4Å; Q42-A46 PolarHBondContact O-N 2.85Å; Q42-A46 VanDerWaalsContact O-N 3.13Å
43	A	61.3	Low	62.2	Low	58 Å²	58	69.1 Å²	69.1	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-66	-42.5	174.3	0	0	0	0	0	111.4	M39 M40 A46 T47	M39-A43 WeakPolarHBondContact O-CB 3.42Å; M39-A43 PolarHBondContact O-N 3.34Å; M40-A43 PolarHBondContact O-N 3.46Å; M40-A43 VanDerWaalsContact O-N 3.16Å; A43-A46 PolarHBondContact O-N 3.48Å; A43-T47 PolarHBondContact O-N 3.07Å; A43-T47 PolarHBondContact O-OG1 3.3Å
44	L	67.4	Low	63.8	Low	16 Å²	16	67.5 Å²	67.5	8%	0.084	38%	0.382	C	S	.	.	H	α-helix	trans	-60	-48.1	173.6	-70.7	-177.7	0	0	0	111.4	M40 A46 T47 F48 F83 I119 E122	M40-L44 HydrophobicContact CG-CD1 4.13Å; M40-L44 HydrophobicContact CG-CG 4.36Å; M40-L44 WeakPolarHBondContact O-CB 3.49Å; M40-L44 VanDerWaalsContact O-CG 3.26Å; M40-L44 WeakPolarHBondContact O-CG 3.28Å; M40-L44 PolarHBondContact O-N 3.03Å; L44-A46 VanDerWaalsContact C-N 3.29Å; L44-A46 PolarHBondContact O-N 3.33Å; L44-T47 PolarHBondContact O-N 2.87Å; L44-F48 HydrophobicContact CB-CD2 4.31Å; L44-F48 HydrophobicContact CB-CE2 3.59Å; L44-F48 HydrophobicContact CB-CZ 3.73Å; L44-F48 HydrophobicContact CD1-CZ 4.36Å; L44-F48 HydrophobicContact CD2-CZ 4.13Å; L44-F48 HydrophobicContact CG-CZ 4.28Å; L44-F48 WeakPolarHBondContact O-CD2 3.49Å; L44-F48 WeakPolarHBondContact O-CG 3.45Å; L44-F48 PolarHBondContact O-N 2.75Å; L44-F83 HydrophobicContact CD2-CD1 4.35Å; L44-F83 HydrophobicContact CD2-CE1 3.41Å; L44-F83 VanDerWaalsContact CD2-CE1 3.41Å; L44-F83 HydrophobicContact CD2-CZ 3.71Å; L44-I119 HydrophobicContact CD1-CG1 4.45Å; L44-I119 HydrophobicContact CD2-CG1 4.42Å; L44-I119 HydrophobicContact CD2-CG2 3.85Å; L44-E122 HydrophobicContact CD1-CB 4.17Å; L44-E122 HydrophobicContact CD1-CG 4.06Å
45	K	67.4	Low	65.6	Low	89 Å²	89	62.6 Å²	62.6	39%	0.387	35%	0.349	S	S	.	.	H	α-helix	trans	-51.4	-43.7	173.7	-83	163.7	178.5	127.8	0	113.2	S41 Q42 M126	S41-K45 WeakPolarHBondContact O-CB 3.49Å; S41-K45 WeakPolarHBondContact O-CD 3.39Å; S41-K45 WeakPolarHBondContact O-CG 3.24Å; S41-K45 PolarHBondContact O-N 3.41Å; S41-K45 PolarHBondContact OG-NZ 3.38Å; Q42-K45 WeakPolarHBondContact O-CB 3.45Å; Q42-K45 PolarHBondContact O-N 3.4Å; K45-M126 HydrophobicContact CB-CE 4.31Å; K45-M126 HydrophobicContact CB-SD 4.33Å; K45-M126 HydrophobicContact CD-SD 4.22Å; K45-M126 HydrophobicContact CG-CE 3.6Å; K45-M126 HydrophobicContact CG-SD 3.26Å; K45-M126 WeakPolarHBondContact CG-SD 3.34Å
46	A	67.4	Low	67.4	Low	66 Å²	66	68.1 Å²	68.1	55%	0.545	36%	0.364	S	S	.	.	H	α-helix	trans	-63.3	-43.3	177.8	0	0	0	0	0	111.9	Q42 A43 L44 S49	Q42-A46 PolarHBondContact O-N 2.85Å; Q42-A46 VanDerWaalsContact O-N 3.13Å; A43-A46 PolarHBondContact O-N 3.48Å; L44-A46 VanDerWaalsContact C-N 3.29Å; L44-A46 PolarHBondContact O-N 3.33Å; A46-S49 WeakPolarHBondContact O-CB 3.35Å; A46-S49 PolarHBondContact O-OG 2.73Å
47	T	65.4	Low	68.9	Low	45 Å²	45	73.3 Å²	73.3	28%	0.276	38%	0.377	S	S	.	.	H	α-helix	trans	-69.7	-40.2	179.2	-55.9	0	0	0	0	112.8	A43 L44 S49 G50 E82 F83	A43-T47 PolarHBondContact O-N 3.07Å; A43-T47 PolarHBondContact O-OG1 3.3Å; L44-T47 PolarHBondContact O-N 2.87Å; T47-S49 PolarHBondContact O-N 2.85Å; T47-S49 VanDerWaalsContact O-N 3.09Å; T47-G50 PolarHBondContact O-N 2.91Å; T47-E82 HydrophobicContact CG2-CG 3.46Å; T47-E82 VanDerWaalsContact CG2-CG 3.46Å; T47-F83 HydrophobicContact CG2-CE1 3.81Å; T47-F83 HydrophobicContact CG2-CE2 3.78Å; T47-F83 HydrophobicContact CG2-CZ 3.35Å
48	F	72.6	Confident	70.2	Confident	7 Å²	7	69.6 Å²	69.6	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-19.8	179.1	-59.2	-33.6	0	0	0	113.8	L44 G50 F51 W78 F83 E122 H123 M126	L44-F48 HydrophobicContact CB-CD2 4.31Å; L44-F48 HydrophobicContact CB-CE2 3.59Å; L44-F48 HydrophobicContact CB-CZ 3.73Å; L44-F48 HydrophobicContact CD1-CZ 4.36Å; L44-F48 HydrophobicContact CD2-CZ 4.13Å; L44-F48 HydrophobicContact CG-CZ 4.28Å; L44-F48 WeakPolarHBondContact O-CD2 3.49Å; L44-F48 WeakPolarHBondContact O-CG 3.45Å; L44-F48 PolarHBondContact O-N 2.75Å; F48-G50 PolarHBondContact O-N 3.2Å; F48-F51 WeakPolarHBondContact O-CB 3.38Å; F48-F51 PolarHBondContact O-N 3.36Å; F48-W78 HydrophobicContact CD1-CH2 4.16Å; F48-W78 HydrophobicContact CD1-CZ3 4.17Å; F48-F83 AromaticContact CD1-CE2 3.97Å; F48-F83 HydrophobicContact CD1-CE2 3.97Å; F48-F83 AromaticContact CD1-CZ 3.97Å; F48-F83 HydrophobicContact CD1-CZ 3.97Å; F48-F83 AromaticContact CE1-CE2 3.54Å; F48-F83 HydrophobicContact CE1-CE2 3.54Å; F48-F83 AromaticContact CE1-CZ 3.49Å; F48-F83 HydrophobicContact CE1-CZ 3.49Å; F48-F83 VanDerWaalsContact CE1-CZ 3.49Å; F48-F83 HydrophobicContact CZ-CZ 4.3Å; F48-E122 HydrophobicContact CE2-CG 4.48Å; F48-H123 HydrophobicContact CD1-CB 4.04Å; F48-H123 AromaticContact CD1-CD2 3.73Å; F48-H123 AromaticContact CD1-CE1 3.77Å; F48-H123 AromaticContact CD1-CG 3.51Å; F48-H123 AromaticContact CD1-ND1 3.53Å; F48-H123 AromaticContact CD1-NE2 3.9Å; F48-H123 HydrophobicContact CD2-CB 4.13Å; F48-H123 AromaticContact CD2-CD2 3.77Å; F48-H123 AromaticContact CD2-CG 3.98Å; F48-H123 HydrophobicContact CE1-CB 3.61Å; F48-H123 AromaticContact CE1-CG 3.6Å; F48-H123 AromaticContact CE1-ND1 3.73Å; F48-H123 HydrophobicContact CE2-CB 3.69Å; F48-H123 HydrophobicContact CG-CB 4.3Å; F48-H123 AromaticContact CG-CD2 3.49Å; F48-H123 VanDerWaalsContact CG-CD2 3.49Å; F48-H123 WeakPolarHBondContact CG-CD2 3.27Å; F48-H123 AromaticContact CG-CG 3.73Å; F48-H123 AromaticContact CG-NE2 3.79Å; F48-H123 HydrophobicContact CZ-CB 3.44Å; F48-H123 VanDerWaalsContact CZ-CB 3.44Å; F48-H123 AromaticContact CZ-CG 3.89Å; F48-M126 HydrophobicContact CB-CE 4.35Å; F48-M126 HydrophobicContact CD2-CE 3.84Å; F48-M126 HydrophobicContact CD2-SD 3.57Å; F48-M126 VanDerWaalsContact CD2-SD 3.57Å; F48-M126 HydrophobicContact CE2-SD 3.93Å
49	S	67.2	Low	71.3	Confident	73 Å²	73	67.6 Å²	67.6	51%	0.51	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.8	169.7	76.7	0	0	0	0	114.5	A46 T47	A46-S49 WeakPolarHBondContact O-CB 3.35Å; A46-S49 PolarHBondContact O-OG 2.73Å; T47-S49 PolarHBondContact O-N 2.85Å; T47-S49 VanDerWaalsContact O-N 3.09Å
50	G	72.1	Confident	72.8	Confident	20 Å²	20	61.2 Å²	61.2	21%	0.206	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-42.5	167.4	0	0	0	0	0	112.7	T47 F48 T52 K53	T47-G50 PolarHBondContact O-N 2.91Å; F48-G50 PolarHBondContact O-N 3.2Å; G50-T52 VanDerWaalsContact C-N 3.31Å; G50-T52 PolarHBondContact O-N 3.42Å; G50-K53 PolarHBondContact O-N 2.84Å
51	F	80.9	Confident	74.2	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	33%	0.326	C	S	.	.	H	α-helix	trans	-64.6	-31.4	-173.9	-174.7	-121	0	0	0	113	F48 K53 E54 Q55 I60 W67 W75 W78 H123 L127	F48-F51 WeakPolarHBondContact O-CB 3.38Å; F48-F51 PolarHBondContact O-N 3.36Å; F51-K53 PolarHBondContact O-N 3.23Å; F51-K53 VanDerWaalsContact O-N 3.11Å; F51-E54 HydrophobicContact CD2-CB 4.18Å; F51-E54 CarbonylContact O-C 3.56Å; F51-E54 WeakPolarHBondContact O-CA 3.36Å; F51-E54 WeakPolarHBondContact O-CB 3.4Å; F51-E54 PolarHBondContact O-N 2.91Å; F51-Q55 HydrophobicContact CD1-CG 3.8Å; F51-Q55 VanDerWaalsContact CE1-CD 3.46Å; F51-Q55 HydrophobicContact CE1-CG 3.43Å; F51-Q55 VanDerWaalsContact CE1-CG 3.43Å; F51-Q55 HydrophobicContact CE2-CG 4.2Å; F51-Q55 HydrophobicContact CG-CG 4.33Å; F51-Q55 HydrophobicContact CZ-CG 3.64Å; F51-Q55 PolarHBondContact O-N 2.61Å; F51-I60 HydrophobicContact CE2-CD1 4.35Å; F51-I60 HydrophobicContact CZ-CD1 4.3Å; F51-W67 AromaticContact CE1-CH2 3.86Å; F51-W67 HydrophobicContact CE1-CH2 3.86Å; F51-W67 AromaticContact CE1-CZ2 3.75Å; F51-W67 HydrophobicContact CE1-CZ2 3.75Å; F51-W67 HydrophobicContact CZ-CH2 4.1Å; F51-W67 HydrophobicContact CZ-CZ2 4.08Å; F51-W75 AromaticContact CE1-CD1 3.65Å; F51-W75 HydrophobicContact CE1-CG 4.5Å; F51-W75 HydrophobicContact CE2-CB 4.08Å; F51-W75 AromaticContact CE2-CD1 3.93Å; F51-W75 HydrophobicContact CE2-CG 4.44Å; F51-W75 HydrophobicContact CZ-CB 3.81Å; F51-W75 AromaticContact CZ-CD1 3.54Å; F51-W75 HydrophobicContact CZ-CG 4.06Å; F51-W78 HydrophobicContact CB-CD2 3.97Å; F51-W78 HydrophobicContact CB-CE3 3.87Å; F51-W78 HydrophobicContact CB-CH2 3.9Å; F51-W78 HydrophobicContact CB-CZ2 3.92Å; F51-W78 HydrophobicContact CB-CZ3 3.87Å; F51-W78 HydrophobicContact CD2-CB 4.24Å; F51-W78 AromaticContact CD2-CD2 3.67Å; F51-W78 HydrophobicContact CD2-CD2 3.67Å; F51-W78 AromaticContact CD2-CE3 3.77Å; F51-W78 HydrophobicContact CD2-CE3 3.77Å; F51-W78 AromaticContact CD2-CG 3.84Å; F51-W78 HydrophobicContact CD2-CG 3.84Å; F51-W78 HydrophobicContact CE2-CB 4.48Å; F51-W78 HydrophobicContact CG-CD2 4.2Å; F51-W78 HydrophobicContact CG-CE3 4.03Å; F51-W78 HydrophobicContact CG-CZ3 4.39Å; F51-H123 AromaticContact CD1-CE1 3.67Å; F51-H123 AromaticContact CD1-NE2 3.68Å; F51-H123 AromaticContact CG-CE1 3.79Å; F51-L127 HydrophobicContact CD1-CD1 4.32Å; F51-L127 HydrophobicContact CD1-CD2 4.49Å; F51-L127 HydrophobicContact CE1-CD1 4.14Å
52	T	79.8	Confident	75.1	Confident	60 Å²	60	64.9 Å²	64.9	37%	0.368	35%	0.353	S	S	.	.	H	α-helix	trans	-57.5	-29.6	177.3	-39.1	0	0	0	0	113.2	G50 Q56	G50-T52 VanDerWaalsContact C-N 3.31Å; G50-T52 PolarHBondContact O-N 3.42Å; T52-Q56 WeakPolarHBondContact O-CG 3.37Å; T52-Q56 PolarHBondContact O-N 2.89Å
53	K	77.8	Confident	76	Confident	147 Å²	147	61.3 Å²	61.3	64%	0.639	34%	0.337	S	S	*	.	H	α-helix	trans	-77.2	-34.3	174.8	-62.9	167.9	-171.2	154.5	0	111.6	G50 F51 Q56 R57	G50-K53 PolarHBondContact O-N 2.84Å; F51-K53 PolarHBondContact O-N 3.23Å; F51-K53 VanDerWaalsContact O-N 3.11Å; K53-Q56 PolarHBondContact O-N 3.34Å; K53-R57 PolarHBondContact O-N 3.33Å
54	E	77.8	Confident	77.1	Confident	47 Å²	47	58.6 Å²	58.6	22%	0.22	32%	0.315	C	S	.	.	H	α-helix	trans	-73.3	-37	178.8	-160.8	69.2	163.8	0	0	111.3	F51 Q56 R57 L58	F51-E54 HydrophobicContact CD2-CB 4.18Å; F51-E54 CarbonylContact O-C 3.56Å; F51-E54 WeakPolarHBondContact O-CA 3.36Å; F51-E54 WeakPolarHBondContact O-CB 3.4Å; F51-E54 PolarHBondContact O-N 2.91Å; E54-Q56 VanDerWaalsContact C-N 3.3Å; E54-Q56 PolarHBondContact O-N 3.01Å; E54-R57 PolarHBondContact O-N 2.88Å; E54-R57 VanDerWaalsContact O-N 3.11Å; E54-R57 IonicContact OE1-CZ 3.32Å; E54-R57 IonicContact OE1-NE 3.16Å; E54-R57 PolarHBondContact OE1-NE 3.33Å; E54-R57 VanDerWaalsContact OE1-NE 3.16Å; E54-R57 IonicContact OE1-NH2 2.67Å; E54-R57 PolarHBondContact OE1-NH2 2.6Å; E54-R57 WeakPolarHBondContact OE2-CD 3.46Å; E54-R57 IonicContact OE2-CZ 3.71Å; E54-R57 IonicContact OE2-NE 2.78Å; E54-R57 PolarHBondContact OE2-NE 3.39Å; E54-R57 IonicContact OE2-NH2 3.81Å; E54-L58 HydrophobicContact CG-CD1 4.03Å; E54-L58 WeakPolarHBondContact O-CB 3.06Å; E54-L58 PolarHBondContact O-N 3.19Å
55	Q	82.5	Confident	78	Confident	14 Å²	14	65.1 Å²	65.1	7%	0.065	34%	0.338	C	S	.	.	H	α-helix	trans	-56.2	-44	167.4	-69.2	177.1	-68.2	0	0	111.7	F51 G59 I60 P61	F51-Q55 HydrophobicContact CD1-CG 3.8Å; F51-Q55 VanDerWaalsContact CE1-CD 3.46Å; F51-Q55 HydrophobicContact CE1-CG 3.43Å; F51-Q55 VanDerWaalsContact CE1-CG 3.43Å; F51-Q55 HydrophobicContact CE2-CG 4.2Å; F51-Q55 HydrophobicContact CG-CG 4.33Å; F51-Q55 HydrophobicContact CZ-CG 3.64Å; F51-Q55 PolarHBondContact O-N 2.61Å; Q55-G59 CarbonylContact O-C 3.56Å; Q55-G59 WeakPolarHBondContact O-CA 3.2Å; Q55-G59 PolarHBondContact O-N 3.04Å; Q55-I60 HydrophobicContact CB-CB 4.32Å; Q55-I60 HydrophobicContact CG-CB 4.16Å; Q55-I60 HydrophobicContact CG-CG2 4.27Å; Q55-I60 PolarHBondContact O-N 3.4Å; Q55-I60 VanDerWaalsContact O-N 3.08Å; Q55-P61 PolarHBondContact NE2-O 3.37Å
56	Q	79.6	Confident	78.9	Confident	159 Å²	159	66.8 Å²	66.8	74%	0.743	35%	0.347	S	S	*	.	H	α-helix	trans	-67.9	-34.2	174.7	-70.9	177	1.1	0	0	113.2	T52 K53 E54	T52-Q56 WeakPolarHBondContact O-CG 3.37Å; T52-Q56 PolarHBondContact O-N 2.89Å; K53-Q56 PolarHBondContact O-N 3.34Å; E54-Q56 VanDerWaalsContact C-N 3.3Å; E54-Q56 PolarHBondContact O-N 3.01Å
57	R	82.6	Confident	80	Confident	152 Å²	152	63.9 Å²	63.9	57%	0.574	32%	0.322	S	S	*	.	H	α-helix	trans	-71	-39.3	178.7	-169.6	-174.6	70.6	74.2	-6.6	112.7	K53 E54	K53-R57 PolarHBondContact O-N 3.33Å; E54-R57 PolarHBondContact O-N 2.88Å; E54-R57 VanDerWaalsContact O-N 3.11Å; E54-R57 IonicContact OE1-CZ 3.32Å; E54-R57 IonicContact OE1-NE 3.16Å; E54-R57 PolarHBondContact OE1-NE 3.33Å; E54-R57 VanDerWaalsContact OE1-NE 3.16Å; E54-R57 IonicContact OE1-NH2 2.67Å; E54-R57 PolarHBondContact OE1-NH2 2.6Å; E54-R57 WeakPolarHBondContact OE2-CD 3.46Å; E54-R57 IonicContact OE2-CZ 3.71Å; E54-R57 IonicContact OE2-NE 2.78Å; E54-R57 PolarHBondContact OE2-NE 3.39Å; E54-R57 IonicContact OE2-NH2 3.81Å
58	L	79.3	Confident	81.1	Confident	56 Å²	56	65 Å²	65	29%	0.293	33%	0.329	S	S	.	.	H	α-helix	trans	-100.2	-8.7	-174.2	-69.6	175.2	0	0	0	113.9	E54 I60 E74	E54-L58 HydrophobicContact CG-CD1 4.03Å; E54-L58 WeakPolarHBondContact O-CB 3.06Å; E54-L58 PolarHBondContact O-N 3.19Å; L58-I60 VanDerWaalsContact C-N 3.31Å; L58-I60 HydrophobicContact CB-CD1 3.93Å; L58-I60 HydrophobicContact CB-CG1 3.88Å; L58-I60 HydrophobicContact CD1-CD1 3.89Å; L58-E74 HydrophobicContact CD1-CB 3.92Å; L58-E74 HydrophobicContact CD1-CG 3.98Å; L58-E74 WeakPolarHBondContact CD1-OE2 3.31Å
59	G	82.1	Confident	81.8	Confident	57 Å²	57	70.2 Å²	70.2	59%	0.588	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	19	-176.1	0	0	0	0	0	114.1	Q55	Q55-G59 CarbonylContact O-C 3.56Å; Q55-G59 WeakPolarHBondContact O-CA 3.2Å; Q55-G59 PolarHBondContact O-N 3.04Å
60	I	86.1	Confident	82.8	Confident	8 Å²	8	71.6 Å²	71.6	4%	0.041	36%	0.355	C	S	.	.			trans	-67.8	129.1	179.3	-60.7	166.5	0	0	0	108.8	F51 Q55 L58 W67 H71 E74	F51-I60 HydrophobicContact CE2-CD1 4.35Å; F51-I60 HydrophobicContact CZ-CD1 4.3Å; Q55-I60 HydrophobicContact CB-CB 4.32Å; Q55-I60 HydrophobicContact CG-CB 4.16Å; Q55-I60 HydrophobicContact CG-CG2 4.27Å; Q55-I60 PolarHBondContact O-N 3.4Å; Q55-I60 VanDerWaalsContact O-N 3.08Å; L58-I60 VanDerWaalsContact C-N 3.31Å; L58-I60 HydrophobicContact CB-CD1 3.93Å; L58-I60 HydrophobicContact CB-CG1 3.88Å; L58-I60 HydrophobicContact CD1-CD1 3.89Å; I60-W67 HydrophobicContact CG2-CD2 4.27Å; I60-W67 HydrophobicContact CG2-CG 4.26Å; I60-W67 HydrophobicContact CG2-CZ2 4.31Å; I60-W67 VanDerWaalsContact CG2-NE1 3.34Å; I60-H71 HydrophobicContact CG1-CB 4.24Å; I60-H71 HydrophobicContact CG2-CB 4.02Å; I60-E74 HydrophobicContact CD1-CB 3.98Å
61	P	84.3	Confident	83.5	Confident	33 Å²	33	72.5 Å²	72.5	21%	0.214	35%	0.354	C	S	.	.			trans	-55.8	154.7	175.6	-27.4	36.1	0	0	0	113.2	Q55 Q66 W67 H71	Q55-P61 PolarHBondContact NE2-O 3.37Å; P61-Q66 HydrophobicContact CB-CB 3.77Å; P61-Q66 HydrophobicContact CG-CB 3.96Å; P61-W67 PolarHBondContact O-NE1 2.96Å; P61-H71 VanDerWaalsContact CD-ND1 3.33Å; P61-H71 WeakPolarHBondContact CD-ND1 3.35Å
62	K	79.2	Confident	83.9	Confident	146 Å²	146	72.4 Å²	72.4	64%	0.635	35%	0.354	S	S	*	.	S	Bend	trans	-67.1	-53.5	174	-72.8	-170.5	173.1	-169.5	0	111.7	P64	K62-P64 VanDerWaalsContact O-CD 3.31Å; K62-P64 WeakPolarHBondContact O-CD 3.36Å
63	D	82.4	Confident	84.2	Confident	34 Å²	34	71.8 Å²	71.8	18%	0.182	35%	0.354	C	S	.	.	S	Bend	trans	-63.9	117.1	175	173.7	13.9	0	0	0	111.3	R65 Q66	D63-R65 PolarHBondContact O-N 3.35Å; D63-R65 VanDerWaalsContact OD1-CB 3.24Å; D63-R65 WeakPolarHBondContact OD1-CB 3.39Å; D63-R65 WeakPolarHBondContact OD1-CG 3.16Å; D63-R65 PolarHBondContact OD1-N 2.81Å; D63-Q66 HydrophobicContact CB-CG 4.29Å; D63-Q66 PolarHBondContact O-N 3.28Å; D63-Q66 VanDerWaalsContact O-N 3.12Å; D63-Q66 WeakPolarHBondContact OD2-CG 3.4Å; D63-Q66 PolarHBondContact OD2-NE2 2.92Å
64	P	85.6	Confident	84.5	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-59.9	-24	176.6	-25	36.4	0	0	0	114.2	K62 Q66 W67 G97 L124 L127 Q128	K62-P64 VanDerWaalsContact O-CD 3.31Å; K62-P64 WeakPolarHBondContact O-CD 3.36Å; P64-Q66 PolarHBondContact O-N 3.24Å; P64-W67 HydrophobicContact CB-CD2 4.18Å; P64-W67 HydrophobicContact CB-CE3 4.33Å; P64-W67 HydrophobicContact CB-CH2 4.39Å; P64-W67 HydrophobicContact CB-CZ2 4.23Å; P64-W67 HydrophobicContact CB-CZ3 4.42Å; P64-W67 HydrophobicContact CG-CH2 4.41Å; P64-W67 HydrophobicContact CG-CZ2 4.13Å; P64-W67 VanDerWaalsContact O-CB 3.31Å; P64-W67 WeakPolarHBondContact O-CB 3.2Å; P64-W67 PolarHBondContact O-N 3.43Å; P64-W67 VanDerWaalsContact O-N 3.1Å; P64-G97 CarbonylContact O-C 3.39Å; P64-G97 VanDerWaalsContact O-CA 3.25Å; P64-G97 WeakPolarHBondContact O-CA 3.23Å; P64-L124 HydrophobicContact CB-CD1 3.66Å; P64-L124 HydrophobicContact CG-CD1 4.03Å; P64-L127 HydrophobicContact CG-CB 3.46Å; P64-L127 VanDerWaalsContact CG-CB 3.46Å; P64-L127 HydrophobicContact CG-CD1 4.33Å; P64-Q128 HydrophobicContact CG-CG 4.26Å
65	R	86.3	Confident	85	Confident	153 Å²	153	65.9 Å²	65.9	58%	0.577	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-68.8	-18.5	179.2	-57.5	170.9	179.4	-156.8	-3.4	112.5	D63 C101	D63-R65 PolarHBondContact O-N 3.35Å; D63-R65 VanDerWaalsContact OD1-CB 3.24Å; D63-R65 WeakPolarHBondContact OD1-CB 3.39Å; D63-R65 WeakPolarHBondContact OD1-CG 3.16Å; D63-R65 PolarHBondContact OD1-N 2.81Å; R65-C101 HydrophobicContact CG-CB 4.15Å
66	Q	85.6	Confident	85.1	Confident	124 Å²	124	65.3 Å²	65.3	58%	0.579	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-93.1	3.4	176.4	-65.1	170.2	47.7	0	0	112.7	P61 D63 P64	P61-Q66 HydrophobicContact CB-CB 3.77Å; P61-Q66 HydrophobicContact CG-CB 3.96Å; D63-Q66 HydrophobicContact CB-CG 4.29Å; D63-Q66 PolarHBondContact O-N 3.28Å; D63-Q66 VanDerWaalsContact O-N 3.12Å; D63-Q66 WeakPolarHBondContact OD2-CG 3.4Å; D63-Q66 PolarHBondContact OD2-NE2 2.92Å; P64-Q66 PolarHBondContact O-N 3.24Å
67	W	90.6	Very high	85.3	Confident	5 Å²	5	59.6 Å²	59.6	2%	0.019	31%	0.306	C	S	.	.			trans	-75.5	131.2	179.9	-68.1	4.7	0	0	0	112.2	F51 I60 P61 P64 H71 V72 W75 G97 L127	F51-W67 AromaticContact CE1-CH2 3.86Å; F51-W67 HydrophobicContact CE1-CH2 3.86Å; F51-W67 AromaticContact CE1-CZ2 3.75Å; F51-W67 HydrophobicContact CE1-CZ2 3.75Å; F51-W67 HydrophobicContact CZ-CH2 4.1Å; F51-W67 HydrophobicContact CZ-CZ2 4.08Å; I60-W67 HydrophobicContact CG2-CD2 4.27Å; I60-W67 HydrophobicContact CG2-CG 4.26Å; I60-W67 HydrophobicContact CG2-CZ2 4.31Å; I60-W67 VanDerWaalsContact CG2-NE1 3.34Å; P61-W67 PolarHBondContact O-NE1 2.96Å; P64-W67 HydrophobicContact CB-CD2 4.18Å; P64-W67 HydrophobicContact CB-CE3 4.33Å; P64-W67 HydrophobicContact CB-CH2 4.39Å; P64-W67 HydrophobicContact CB-CZ2 4.23Å; P64-W67 HydrophobicContact CB-CZ3 4.42Å; P64-W67 HydrophobicContact CG-CH2 4.41Å; P64-W67 HydrophobicContact CG-CZ2 4.13Å; P64-W67 VanDerWaalsContact O-CB 3.31Å; P64-W67 WeakPolarHBondContact O-CB 3.2Å; P64-W67 PolarHBondContact O-N 3.43Å; P64-W67 VanDerWaalsContact O-N 3.1Å; W67-H71 HydrophobicContact CB-CB 3.71Å; W67-H71 HydrophobicContact CD2-CB 4.48Å; W67-H71 HydrophobicContact CG-CB 3.91Å; W67-V72 HydrophobicContact CB-CG2 4.18Å; W67-V72 HydrophobicContact CE3-CG2 4.12Å; W67-W75 HydrophobicContact CE3-CB 4.35Å; W67-W75 HydrophobicContact CE3-CG 4.48Å; W67-W75 HydrophobicContact CH2-CB 3.96Å; W67-W75 AromaticContact CH2-CD1 3.49Å; W67-W75 VanDerWaalsContact CH2-CD1 3.49Å; W67-W75 HydrophobicContact CH2-CD2 4.01Å; W67-W75 AromaticContact CH2-CG 3.55Å; W67-W75 HydrophobicContact CH2-CG 3.55Å; W67-W75 AromaticContact CH2-NE1 3.83Å; W67-W75 HydrophobicContact CZ3-CB 3.66Å; W67-W75 AromaticContact CZ3-CD1 3.84Å; W67-W75 AromaticContact CZ3-CD2 3.57Å; W67-W75 HydrophobicContact CZ3-CD2 3.57Å; W67-W75 HydrophobicContact CZ3-CE3 4.04Å; W67-W75 AromaticContact CZ3-CG 3.4Å; W67-W75 HydrophobicContact CZ3-CG 3.4Å; W67-W75 VanDerWaalsContact CZ3-CG 3.4Å; W67-G97 PolarHBondContact O-N 3.33Å; W67-L127 HydrophobicContact CH2-CD1 3.58Å; W67-L127 HydrophobicContact CZ2-CD1 3.83Å
68	T	88.7	Confident	85.5	Confident	68 Å²	68	53.4 Å²	53.4	42%	0.417	28%	0.283	S	S	.	.			trans	-71.4	166.7	164.6	65.1	0	0	0	0	109.9	N70 H71 V72	T68-N70 PolarHBondContact O-N 3.3Å; T68-H71 PolarHBondContact N-ND1 3.47Å; T68-H71 WeakPolarHBondContact O-CB 3.47Å; T68-H71 PolarHBondContact O-N 3Å; T68-H71 PolarHBondContact OG1-CD2 3.48Å; T68-H71 VanDerWaalsContact OG1-CD2 3.22Å; T68-H71 PolarHBondContact OG1-N 3.45Å; T68-H71 VanDerWaalsContact OG1-N 3.16Å; T68-V72 PolarHBondContact O-N 3.32Å
69	E	87.9	Confident	85.7	Confident	118 Å²	118	50.8 Å²	50.8	55%	0.551	27%	0.269	S	S	*	.	H	α-helix	trans	-54.7	-38.6	171.3	-174.5	177	176.1	0	0	112.2	H71 V72 A73 M95	E69-H71 VanDerWaalsContact C-N 3.35Å; E69-H71 PolarHBondContact O-N 3.11Å; E69-V72 PolarHBondContact O-N 2.75Å; E69-A73 PolarHBondContact O-N 3.04Å; E69-M95 WeakPolarHBondContact CA-O 3.38Å
70	N	87.1	Confident	85.6	Confident	101 Å²	101	49.4 Å²	49.4	54%	0.54	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-37.6	173	-162.6	120.1	0	0	0	112.1	T68 A73 E74	T68-N70 PolarHBondContact O-N 3.3Å; N70-A73 PolarHBondContact O-N 3.45Å; N70-E74 WeakPolarHBondContact ND2-CG 3.39Å; N70-E74 VanDerWaalsContact O-CG 3.25Å; N70-E74 WeakPolarHBondContact O-CG 3.37Å; N70-E74 PolarHBondContact O-N 3.02Å
71	H	87.8	Confident	85.4	Confident	39 Å²	39	54.5 Å²	54.5	18%	0.181	28%	0.275	C	S	.	.	H	α-helix	trans	-69.7	-35.2	177.7	-62.1	170.1	0	0	0	111.7	I60 P61 W67 T68 E69 W75	I60-H71 HydrophobicContact CG1-CB 4.24Å; I60-H71 HydrophobicContact CG2-CB 4.02Å; P61-H71 VanDerWaalsContact CD-ND1 3.33Å; P61-H71 WeakPolarHBondContact CD-ND1 3.35Å; W67-H71 HydrophobicContact CB-CB 3.71Å; W67-H71 HydrophobicContact CD2-CB 4.48Å; W67-H71 HydrophobicContact CG-CB 3.91Å; T68-H71 PolarHBondContact N-ND1 3.47Å; T68-H71 WeakPolarHBondContact O-CB 3.47Å; T68-H71 PolarHBondContact O-N 3Å; T68-H71 PolarHBondContact OG1-CD2 3.48Å; T68-H71 VanDerWaalsContact OG1-CD2 3.22Å; T68-H71 PolarHBondContact OG1-N 3.45Å; T68-H71 VanDerWaalsContact OG1-N 3.16Å; E69-H71 VanDerWaalsContact C-N 3.35Å; E69-H71 PolarHBondContact O-N 3.11Å; H71-W75 WeakPolarHBondContact O-CB 3.31Å; H71-W75 PolarHBondContact O-N 2.92Å
72	V	87.9	Confident	85.2	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-44.3	171.5	174.8	0	0	0	0	110.6	W67 T68 E69 W75 L76 F93 M95 L100	W67-V72 HydrophobicContact CB-CG2 4.18Å; W67-V72 HydrophobicContact CE3-CG2 4.12Å; T68-V72 PolarHBondContact O-N 3.32Å; E69-V72 PolarHBondContact O-N 2.75Å; V72-W75 PolarHBondContact O-N 2.87Å; V72-L76 WeakPolarHBondContact O-CB 3.25Å; V72-L76 PolarHBondContact O-N 3.01Å; V72-F93 HydrophobicContact CG1-CB 4.5Å; V72-M95 WeakPolarHBondContact CG2-O 3.36Å; V72-L100 HydrophobicContact CG1-CD1 4.39Å; V72-L100 HydrophobicContact CG1-CD2 4.04Å; V72-L100 HydrophobicContact CG2-CD2 4.15Å
73	A	86.1	Confident	85	Confident	46 Å²	46	52.4 Å²	52.4	38%	0.38	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176.9	0	0	0	0	0	113	E69 N70 L76 A77	E69-A73 PolarHBondContact O-N 3.04Å; N70-A73 PolarHBondContact O-N 3.45Å; A73-L76 PolarHBondContact O-N 3.31Å; A73-A77 VanDerWaalsContact O-CB 3.29Å; A73-A77 WeakPolarHBondContact O-CB 3.42Å; A73-A77 PolarHBondContact O-N 2.64Å
74	E	85.8	Confident	84.6	Confident	70 Å²	70	55.3 Å²	55.3	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-40.3	176.2	-68.5	-76.9	175.6	0	0	112.1	L58 I60 N70 A77 W78	L58-E74 HydrophobicContact CD1-CB 3.92Å; L58-E74 HydrophobicContact CD1-CG 3.98Å; L58-E74 WeakPolarHBondContact CD1-OE2 3.31Å; I60-E74 HydrophobicContact CD1-CB 3.98Å; N70-E74 WeakPolarHBondContact ND2-CG 3.39Å; N70-E74 VanDerWaalsContact O-CG 3.25Å; N70-E74 WeakPolarHBondContact O-CG 3.37Å; N70-E74 PolarHBondContact O-N 3.02Å; E74-A77 PolarHBondContact O-N 2.81Å; E74-W78 WeakPolarHBondContact O-CB 3.22Å; E74-W78 PolarHBondContact O-N 3.07Å
75	W	88.1	Confident	84	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-42.5	173	167.7	75	0	0	0	112.5	F51 W67 H71 V72 T79 L100 F108 L120 H123 L124	F51-W75 AromaticContact CE1-CD1 3.65Å; F51-W75 HydrophobicContact CE1-CG 4.5Å; F51-W75 HydrophobicContact CE2-CB 4.08Å; F51-W75 AromaticContact CE2-CD1 3.93Å; F51-W75 HydrophobicContact CE2-CG 4.44Å; F51-W75 HydrophobicContact CZ-CB 3.81Å; F51-W75 AromaticContact CZ-CD1 3.54Å; F51-W75 HydrophobicContact CZ-CG 4.06Å; W67-W75 HydrophobicContact CE3-CB 4.35Å; W67-W75 HydrophobicContact CE3-CG 4.48Å; W67-W75 HydrophobicContact CH2-CB 3.96Å; W67-W75 AromaticContact CH2-CD1 3.49Å; W67-W75 VanDerWaalsContact CH2-CD1 3.49Å; W67-W75 HydrophobicContact CH2-CD2 4.01Å; W67-W75 AromaticContact CH2-CG 3.55Å; W67-W75 HydrophobicContact CH2-CG 3.55Å; W67-W75 AromaticContact CH2-NE1 3.83Å; W67-W75 HydrophobicContact CZ3-CB 3.66Å; W67-W75 AromaticContact CZ3-CD1 3.84Å; W67-W75 AromaticContact CZ3-CD2 3.57Å; W67-W75 HydrophobicContact CZ3-CD2 3.57Å; W67-W75 HydrophobicContact CZ3-CE3 4.04Å; W67-W75 AromaticContact CZ3-CG 3.4Å; W67-W75 HydrophobicContact CZ3-CG 3.4Å; W67-W75 VanDerWaalsContact CZ3-CG 3.4Å; H71-W75 WeakPolarHBondContact O-CB 3.31Å; H71-W75 PolarHBondContact O-N 2.92Å; V72-W75 PolarHBondContact O-N 2.87Å; W75-T79 WeakPolarHBondContact O-CB 3.41Å; W75-T79 PolarHBondContact O-N 2.94Å; W75-T79 PolarHBondContact O-OG1 2.85Å; W75-L100 HydrophobicContact CE3-CD2 4.37Å; W75-L100 HydrophobicContact CH2-CD2 4.38Å; W75-L100 HydrophobicContact CZ3-CD2 3.85Å; W75-F108 HydrophobicContact CH2-CE2 4.26Å; W75-F108 AromaticContact CH2-CZ 3.99Å; W75-F108 HydrophobicContact CH2-CZ 3.99Å; W75-F108 HydrophobicContact CZ3-CZ 4.42Å; W75-L120 HydrophobicContact CH2-CB 4.16Å; W75-L120 HydrophobicContact CH2-CD2 3.89Å; W75-L120 HydrophobicContact CZ2-CD2 4.1Å; W75-L120 WeakPolarHBondContact CZ2-O 3.41Å; W75-L120 HydrophobicContact CZ3-CD2 4.24Å; W75-H123 AromaticContact CD1-CE1 3.82Å; W75-H123 AromaticContact CD1-ND1 3.88Å; W75-H123 AromaticContact CE2-ND1 4Å; W75-H123 HydrophobicContact CZ2-CB 4.31Å; W75-H123 AromaticContact NE1-CE1 3.41Å; W75-H123 PolarHBondContact NE1-CE1 2.81Å; W75-H123 AromaticContact NE1-CG 3.71Å; W75-H123 AromaticContact NE1-ND1 3.06Å; W75-H123 PolarHBondContact NE1-ND1 3.35Å; W75-L124 HydrophobicContact CH2-CB 4.28Å; W75-L124 HydrophobicContact CZ2-CB 4.11Å
76	L	84.8	Confident	82.7	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-45.8	177.5	-169.2	64.8	0	0	0	110.8	V72 A73 W78 T79 I80 V88 F90 F93 L120	V72-L76 WeakPolarHBondContact O-CB 3.25Å; V72-L76 PolarHBondContact O-N 3.01Å; A73-L76 PolarHBondContact O-N 3.31Å; L76-W78 PolarHBondContact O-N 3.08Å; L76-T79 PolarHBondContact O-N 2.87Å; L76-I80 HydrophobicContact CG-CD1 3.98Å; L76-I80 WeakPolarHBondContact O-CB 3.36Å; L76-I80 WeakPolarHBondContact O-CD1 3.25Å; L76-I80 WeakPolarHBondContact O-CG1 3.25Å; L76-I80 PolarHBondContact O-N 3.38Å; L76-V88 HydrophobicContact CD1-CG1 4Å; L76-V88 HydrophobicContact CD2-CG1 4.21Å; L76-V88 HydrophobicContact CG-CG1 4.24Å; L76-F90 HydrophobicContact CD2-CD1 4.1Å; L76-F93 HydrophobicContact CD2-CB 3.83Å; L76-F93 HydrophobicContact CD2-CD2 3.73Å; L76-F93 HydrophobicContact CD2-CG 3.92Å; L76-L120 HydrophobicContact CD1-CD1 3.85Å; L76-L120 HydrophobicContact CD1-CD2 3.74Å; L76-L120 HydrophobicContact CD1-CG 4.5Å
77	A	83.6	Confident	81.6	Confident	39 Å²	39	59.1 Å²	59.1	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-42.1	176	0	0	0	0	0	112.6	A73 E74 N81 F90	A73-A77 VanDerWaalsContact O-CB 3.29Å; A73-A77 WeakPolarHBondContact O-CB 3.42Å; A73-A77 PolarHBondContact O-N 2.64Å; E74-A77 PolarHBondContact O-N 2.81Å; A77-N81 WeakPolarHBondContact O-CB 3.24Å; A77-N81 PolarHBondContact O-N 2.9Å; A77-F90 HydrophobicContact CB-CE1 4.31Å
78	W	86.9	Confident	80.4	Confident	23 Å²	23	59.6 Å²	59.6	9%	0.087	32%	0.318	C	S	.	.	H	α-helix	trans	-59.3	-49.5	172.2	175.1	80.7	0	0	0	111.1	F48 F51 E74 L76 I80 N81 E82 F83 H123	F48-W78 HydrophobicContact CD1-CH2 4.16Å; F48-W78 HydrophobicContact CD1-CZ3 4.17Å; F51-W78 HydrophobicContact CB-CD2 3.97Å; F51-W78 HydrophobicContact CB-CE3 3.87Å; F51-W78 HydrophobicContact CB-CH2 3.9Å; F51-W78 HydrophobicContact CB-CZ2 3.92Å; F51-W78 HydrophobicContact CB-CZ3 3.87Å; F51-W78 HydrophobicContact CD2-CB 4.24Å; F51-W78 AromaticContact CD2-CD2 3.67Å; F51-W78 HydrophobicContact CD2-CD2 3.67Å; F51-W78 AromaticContact CD2-CE3 3.77Å; F51-W78 HydrophobicContact CD2-CE3 3.77Å; F51-W78 AromaticContact CD2-CG 3.84Å; F51-W78 HydrophobicContact CD2-CG 3.84Å; F51-W78 HydrophobicContact CE2-CB 4.48Å; F51-W78 HydrophobicContact CG-CD2 4.2Å; F51-W78 HydrophobicContact CG-CE3 4.03Å; F51-W78 HydrophobicContact CG-CZ3 4.39Å; E74-W78 WeakPolarHBondContact O-CB 3.22Å; E74-W78 PolarHBondContact O-N 3.07Å; L76-W78 PolarHBondContact O-N 3.08Å; W78-I80 VanDerWaalsContact C-N 3.35Å; W78-I80 PolarHBondContact O-N 3.46Å; W78-N81 PolarHBondContact O-N 2.79Å; W78-E82 HydrophobicContact CD2-CB 4.47Å; W78-E82 HydrophobicContact CH2-CB 4.09Å; W78-E82 HydrophobicContact CH2-CG 3.91Å; W78-E82 HydrophobicContact CZ2-CB 3.8Å; W78-E82 HydrophobicContact CZ2-CG 3.52Å; W78-E82 WeakPolarHBondContact O-CB 3.35Å; W78-E82 PolarHBondContact O-N 3.13Å; W78-F83 HydrophobicContact CH2-CE2 4.37Å; W78-F83 HydrophobicContact CZ3-CE2 4.43Å; W78-H123 AromaticContact CE3-CE1 3.98Å; W78-H123 AromaticContact CZ3-CE1 3.43Å; W78-H123 VanDerWaalsContact CZ3-CE1 3.43Å; W78-H123 WeakPolarHBondContact CZ3-CE1 3.3Å; W78-H123 AromaticContact CZ3-ND1 3.8Å
79	T	82.3	Confident	79.4	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-38.8	-177.5	-49.3	0	0	0	0	111.5	W75 L76 N81 F83 L85 L120	W75-T79 WeakPolarHBondContact O-CB 3.41Å; W75-T79 PolarHBondContact O-N 2.94Å; W75-T79 PolarHBondContact O-OG1 2.85Å; L76-T79 PolarHBondContact O-N 2.87Å; T79-N81 PolarHBondContact O-N 3.14Å; T79-F83 HydrophobicContact CG2-CD2 3.63Å; T79-F83 HydrophobicContact CG2-CE2 3.98Å; T79-F83 WeakPolarHBondContact O-CD2 3.36Å; T79-F83 PolarHBondContact O-N 3.43Å; T79-L85 HydrophobicContact CG2-CD1 4.41Å; T79-L120 HydrophobicContact CG2-CD2 3.66Å; T79-L120 HydrophobicContact CG2-CG 4.5Å
80	I	80.5	Confident	78.3	Confident	29 Å²	29	59.4 Å²	59.4	15%	0.149	31%	0.314	C	S	.	.	H	α-helix	trans	-59.6	-45.8	173.6	-70.4	161.9	0	0	0	111.3	L76 W78 S84 L85 V88 F90	L76-I80 HydrophobicContact CG-CD1 3.98Å; L76-I80 WeakPolarHBondContact O-CB 3.36Å; L76-I80 WeakPolarHBondContact O-CD1 3.25Å; L76-I80 WeakPolarHBondContact O-CG1 3.25Å; L76-I80 PolarHBondContact O-N 3.38Å; W78-I80 VanDerWaalsContact C-N 3.35Å; W78-I80 PolarHBondContact O-N 3.46Å; I80-S84 CarbonylContact O-C 3.54Å; I80-S84 WeakPolarHBondContact O-CA 3.4Å; I80-S84 PolarHBondContact O-N 3.05Å; I80-L85 HydrophobicContact CG1-CB 4.45Å; I80-L85 HydrophobicContact CG1-CD1 4.47Å; I80-L85 HydrophobicContact CG2-CB 4.45Å; I80-L85 PolarHBondContact O-N 3.1Å; I80-V88 HydrophobicContact CD1-CB 3.66Å; I80-V88 HydrophobicContact CD1-CG1 3.78Å; I80-V88 HydrophobicContact CD1-CG2 4.26Å; I80-V88 HydrophobicContact CG1-CB 3.9Å; I80-V88 HydrophobicContact CG1-CG1 4.2Å; I80-V88 HydrophobicContact CG1-CG2 3.91Å; I80-F90 HydrophobicContact CD1-CE1 3.65Å; I80-F90 HydrophobicContact CD1-CE2 4.01Å; I80-F90 HydrophobicContact CD1-CZ 3.34Å
81	N	81.4	Confident	77.2	Confident	114 Å²	114	63.1 Å²	63.1	61%	0.61	33%	0.328	S	S	*	.	H	α-helix	trans	-66.6	-49	178.5	174.9	93	0	0	0	112.1	A77 W78 T79 F83 S84	A77-N81 WeakPolarHBondContact O-CB 3.24Å; A77-N81 PolarHBondContact O-N 2.9Å; W78-N81 PolarHBondContact O-N 2.79Å; T79-N81 PolarHBondContact O-N 3.14Å; N81-F83 PolarHBondContact O-N 3.49Å; N81-S84 PolarHBondContact O-N 3.4Å
82	E	80.2	Confident	76.4	Confident	86 Å²	86	66 Å²	66	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-64.9	-42.1	-174.3	-163.6	74.9	-173.8	0	0	112	T47 W78	T47-E82 HydrophobicContact CG2-CG 3.46Å; T47-E82 VanDerWaalsContact CG2-CG 3.46Å; W78-E82 HydrophobicContact CD2-CB 4.47Å; W78-E82 HydrophobicContact CH2-CB 4.09Å; W78-E82 HydrophobicContact CH2-CG 3.91Å; W78-E82 HydrophobicContact CZ2-CB 3.8Å; W78-E82 HydrophobicContact CZ2-CG 3.52Å; W78-E82 WeakPolarHBondContact O-CB 3.35Å; W78-E82 PolarHBondContact O-N 3.13Å
83	F	76.1	Confident	75.9	Confident	49 Å²	49	66.3 Å²	66.3	22%	0.215	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	5.7	178.8	-66.6	-86.1	0	0	0	113.7	L44 T47 F48 W78 T79 N81 L85 I119	L44-F83 HydrophobicContact CD2-CD1 4.35Å; L44-F83 HydrophobicContact CD2-CE1 3.41Å; L44-F83 VanDerWaalsContact CD2-CE1 3.41Å; L44-F83 HydrophobicContact CD2-CZ 3.71Å; T47-F83 HydrophobicContact CG2-CE1 3.81Å; T47-F83 HydrophobicContact CG2-CE2 3.78Å; T47-F83 HydrophobicContact CG2-CZ 3.35Å; F48-F83 AromaticContact CD1-CE2 3.97Å; F48-F83 HydrophobicContact CD1-CE2 3.97Å; F48-F83 AromaticContact CD1-CZ 3.97Å; F48-F83 HydrophobicContact CD1-CZ 3.97Å; F48-F83 AromaticContact CE1-CE2 3.54Å; F48-F83 HydrophobicContact CE1-CE2 3.54Å; F48-F83 AromaticContact CE1-CZ 3.49Å; F48-F83 HydrophobicContact CE1-CZ 3.49Å; F48-F83 VanDerWaalsContact CE1-CZ 3.49Å; F48-F83 HydrophobicContact CZ-CZ 4.3Å; W78-F83 HydrophobicContact CH2-CE2 4.37Å; W78-F83 HydrophobicContact CZ3-CE2 4.43Å; T79-F83 HydrophobicContact CG2-CD2 3.63Å; T79-F83 HydrophobicContact CG2-CE2 3.98Å; T79-F83 WeakPolarHBondContact O-CD2 3.36Å; T79-F83 PolarHBondContact O-N 3.43Å; N81-F83 PolarHBondContact O-N 3.49Å; F83-L85 HydrophobicContact CB-CD1 4.13Å; F83-L85 HydrophobicContact CB-CD2 3.9Å; F83-L85 HydrophobicContact CB-CG 3.73Å; F83-L85 PolarHBondContact O-N 3.05Å; F83-I119 HydrophobicContact CD1-CG2 4.44Å; F83-I119 HydrophobicContact CD2-CG2 4.46Å; F83-I119 HydrophobicContact CE1-CG2 4.42Å; F83-I119 HydrophobicContact CE2-CG2 4.43Å; F83-I119 HydrophobicContact CG-CG2 4.46Å; F83-I119 HydrophobicContact CZ-CG2 4.39Å
84	S	73.3	Confident	75.5	Confident	96 Å²	96	66.2 Å²	66.2	67%	0.671	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	36	-178.9	-62.9	0	0	0	0	114.1	I80 N81	I80-S84 CarbonylContact O-C 3.54Å; I80-S84 WeakPolarHBondContact O-CA 3.4Å; I80-S84 PolarHBondContact O-N 3.05Å; N81-S84 PolarHBondContact O-N 3.4Å
85	L	72.9	Confident	75.4	Confident	31 Å²	31	64.5 Å²	64.5	16%	0.162	34%	0.337	C	S	.	.			trans	-68.2	146	-174.8	-56.7	170.8	0	0	0	110.7	T79 I80 F83 V88 V116	T79-L85 HydrophobicContact CG2-CD1 4.41Å; I80-L85 HydrophobicContact CG1-CB 4.45Å; I80-L85 HydrophobicContact CG1-CD1 4.47Å; I80-L85 HydrophobicContact CG2-CB 4.45Å; I80-L85 PolarHBondContact O-N 3.1Å; F83-L85 HydrophobicContact CB-CD1 4.13Å; F83-L85 HydrophobicContact CB-CD2 3.9Å; F83-L85 HydrophobicContact CB-CG 3.73Å; F83-L85 PolarHBondContact O-N 3.05Å; L85-V88 HydrophobicContact CB-CG2 4.08Å; L85-V88 HydrophobicContact CD1-CG2 4.45Å; L85-V116 HydrophobicContact CD1-CG1 3.68Å; L85-V116 HydrophobicContact CD2-CG1 4.26Å; L85-V116 HydrophobicContact CD2-CG2 4.25Å; L85-V116 HydrophobicContact CG-CG1 4.46Å
86	K	60.3	Low	75.3	Confident	173 Å²	173	67.6 Å²	67.6	75%	0.752	35%	0.354	S	S	*	.			trans	-119.1	149.3	176.1	-63.4	179.4	-176	173.6	0	109.3	V88	K86-V88 VanDerWaalsContact C-N 3.34Å; K86-V88 PolarHBondContact O-N 3.1Å
87	N	61.1	Low	75.4	Confident	153 Å²	153	67.5 Å²	67.5	82%	0.818	35%	0.353	S	S	*	.			trans	62.6	31.3	173.9	-46.7	-14.8	0	0	0	115.1	P113	N87-P113 WeakPolarHBondContact O-CG 3.44Å
88	V	65.7	Low	75.5	Confident	14 Å²	14	67.8 Å²	67.8	9%	0.085	36%	0.356	C	S	.	.			trans	-80.5	128.7	166.4	-177.4	0	0	0	0	109	L76 I80 L85 K86 P113 V116	L76-V88 HydrophobicContact CD1-CG1 4Å; L76-V88 HydrophobicContact CD2-CG1 4.21Å; L76-V88 HydrophobicContact CG-CG1 4.24Å; I80-V88 HydrophobicContact CD1-CB 3.66Å; I80-V88 HydrophobicContact CD1-CG1 3.78Å; I80-V88 HydrophobicContact CD1-CG2 4.26Å; I80-V88 HydrophobicContact CG1-CB 3.9Å; I80-V88 HydrophobicContact CG1-CG1 4.2Å; I80-V88 HydrophobicContact CG1-CG2 3.91Å; L85-V88 HydrophobicContact CB-CG2 4.08Å; L85-V88 HydrophobicContact CD1-CG2 4.45Å; K86-V88 VanDerWaalsContact C-N 3.34Å; K86-V88 PolarHBondContact O-N 3.1Å; V88-P113 HydrophobicContact CG2-CG 4.4Å; V88-V116 HydrophobicContact CG2-CG1 3.93Å
89	D	67.3	Low	75.4	Confident	74 Å²	74	71 Å²	71	40%	0.396	37%	0.374	S	S	.	.			trans	-97.1	107	-172.4	-171.5	-1.1	0	0	0	110.6	E91 K92	D89-E91 PolarHBondContact O-N 2.84Å; D89-K92 HydrophobicContact CB-CD 4.11Å; D89-K92 HydrophobicContact CB-CG 4.3Å; D89-K92 WeakPolarHBondContact OD2-CE 3.39Å; D89-K92 IonicContact OD2-NZ 2.75Å
90	F	64.9	Low	75.5	Confident	109 Å²	109	71 Å²	71	48%	0.478	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-67.4	-33	-171.1	-69.7	-92.7	0	0	0	113.1	L76 A77 I80 K92 F93	L76-F90 HydrophobicContact CD2-CD1 4.1Å; A77-F90 HydrophobicContact CB-CE1 4.31Å; I80-F90 HydrophobicContact CD1-CE1 3.65Å; I80-F90 HydrophobicContact CD1-CE2 4.01Å; I80-F90 HydrophobicContact CD1-CZ 3.34Å; F90-K92 VanDerWaalsContact C-N 3.25Å; F90-K92 PolarHBondContact O-N 3.46Å; F90-F93 PolarHBondContact O-N 3.03Å; F90-F93 VanDerWaalsContact O-N 3.13Å
91	E	64.9	Low	75.8	Confident	179 Å²	179	70.4 Å²	70.4	84%	0.836	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-68.7	-25.8	-174.6	-61.9	-163.7	161.7	0	0	112.4	D89 F93 G94	D89-E91 PolarHBondContact O-N 2.84Å; E91-F93 PolarHBondContact O-N 2.91Å; E91-G94 PolarHBondContact O-N 3.27Å
92	K	70.3	Confident	75.9	Confident	98 Å²	98	68.9 Å²	68.9	43%	0.426	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-67.6	-21.9	175.1	-63.9	-176.5	-179.2	173.8	0	113.6	D89 F90 L111	D89-K92 HydrophobicContact CB-CD 4.11Å; D89-K92 HydrophobicContact CB-CG 4.3Å; D89-K92 WeakPolarHBondContact OD2-CE 3.39Å; D89-K92 IonicContact OD2-NZ 2.75Å; F90-K92 VanDerWaalsContact C-N 3.25Å; F90-K92 PolarHBondContact O-N 3.46Å; K92-L111 HydrophobicContact CB-CB 4.44Å; K92-L111 WeakPolarHBondContact CD-O 3.47Å
93	F	77.1	Confident	76	Confident	7 Å²	7	66.9 Å²	66.9	3%	0.031	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-104.7	17	-178.7	-66.5	-81.4	0	0	0	113.1	V72 L76 F90 E91 M95 L100 F108 L111 A112	V72-F93 HydrophobicContact CG1-CB 4.5Å; L76-F93 HydrophobicContact CD2-CB 3.83Å; L76-F93 HydrophobicContact CD2-CD2 3.73Å; L76-F93 HydrophobicContact CD2-CG 3.92Å; F90-F93 PolarHBondContact O-N 3.03Å; F90-F93 VanDerWaalsContact O-N 3.13Å; E91-F93 PolarHBondContact O-N 2.91Å; F93-M95 PolarHBondContact O-N 3.32Å; F93-L100 HydrophobicContact CD1-CD1 3.94Å; F93-L100 HydrophobicContact CE1-CD1 4.46Å; F93-F108 HydrophobicContact CD1-CE2 4.49Å; F93-F108 HydrophobicContact CE1-CD2 4.35Å; F93-F108 HydrophobicContact CE1-CE1 4.35Å; F93-F108 AromaticContact CE1-CE2 3.83Å; F93-F108 HydrophobicContact CE1-CE2 3.83Å; F93-F108 AromaticContact CE1-CZ 3.79Å; F93-F108 HydrophobicContact CE1-CZ 3.79Å; F93-F108 HydrophobicContact CZ-CZ 4.35Å; F93-L111 HydrophobicContact CE1-CB 4.37Å; F93-L111 HydrophobicContact CZ-CB 4.04Å; F93-A112 HydrophobicContact CZ-CB 4.17Å
94	G	78	Confident	76.2	Confident	45 Å²	45	66 Å²	66	46%	0.464	37%	0.371	S	S	.	.			trans	-67	68.3	170.5	0	0	0	0	0	112.9	E91	E91-G94 PolarHBondContact O-N 3.27Å
95	M	83.6	Confident	76.6	Confident	34 Å²	34	65 Å²	65	17%	0.167	36%	0.355	C	S	.	.	S	Bend	trans	-149.6	158.6	178.6	68.1	-178	81.4	0	0	111.2	E69 V72 F93 N99 L100 M103 L111	E69-M95 WeakPolarHBondContact CA-O 3.38Å; V72-M95 WeakPolarHBondContact CG2-O 3.36Å; F93-M95 PolarHBondContact O-N 3.32Å; M95-N99 HydrophobicContact CB-CB 4.25Å; M95-N99 HydrophobicContact CG-CB 4.44Å; M95-N99 HydrophobicContact SD-CB 4.15Å; M95-L100 HydrophobicContact CG-CB 4.43Å; M95-L100 HydrophobicContact CG-CD1 4.09Å; M95-L100 HydrophobicContact SD-CB 4.27Å; M95-L100 HydrophobicContact SD-CD1 3.83Å; M95-M103 HydrophobicContact CE-CE 4.33Å; M95-M103 HydrophobicContact CE-SD 4.47Å; M95-M103 HydrophobicContact SD-SD 4.14Å; M95-L111 HydrophobicContact CE-CD1 3.82Å
96	N	86.4	Confident	76.9	Confident	65 Å²	65	71.2 Å²	71.2	35%	0.348	38%	0.383	S	S	.	.			trans	-73.8	161.3	171.3	68.7	37.3	0	0	0	111.6	A98 N99 L100	N96-A98 VanDerWaalsContact C-N 3.27Å; N96-A98 PolarHBondContact O-N 3.09Å; N96-A98 WeakPolarHBondContact OD1-CB 3.28Å; N96-A98 PolarHBondContact OD1-N 3.24Å; N96-N99 PolarHBondContact O-N 3.19Å; N96-N99 VanDerWaalsContact OD1-CG 3.3Å; N96-N99 PolarHBondContact OD1-N 3.22Å; N96-N99 PolarHBondContact OD1-OD1 3.22Å; N96-L100 PolarHBondContact O-N 3.31Å
97	G	86.3	Confident	77.8	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-70.2	-20.4	-176.8	0	0	0	0	0	114.7	P64 W67 L100 C101	P64-G97 CarbonylContact O-C 3.39Å; P64-G97 VanDerWaalsContact O-CA 3.25Å; P64-G97 WeakPolarHBondContact O-CA 3.23Å; W67-G97 PolarHBondContact O-N 3.33Å; G97-L100 PolarHBondContact O-N 3.15Å; G97-C101 WeakPolarHBondContact O-CB 3.1Å; G97-C101 PolarHBondContact O-N 2.99Å; G97-C101 PolarHBondContact O-SG 3.18Å
98	A	85.6	Confident	78.9	Confident	45 Å²	45	63.3 Å²	63.3	37%	0.372	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-45.9	171	0	0	0	0	0	111.2	N96 C101 A102	N96-A98 VanDerWaalsContact C-N 3.27Å; N96-A98 PolarHBondContact O-N 3.09Å; N96-A98 WeakPolarHBondContact OD1-CB 3.28Å; N96-A98 PolarHBondContact OD1-N 3.24Å; A98-C101 PolarHBondContact O-N 2.88Å; A98-A102 VanDerWaalsContact O-CB 3.27Å; A98-A102 WeakPolarHBondContact O-CB 3.36Å; A98-A102 PolarHBondContact O-N 2.66Å
99	N	84.6	Confident	79.7	Confident	90 Å²	90	65.7 Å²	65.7	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-64.7	-42.5	173.4	-68.5	-3.2	0	0	0	111.2	M95 N96 C101 A102 M103	M95-N99 HydrophobicContact CB-CB 4.25Å; M95-N99 HydrophobicContact CG-CB 4.44Å; M95-N99 HydrophobicContact SD-CB 4.15Å; N96-N99 PolarHBondContact O-N 3.19Å; N96-N99 VanDerWaalsContact OD1-CG 3.3Å; N96-N99 PolarHBondContact OD1-N 3.22Å; N96-N99 PolarHBondContact OD1-OD1 3.22Å; N99-C101 VanDerWaalsContact C-N 3.3Å; N99-C101 PolarHBondContact O-N 2.63Å; N99-A102 PolarHBondContact O-N 2.57Å; N99-A102 VanDerWaalsContact O-N 3.08Å; N99-M103 PolarHBondContact O-N 2.88Å
100	L	85.2	Confident	80.3	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-59.5	-37.3	178	-161.3	77.5	0	0	0	112.8	V72 W75 F93 M95 N96 G97 M103 F108 L124	V72-L100 HydrophobicContact CG1-CD1 4.39Å; V72-L100 HydrophobicContact CG1-CD2 4.04Å; V72-L100 HydrophobicContact CG2-CD2 4.15Å; W75-L100 HydrophobicContact CE3-CD2 4.37Å; W75-L100 HydrophobicContact CH2-CD2 4.38Å; W75-L100 HydrophobicContact CZ3-CD2 3.85Å; F93-L100 HydrophobicContact CD1-CD1 3.94Å; F93-L100 HydrophobicContact CE1-CD1 4.46Å; M95-L100 HydrophobicContact CG-CB 4.43Å; M95-L100 HydrophobicContact CG-CD1 4.09Å; M95-L100 HydrophobicContact SD-CB 4.27Å; M95-L100 HydrophobicContact SD-CD1 3.83Å; N96-L100 PolarHBondContact O-N 3.31Å; G97-L100 PolarHBondContact O-N 3.15Å; L100-M103 HydrophobicContact CD1-SD 4.2Å; L100-M103 WeakPolarHBondContact O-CG 3.44Å; L100-F108 HydrophobicContact CD1-CD2 4.2Å; L100-F108 HydrophobicContact CD1-CE2 3.83Å; L100-F108 HydrophobicContact CG-CD2 4.46Å; L100-F108 HydrophobicContact CG-CE2 4.1Å; L100-L124 HydrophobicContact CD2-CD1 4.11Å; L100-L124 HydrophobicContact CD2-CD2 3.94Å; L100-L124 HydrophobicContact CG-CD2 3.89Å
101	C	85.8	Confident	80.8	Confident	17 Å²	17	64.1 Å²	64.1	12%	0.115	35%	0.346	C	S	.	.	H	α-helix	trans	-76	-34.6	173.5	-64.5	0	0	0	0	112.4	R65 G97 A98 N99	R65-C101 HydrophobicContact CG-CB 4.15Å; G97-C101 WeakPolarHBondContact O-CB 3.1Å; G97-C101 PolarHBondContact O-N 2.99Å; G97-C101 PolarHBondContact O-SG 3.18Å; A98-C101 PolarHBondContact O-N 2.88Å; N99-C101 VanDerWaalsContact C-N 3.3Å; N99-C101 PolarHBondContact O-N 2.63Å
102	A	84.4	Confident	81.3	Confident	82 Å²	82	56.2 Å²	56.2	68%	0.678	31%	0.311	S	S	*	.	H	α-helix	trans	-76.9	-22.8	-174.9	0	0	0	0	0	114.2	A98 N99 G104	A98-A102 VanDerWaalsContact O-CB 3.27Å; A98-A102 WeakPolarHBondContact O-CB 3.36Å; A98-A102 PolarHBondContact O-N 2.66Å; N99-A102 PolarHBondContact O-N 2.57Å; N99-A102 VanDerWaalsContact O-N 3.08Å; A102-G104 VanDerWaalsContact C-N 3.3Å; A102-G104 PolarHBondContact O-N 2.98Å
103	M	81.7	Confident	81.4	Confident	44 Å²	44	53.4 Å²	53.4	22%	0.217	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-24.6	-176.4	73.2	-166.9	-57.5	0	0	114.3	M95 N99 L100 R107 F108 L111	M95-M103 HydrophobicContact CE-CE 4.33Å; M95-M103 HydrophobicContact CE-SD 4.47Å; M95-M103 HydrophobicContact SD-SD 4.14Å; N99-M103 PolarHBondContact O-N 2.88Å; L100-M103 HydrophobicContact CD1-SD 4.2Å; L100-M103 WeakPolarHBondContact O-CG 3.44Å; M103-R107 HydrophobicContact CB-CB 4.11Å; M103-R107 HydrophobicContact CE-CB 4.03Å; M103-R107 VanDerWaalsContact CE-O 3.22Å; M103-R107 WeakPolarHBondContact CE-O 3.31Å; M103-R107 HydrophobicContact CG-CB 4.43Å; M103-R107 WeakPolarHBondContact O-CB 3.3Å; M103-R107 WeakPolarHBondContact O-CG 3.26Å; M103-F108 HydrophobicContact CE-CB 4.46Å; M103-F108 HydrophobicContact CG-CB 4.3Å; M103-F108 HydrophobicContact SD-CB 4.12Å; M103-F108 HydrophobicContact SD-CD2 3.85Å; M103-F108 HydrophobicContact SD-CG 4.44Å; M103-L111 HydrophobicContact CE-CD1 3.56Å; M103-L111 HydrophobicContact CE-CG 4.16Å
104	G	81.2	Confident	80.9	Confident	29 Å²	29	59.7 Å²	59.7	30%	0.299	34%	0.337	S	S	.	.	H	α-helix	trans	75.1	163.6	-177.5	0	0	0	0	0	114.2	A102 E106 R107 F108 W121	A102-G104 VanDerWaalsContact C-N 3.3Å; A102-G104 PolarHBondContact O-N 2.98Å; G104-E106 PolarHBondContact O-N 3.25Å; G104-R107 PolarHBondContact O-N 3.37Å; G104-F108 PolarHBondContact O-N 2.93Å; G104-W121 VanDerWaalsContact C-CH2 3.49Å
105	K	81	Confident	80.4	Confident	77 Å²	77	65.5 Å²	65.5	34%	0.335	35%	0.349	S	S	.	.	H	α-helix	trans	-58.1	-45.7	-169.9	-175.2	168.6	-178.5	164.4	0	113.4	R107 F108 L109 D118 W121	K105-R107 PolarHBondContact O-N 2.72Å; K105-F108 WeakPolarHBondContact O-CB 3.45Å; K105-F108 PolarHBondContact O-N 2.69Å; K105-F108 VanDerWaalsContact O-N 3.16Å; K105-L109 HydrophobicContact CG-CD1 4.23Å; K105-L109 HydrophobicContact CG-CG 4.25Å; K105-L109 WeakPolarHBondContact O-CG 3.41Å; K105-L109 PolarHBondContact O-N 2.52Å; K105-D118 VanDerWaalsContact CE-OD1 3.23Å; K105-D118 WeakPolarHBondContact CE-OD1 3.35Å; K105-D118 IonicContact NZ-OD1 2.86Å; K105-D118 PolarHBondContact NZ-OD1 3.16Å; K105-W121 HydrophobicContact CB-CD2 3.92Å; K105-W121 HydrophobicContact CB-CE3 4.49Å; K105-W121 HydrophobicContact CB-CG 4.34Å; K105-W121 HydrophobicContact CB-CH2 4.46Å; K105-W121 HydrophobicContact CB-CZ2 3.88Å; K105-W121 HydrophobicContact CD-CG 4.03Å; K105-W121 HydrophobicContact CG-CD2 3.94Å; K105-W121 HydrophobicContact CG-CG 3.85Å
106	E	79.9	Confident	79.9	Confident	161 Å²	161	64.7 Å²	64.7	75%	0.752	35%	0.346	S	S	*	.	H	α-helix	trans	-60.8	-46.9	-175.6	-61.1	-178.6	142.9	0	0	111.5	G104 F108 L109 D110	G104-E106 PolarHBondContact O-N 3.25Å; E106-F108 VanDerWaalsContact C-N 3.31Å; E106-F108 PolarHBondContact O-N 2.87Å; E106-L109 PolarHBondContact O-N 3.16Å; E106-D110 PolarHBondContact O-N 3.32Å
107	R	79.6	Confident	79.6	Confident	160 Å²	160	61.6 Å²	61.6	60%	0.604	33%	0.33	S	S	*	.	H	α-helix	trans	-69.7	-27.6	176.4	-60.9	-49.6	-168.3	-172	-1.2	113.6	M103 G104 K105 D110	M103-R107 HydrophobicContact CB-CB 4.11Å; M103-R107 HydrophobicContact CE-CB 4.03Å; M103-R107 VanDerWaalsContact CE-O 3.22Å; M103-R107 WeakPolarHBondContact CE-O 3.31Å; M103-R107 HydrophobicContact CG-CB 4.43Å; M103-R107 WeakPolarHBondContact O-CB 3.3Å; M103-R107 WeakPolarHBondContact O-CG 3.26Å; G104-R107 PolarHBondContact O-N 3.37Å; K105-R107 PolarHBondContact O-N 2.72Å; R107-D110 WeakPolarHBondContact CD-OD2 3.33Å; R107-D110 IonicContact CZ-OD2 3.98Å; R107-D110 IonicContact NE-OD2 3.16Å; R107-D110 IonicContact NH1-OD2 2.88Å; R107-D110 PolarHBondContact NH1-OD2 3.24Å
108	F	84.1	Confident	79.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-68.1	-42.4	173	-171.2	-78.3	0	0	0	110.9	W75 F93 L100 M103 G104 K105 E106 L111 A112 L120 W121 L124	W75-F108 HydrophobicContact CH2-CE2 4.26Å; W75-F108 AromaticContact CH2-CZ 3.99Å; W75-F108 HydrophobicContact CH2-CZ 3.99Å; W75-F108 HydrophobicContact CZ3-CZ 4.42Å; F93-F108 HydrophobicContact CD1-CE2 4.49Å; F93-F108 HydrophobicContact CE1-CD2 4.35Å; F93-F108 HydrophobicContact CE1-CE1 4.35Å; F93-F108 AromaticContact CE1-CE2 3.83Å; F93-F108 HydrophobicContact CE1-CE2 3.83Å; F93-F108 AromaticContact CE1-CZ 3.79Å; F93-F108 HydrophobicContact CE1-CZ 3.79Å; F93-F108 HydrophobicContact CZ-CZ 4.35Å; L100-F108 HydrophobicContact CD1-CD2 4.2Å; L100-F108 HydrophobicContact CD1-CE2 3.83Å; L100-F108 HydrophobicContact CG-CD2 4.46Å; L100-F108 HydrophobicContact CG-CE2 4.1Å; M103-F108 HydrophobicContact CE-CB 4.46Å; M103-F108 HydrophobicContact CG-CB 4.3Å; M103-F108 HydrophobicContact SD-CB 4.12Å; M103-F108 HydrophobicContact SD-CD2 3.85Å; M103-F108 HydrophobicContact SD-CG 4.44Å; G104-F108 PolarHBondContact O-N 2.93Å; K105-F108 WeakPolarHBondContact O-CB 3.45Å; K105-F108 PolarHBondContact O-N 2.69Å; K105-F108 VanDerWaalsContact O-N 3.16Å; E106-F108 VanDerWaalsContact C-N 3.31Å; E106-F108 PolarHBondContact O-N 2.87Å; F108-L111 PolarHBondContact O-N 2.84Å; F108-A112 PolarHBondContact O-N 2.89Å; F108-L120 HydrophobicContact CE1-CB 3.58Å; F108-L120 HydrophobicContact CE1-CD1 4.36Å; F108-L120 HydrophobicContact CZ-CB 3.65Å; F108-L120 HydrophobicContact CZ-CD1 4.37Å; F108-W121 HydrophobicContact CB-CE3 3.5Å; F108-W121 VanDerWaalsContact CB-CE3 3.5Å; F108-W121 HydrophobicContact CB-CZ3 3.75Å; F108-W121 HydrophobicContact CD1-CB 4.21Å; F108-W121 HydrophobicContact CD1-CE3 4.03Å; F108-W121 AromaticContact CD2-CE3 3.76Å; F108-W121 HydrophobicContact CD2-CE3 3.76Å; F108-W121 HydrophobicContact CD2-CZ3 4.03Å; F108-W121 HydrophobicContact CE1-CB 4.47Å; F108-W121 AromaticContact CG-CE3 3.48Å; F108-W121 HydrophobicContact CG-CE3 3.48Å; F108-W121 VanDerWaalsContact CG-CE3 3.48Å; F108-W121 HydrophobicContact CG-CZ3 4.02Å; F108-L124 HydrophobicContact CD2-CD2 4.19Å; F108-L124 HydrophobicContact CE2-CD2 4Å
109	L	81.6	Confident	79.1	Confident	63 Å²	63	64.8 Å²	64.8	33%	0.33	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-39.2	174.1	-67	-176.5	0	0	0	111.9	K105 E106 L111 A112	K105-L109 HydrophobicContact CG-CD1 4.23Å; K105-L109 HydrophobicContact CG-CG 4.25Å; K105-L109 WeakPolarHBondContact O-CG 3.41Å; K105-L109 PolarHBondContact O-N 2.52Å; E106-L109 PolarHBondContact O-N 3.16Å; L109-L111 PolarHBondContact O-N 2.73Å; L109-L111 VanDerWaalsContact O-N 3.09Å; L109-A112 PolarHBondContact O-N 2.8Å
110	D	79.5	Confident	79.1	Confident	101 Å²	101	60.6 Å²	60.6	54%	0.54	32%	0.318	S	S	.	.	H	α-helix	trans	-54.9	-26.6	175.1	-71.7	-24.9	0	0	0	113.8	E106 R107	E106-D110 PolarHBondContact O-N 3.32Å; R107-D110 WeakPolarHBondContact CD-OD2 3.33Å; R107-D110 IonicContact CZ-OD2 3.98Å; R107-D110 IonicContact NE-OD2 3.16Å; R107-D110 IonicContact NH1-OD2 2.88Å; R107-D110 PolarHBondContact NH1-OD2 3.24Å
111	L	75.8	Confident	79.1	Confident	50 Å²	50	61.9 Å²	61.9	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-96.4	-27.7	-179.8	-61.7	-171.3	0	0	0	113.7	K92 F93 M95 M103 F108 L109	K92-L111 HydrophobicContact CB-CB 4.44Å; K92-L111 WeakPolarHBondContact CD-O 3.47Å; F93-L111 HydrophobicContact CE1-CB 4.37Å; F93-L111 HydrophobicContact CZ-CB 4.04Å; M95-L111 HydrophobicContact CE-CD1 3.82Å; M103-L111 HydrophobicContact CE-CD1 3.56Å; M103-L111 HydrophobicContact CE-CG 4.16Å; F108-L111 PolarHBondContact O-N 2.84Å; L109-L111 PolarHBondContact O-N 2.73Å; L109-L111 VanDerWaalsContact O-N 3.09Å
112	A	75.6	Confident	79.1	Confident	13 Å²	13	63.2 Å²	63.2	11%	0.107	33%	0.327	C	S	.	.	S	Bend	trans	-82.2	156.5	-177.6	0	0	0	0	0	112.2	F93 F108 L109	F93-A112 HydrophobicContact CZ-CB 4.17Å; F108-A112 PolarHBondContact O-N 2.89Å; L109-A112 PolarHBondContact O-N 2.8Å
113	P	73.3	Confident	79.1	Confident	39 Å²	39	59.5 Å²	59.5	25%	0.253	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-63.9	150.6	163.2	-18.6	32	0	0	0	111.6	N87 V88 V116 G117	N87-P113 WeakPolarHBondContact O-CG 3.44Å; V88-P113 HydrophobicContact CG2-CG 4.4Å; P113-V116 HydrophobicContact CB-CB 4.26Å; P113-V116 HydrophobicContact CB-CG2 4.09Å; P113-V116 WeakPolarHBondContact O-CB 3Å; P113-V116 PolarHBondContact O-N 2.98Å; P113-V116 VanDerWaalsContact O-N 3.16Å; P113-G117 PolarHBondContact O-N 3.25Å; P113-G117 VanDerWaalsContact O-N 3.15Å
114	D	65.3	Low	79.3	Confident	139 Å²	139	57.4 Å²	57.4	74%	0.743	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	145	173.3	-63.9	-62.5	0	0	0	111.8	V116	D114-V116 PolarHBondContact O-N 3.13Å
115	F	68.1	Low	79.5	Confident	166 Å²	166	59 Å²	59	73%	0.728	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	-27.9	-173.2	-43.4	-79.2	0	0	0	115.7
116	V	73.1	Confident	79.5	Confident	17 Å²	17	56.3 Å²	56.3	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-78	-37.1	179.7	-174.9	0	0	0	0	111.6	L85 V88 P113 D114 D118 I119 L120	L85-V116 HydrophobicContact CD1-CG1 3.68Å; L85-V116 HydrophobicContact CD2-CG1 4.26Å; L85-V116 HydrophobicContact CD2-CG2 4.25Å; L85-V116 HydrophobicContact CG-CG1 4.46Å; V88-V116 HydrophobicContact CG2-CG1 3.93Å; P113-V116 HydrophobicContact CB-CB 4.26Å; P113-V116 HydrophobicContact CB-CG2 4.09Å; P113-V116 WeakPolarHBondContact O-CB 3Å; P113-V116 PolarHBondContact O-N 2.98Å; P113-V116 VanDerWaalsContact O-N 3.16Å; D114-V116 PolarHBondContact O-N 3.13Å; V116-D118 VanDerWaalsContact C-N 3.33Å; V116-D118 PolarHBondContact O-N 3.33Å; V116-I119 PolarHBondContact O-N 3.15Å; V116-L120 HydrophobicContact CG1-CD1 3.9Å; V116-L120 HydrophobicContact CG1-CG 4.42Å; V116-L120 PolarHBondContact O-N 3.47Å; V116-L120 VanDerWaalsContact O-N 3.17Å
117	G	80.1	Confident	79.6	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-39.1	-179.6	0	0	0	0	0	114.3	P113 W121	P113-G117 PolarHBondContact O-N 3.25Å; P113-G117 VanDerWaalsContact O-N 3.15Å; G117-W121 WeakPolarHBondContact O-CB 3.49Å; G117-W121 PolarHBondContact O-N 3.22Å
118	D	80.7	Confident	79.7	Confident	77 Å²	77	44.1 Å²	44.1	41%	0.412	22%	0.224	S	C	.	.	H	α-helix	trans	-64.5	-40.7	177	-83.6	-67.5	0	0	0	112.6	K105 V116 W121 E122	K105-D118 VanDerWaalsContact CE-OD1 3.23Å; K105-D118 WeakPolarHBondContact CE-OD1 3.35Å; K105-D118 IonicContact NZ-OD1 2.86Å; K105-D118 PolarHBondContact NZ-OD1 3.16Å; V116-D118 VanDerWaalsContact C-N 3.33Å; V116-D118 PolarHBondContact O-N 3.33Å; D118-W121 PolarHBondContact O-N 3.4Å; D118-E122 WeakPolarHBondContact O-CB 3.22Å; D118-E122 PolarHBondContact O-N 3.11Å
119	I	81	Confident	79.2	Confident	35 Å²	35	49.5 Å²	49.5	18%	0.179	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-46.3	179.1	-64.3	171.1	0	0	0	110.6	L44 F83 V116 H123	L44-I119 HydrophobicContact CD1-CG1 4.45Å; L44-I119 HydrophobicContact CD2-CG1 4.42Å; L44-I119 HydrophobicContact CD2-CG2 3.85Å; F83-I119 HydrophobicContact CD1-CG2 4.44Å; F83-I119 HydrophobicContact CD2-CG2 4.46Å; F83-I119 HydrophobicContact CE1-CG2 4.42Å; F83-I119 HydrophobicContact CE2-CG2 4.43Å; F83-I119 HydrophobicContact CG-CG2 4.46Å; F83-I119 HydrophobicContact CZ-CG2 4.39Å; V116-I119 PolarHBondContact O-N 3.15Å; I119-H123 PolarHBondContact O-N 3.18Å
120	L	84.1	Confident	78.3	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-42.1	177.7	-75.3	165.6	0	0	0	111.8	W75 L76 T79 F108 V116 H123 L124	W75-L120 HydrophobicContact CH2-CB 4.16Å; W75-L120 HydrophobicContact CH2-CD2 3.89Å; W75-L120 HydrophobicContact CZ2-CD2 4.1Å; W75-L120 WeakPolarHBondContact CZ2-O 3.41Å; W75-L120 HydrophobicContact CZ3-CD2 4.24Å; L76-L120 HydrophobicContact CD1-CD1 3.85Å; L76-L120 HydrophobicContact CD1-CD2 3.74Å; L76-L120 HydrophobicContact CD1-CG 4.5Å; T79-L120 HydrophobicContact CG2-CD2 3.66Å; T79-L120 HydrophobicContact CG2-CG 4.5Å; F108-L120 HydrophobicContact CE1-CB 3.58Å; F108-L120 HydrophobicContact CE1-CD1 4.36Å; F108-L120 HydrophobicContact CZ-CB 3.65Å; F108-L120 HydrophobicContact CZ-CD1 4.37Å; V116-L120 HydrophobicContact CG1-CD1 3.9Å; V116-L120 HydrophobicContact CG1-CG 4.42Å; V116-L120 PolarHBondContact O-N 3.47Å; V116-L120 VanDerWaalsContact O-N 3.17Å; L120-H123 PolarHBondContact O-N 2.86Å; L120-L124 PolarHBondContact O-N 3.46Å
121	W	85.9	Confident	77.1	Confident	28 Å²	28	51.4 Å²	51.4	11%	0.106	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-41.4	178.5	-175.1	-89.8	0	0	0	112.4	G104 K105 F108 G117 D118 H123 L124 E125	G104-W121 VanDerWaalsContact C-CH2 3.49Å; K105-W121 HydrophobicContact CB-CD2 3.92Å; K105-W121 HydrophobicContact CB-CE3 4.49Å; K105-W121 HydrophobicContact CB-CG 4.34Å; K105-W121 HydrophobicContact CB-CH2 4.46Å; K105-W121 HydrophobicContact CB-CZ2 3.88Å; K105-W121 HydrophobicContact CD-CG 4.03Å; K105-W121 HydrophobicContact CG-CD2 3.94Å; K105-W121 HydrophobicContact CG-CG 3.85Å; F108-W121 HydrophobicContact CB-CE3 3.5Å; F108-W121 VanDerWaalsContact CB-CE3 3.5Å; F108-W121 HydrophobicContact CB-CZ3 3.75Å; F108-W121 HydrophobicContact CD1-CB 4.21Å; F108-W121 HydrophobicContact CD1-CE3 4.03Å; F108-W121 AromaticContact CD2-CE3 3.76Å; F108-W121 HydrophobicContact CD2-CE3 3.76Å; F108-W121 HydrophobicContact CD2-CZ3 4.03Å; F108-W121 HydrophobicContact CE1-CB 4.47Å; F108-W121 AromaticContact CG-CE3 3.48Å; F108-W121 HydrophobicContact CG-CE3 3.48Å; F108-W121 VanDerWaalsContact CG-CE3 3.48Å; F108-W121 HydrophobicContact CG-CZ3 4.02Å; G117-W121 WeakPolarHBondContact O-CB 3.49Å; G117-W121 PolarHBondContact O-N 3.22Å; D118-W121 PolarHBondContact O-N 3.4Å; W121-H123 VanDerWaalsContact C-N 3.26Å; W121-H123 PolarHBondContact O-N 3.31Å; W121-L124 HydrophobicContact CE3-CD2 4.1Å; W121-L124 HydrophobicContact CZ3-CD2 3.98Å; W121-L124 PolarHBondContact O-N 3.34Å; W121-L124 VanDerWaalsContact O-N 3.17Å; W121-E125 WeakPolarHBondContact O-CB 3.24Å; W121-E125 PolarHBondContact O-N 2.95Å
122	E	84.9	Confident	76	Confident	45 Å²	45	54.4 Å²	54.4	21%	0.21	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-41.1	176.1	-169.8	76.1	-178.1	0	0	111.1	S41 L44 F48 D118 M126	S41-E122 VanDerWaalsContact CB-OE1 3.31Å; S41-E122 WeakPolarHBondContact CB-OE1 3.23Å; S41-E122 PolarHBondContact OG-OE1 3.02Å; L44-E122 HydrophobicContact CD1-CB 4.17Å; L44-E122 HydrophobicContact CD1-CG 4.06Å; F48-E122 HydrophobicContact CE2-CG 4.48Å; D118-E122 WeakPolarHBondContact O-CB 3.22Å; D118-E122 PolarHBondContact O-N 3.11Å; E122-M126 WeakPolarHBondContact O-CB 3.41Å; E122-M126 WeakPolarHBondContact O-CG 3.45Å; E122-M126 PolarHBondContact O-N 3.47Å
123	H	84.5	Confident	74.6	Confident	3 Å²	3	62 Å²	62	1%	0.014	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-47.1	174.7	-163	-176	0	0	0	112	F48 F51 W75 W78 I119 L120 W121 E125 M126 L127	F48-H123 HydrophobicContact CD1-CB 4.04Å; F48-H123 AromaticContact CD1-CD2 3.73Å; F48-H123 AromaticContact CD1-CE1 3.77Å; F48-H123 AromaticContact CD1-CG 3.51Å; F48-H123 AromaticContact CD1-ND1 3.53Å; F48-H123 AromaticContact CD1-NE2 3.9Å; F48-H123 HydrophobicContact CD2-CB 4.13Å; F48-H123 AromaticContact CD2-CD2 3.77Å; F48-H123 AromaticContact CD2-CG 3.98Å; F48-H123 HydrophobicContact CE1-CB 3.61Å; F48-H123 AromaticContact CE1-CG 3.6Å; F48-H123 AromaticContact CE1-ND1 3.73Å; F48-H123 HydrophobicContact CE2-CB 3.69Å; F48-H123 HydrophobicContact CG-CB 4.3Å; F48-H123 AromaticContact CG-CD2 3.49Å; F48-H123 VanDerWaalsContact CG-CD2 3.49Å; F48-H123 WeakPolarHBondContact CG-CD2 3.27Å; F48-H123 AromaticContact CG-CG 3.73Å; F48-H123 AromaticContact CG-NE2 3.79Å; F48-H123 HydrophobicContact CZ-CB 3.44Å; F48-H123 VanDerWaalsContact CZ-CB 3.44Å; F48-H123 AromaticContact CZ-CG 3.89Å; F51-H123 AromaticContact CD1-CE1 3.67Å; F51-H123 AromaticContact CD1-NE2 3.68Å; F51-H123 AromaticContact CG-CE1 3.79Å; W75-H123 AromaticContact CD1-CE1 3.82Å; W75-H123 AromaticContact CD1-ND1 3.88Å; W75-H123 AromaticContact CE2-ND1 4Å; W75-H123 HydrophobicContact CZ2-CB 4.31Å; W75-H123 AromaticContact NE1-CE1 3.41Å; W75-H123 PolarHBondContact NE1-CE1 2.81Å; W75-H123 AromaticContact NE1-CG 3.71Å; W75-H123 AromaticContact NE1-ND1 3.06Å; W75-H123 PolarHBondContact NE1-ND1 3.35Å; W78-H123 AromaticContact CE3-CE1 3.98Å; W78-H123 AromaticContact CZ3-CE1 3.43Å; W78-H123 VanDerWaalsContact CZ3-CE1 3.43Å; W78-H123 WeakPolarHBondContact CZ3-CE1 3.3Å; W78-H123 AromaticContact CZ3-ND1 3.8Å; I119-H123 PolarHBondContact O-N 3.18Å; L120-H123 PolarHBondContact O-N 2.86Å; W121-H123 VanDerWaalsContact C-N 3.26Å; W121-H123 PolarHBondContact O-N 3.31Å; H123-E125 VanDerWaalsContact C-N 3.31Å; H123-E125 PolarHBondContact O-N 3.24Å; H123-M126 PolarHBondContact O-N 3.21Å; H123-L127 WeakPolarHBondContact O-CG 3.48Å; H123-L127 PolarHBondContact O-N 3.15Å
124	L	86.1	Confident	72.8	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-66.2	-32.7	-179.4	-175.8	62.4	0	0	0	112.5	P64 W75 L100 F108 L120 W121 Q128	P64-L124 HydrophobicContact CB-CD1 3.66Å; P64-L124 HydrophobicContact CG-CD1 4.03Å; W75-L124 HydrophobicContact CH2-CB 4.28Å; W75-L124 HydrophobicContact CZ2-CB 4.11Å; L100-L124 HydrophobicContact CD2-CD1 4.11Å; L100-L124 HydrophobicContact CD2-CD2 3.94Å; L100-L124 HydrophobicContact CG-CD2 3.89Å; F108-L124 HydrophobicContact CD2-CD2 4.19Å; F108-L124 HydrophobicContact CE2-CD2 4Å; L120-L124 PolarHBondContact O-N 3.46Å; W121-L124 HydrophobicContact CE3-CD2 4.1Å; W121-L124 HydrophobicContact CZ3-CD2 3.98Å; W121-L124 PolarHBondContact O-N 3.34Å; W121-L124 VanDerWaalsContact O-N 3.17Å; L124-Q128 WeakPolarHBondContact O-CG 3.46Å; L124-Q128 PolarHBondContact O-N 3.44Å; L124-Q128 PolarHBondContact O-NE2 2.91Å; L124-Q128 VanDerWaalsContact O-NE2 3.11Å
125	E	85.1	Confident	71.1	Confident	64 Å²	64	70.1 Å²	70.1	30%	0.299	33%	0.333	S	S	.	.	H	α-helix	trans	-74	-39	175.4	-155.6	-144.7	-158.1	0	0	111.6	W121 H123 Q128 K129	W121-E125 WeakPolarHBondContact O-CB 3.24Å; W121-E125 PolarHBondContact O-N 2.95Å; H123-E125 VanDerWaalsContact C-N 3.31Å; H123-E125 PolarHBondContact O-N 3.24Å; E125-Q128 PolarHBondContact O-N 3.17Å; E125-K129 HydrophobicContact CG-CD 4.44Å; E125-K129 WeakPolarHBondContact O-CG 3.1Å; E125-K129 PolarHBondContact O-N 3.16Å; E125-K129 VanDerWaalsContact O-N 3.13Å; E125-K129 VanDerWaalsContact OE1-CE 3.32Å; E125-K129 WeakPolarHBondContact OE1-CE 3.45Å; E125-K129 IonicContact OE1-NZ 3.8Å; E125-K129 PolarHBondContact OE1-NZ 3.05Å; E125-K129 WeakPolarHBondContact OE2-CE 3.47Å; E125-K129 IonicContact OE2-NZ 3.88Å; E125-K129 PolarHBondContact OE2-NZ 3.36Å
126	M	81.3	Confident	69.7	Low	19 Å²	19	68.2 Å²	68.2	9%	0.094	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-48.8	172.2	-82.9	179.9	47.7	0	0	112.8	K45 F48 E122 H123 Q128 K129 E130	K45-M126 HydrophobicContact CB-CE 4.31Å; K45-M126 HydrophobicContact CB-SD 4.33Å; K45-M126 HydrophobicContact CD-SD 4.22Å; K45-M126 HydrophobicContact CG-CE 3.6Å; K45-M126 HydrophobicContact CG-SD 3.26Å; K45-M126 WeakPolarHBondContact CG-SD 3.34Å; F48-M126 HydrophobicContact CB-CE 4.35Å; F48-M126 HydrophobicContact CD2-CE 3.84Å; F48-M126 HydrophobicContact CD2-SD 3.57Å; F48-M126 VanDerWaalsContact CD2-SD 3.57Å; F48-M126 HydrophobicContact CE2-SD 3.93Å; E122-M126 WeakPolarHBondContact O-CB 3.41Å; E122-M126 WeakPolarHBondContact O-CG 3.45Å; E122-M126 PolarHBondContact O-N 3.47Å; H123-M126 PolarHBondContact O-N 3.21Å; M126-Q128 PolarHBondContact O-N 3.45Å; M126-K129 CarbonylContact O-C 3.6Å; M126-K129 WeakPolarHBondContact O-CA 3.46Å; M126-K129 PolarHBondContact O-N 2.99Å; M126-E130 PolarHBondContact O-N 3.39Å
127	L	82.4	Confident	67.7	Low	18 Å²	18	74 Å²	74	9%	0.094	37%	0.366	C	S	.	.	H	α-helix	trans	-61.5	-30.5	-178.9	-69.5	165.9	0	0	0	112	F51 P64 W67 H123	F51-L127 HydrophobicContact CD1-CD1 4.32Å; F51-L127 HydrophobicContact CD1-CD2 4.49Å; F51-L127 HydrophobicContact CE1-CD1 4.14Å; P64-L127 HydrophobicContact CG-CB 3.46Å; P64-L127 VanDerWaalsContact CG-CB 3.46Å; P64-L127 HydrophobicContact CG-CD1 4.33Å; W67-L127 HydrophobicContact CH2-CD1 3.58Å; W67-L127 HydrophobicContact CZ2-CD1 3.83Å; H123-L127 WeakPolarHBondContact O-CG 3.48Å; H123-L127 PolarHBondContact O-N 3.15Å
128	Q	81.7	Confident	65.6	Low	47 Å²	47	81.9 Å²	81.9	22%	0.22	41%	0.408	C	S	.	.	H	α-helix	trans	-75.1	-24	170.9	-72.2	178.4	90.1	0	0	114	P64 L124 E125 M126 T132	P64-Q128 HydrophobicContact CG-CG 4.26Å; L124-Q128 WeakPolarHBondContact O-CG 3.46Å; L124-Q128 PolarHBondContact O-N 3.44Å; L124-Q128 PolarHBondContact O-NE2 2.91Å; L124-Q128 VanDerWaalsContact O-NE2 3.11Å; E125-Q128 PolarHBondContact O-N 3.17Å; M126-Q128 PolarHBondContact O-N 3.45Å; Q128-T132 PolarHBondContact O-OG1 3.5Å
129	K	72	Confident	63.7	Low	113 Å²	113	81.2 Å²	81.2	49%	0.491	42%	0.419	S	S	.	.	H	α-helix	trans	-91	-21	-179.8	-75.2	173.9	178.2	175.7	0	114.3	E125 M126 T132	E125-K129 HydrophobicContact CG-CD 4.44Å; E125-K129 WeakPolarHBondContact O-CG 3.1Å; E125-K129 PolarHBondContact O-N 3.16Å; E125-K129 VanDerWaalsContact O-N 3.13Å; E125-K129 VanDerWaalsContact OE1-CE 3.32Å; E125-K129 WeakPolarHBondContact OE1-CE 3.45Å; E125-K129 IonicContact OE1-NZ 3.8Å; E125-K129 PolarHBondContact OE1-NZ 3.05Å; E125-K129 WeakPolarHBondContact OE2-CE 3.47Å; E125-K129 IonicContact OE2-NZ 3.88Å; E125-K129 PolarHBondContact OE2-NZ 3.36Å; M126-K129 CarbonylContact O-C 3.6Å; M126-K129 WeakPolarHBondContact O-CA 3.46Å; M126-K129 PolarHBondContact O-N 2.99Å; K129-T132 PolarHBondContact O-OG1 3.47Å
130	E	63	Low	61.4	Low	122 Å²	122	87.9 Å²	87.9	57%	0.57	45%	0.454	S	S	*	.	H	α-helix	trans	-76.3	-36.3	-179	-74.6	-169	-179.7	0	0	113.1	M126 T132	M126-E130 PolarHBondContact O-N 3.39Å; E130-T132 VanDerWaalsContact C-N 3.25Å; E130-T132 PolarHBondContact O-N 3.11Å
131	D	54.8	Low	59.1	Low	82 Å²	82	94.1 Å²	94.1	44%	0.439	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-74.7	-11.5	-178.9	-119.1	0.4	0	0	0	113.4	K133	D131-K133 PolarHBondContact O-N 3.45Å
132	T	51.9	Low	56.3	Low	114 Å²	114	98.1 Å²	98.1	70%	0.699	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-69.5	2.2	177.8	-21.2	0	0	0	0	113.9	Q128 K129 E130	Q128-T132 PolarHBondContact O-OG1 3.5Å; K129-T132 PolarHBondContact O-OG1 3.47Å; E130-T132 VanDerWaalsContact C-N 3.25Å; E130-T132 PolarHBondContact O-N 3.11Å
133	K	48.1	Very low	54.1	Low	173 Å²	173	103.2 Å²	103.2	75%	0.752	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-116.6	6.2	-168.6	-76.1	-173.2	175.6	177.3	0	116.7	D131	D131-K133 PolarHBondContact O-N 3.45Å
134	H	34.8	Very low	51.5	Low	162 Å²	162	112.9 Å²	112.9	75%	0.75	60%	0.596	S	S	*	*			trans	-140.6	75.9	-179.3	-107.4	55.8	0	0	0	115.6
135	F	29.1	Very low	48.9	Very low	186 Å²	186	121.2 Å²	121.2	82%	0.816	64%	0.635	S	S	*	*			trans	-142.9	102.7	157.1	-90.3	-75.8	0	0	0	112.1	I137	F135-I137 HydrophobicContact CD1-CD1 3.93Å; F135-I137 HydrophobicContact CD1-CG1 4.25Å; F135-I137 HydrophobicContact CE1-CD1 4.16Å
136	P	38.9	Very low	46.1	Very low	126 Å²	126	127.2 Å²	127.2	82%	0.818	66%	0.663	S	S	*	*			trans	-97.4	82.6	161.1	34.8	-27.4	0	0	0	109.6
137	I	31.3	Very low	43.5	Very low	138 Å²	138	130.7 Å²	130.7	71%	0.708	69%	0.689	S	S	*	*			trans	-114.4	120.3	167.7	-66.4	-178.9	0	0	0	108.6	F135	F135-I137 HydrophobicContact CD1-CD1 3.93Å; F135-I137 HydrophobicContact CD1-CG1 4.25Å; F135-I137 HydrophobicContact CE1-CD1 4.16Å
138	N	36.6	Very low	41	Very low	167 Å²	167	141 Å²	141	89%	0.893	73%	0.726	S	S	*	*			trans	-88.9	120.2	-174.3	-155.8	11.5	0	0	0	110.3
139	G	40	Very low	38.6	Very low	62 Å²	62	149.4 Å²	149.4	64%	0.639	76%	0.758	S	S	*	*			trans	72.2	95.8	160.7	0	0	0	0	0	118.1
140	L	33.3	Very low	36.6	Very low	176 Å²	176	150 Å²	150	92%	0.921	77%	0.771	S	S	*	*				-157.8	139	117	-106.9	169.1	0	0	0	110.2
141	T	35	Very low	34.9	Very low	132 Å²	132	149.6 Å²	149.6	81%	0.81	78%	0.781	S	S	*	*			trans	-82.1	131.8	-175.3	50.4	0	0	0	0	112
142	S	27.1	Very low	33.6	Very low	111 Å²	111	152.1 Å²	152.1	78%	0.776	80%	0.795	S	S	*	*			trans	-140.3	117.8	164.5	-172.1	0	0	0	0	109.5
143	N	38.8	Very low	32.7	Very low	153 Å²	153	157.6 Å²	157.6	82%	0.818	80%	0.804	S	S	*	*			trans	-80.1	121.3	-178.3	-66.6	-20.8	0	0	0	110.3
144	F	30.1	Very low	31.8	Very low	205 Å²	205	156.9 Å²	156.9	90%	0.899	80%	0.802	S	S	*	*			trans	-141	146.8	153.2	-104	-81.5	0	0	0	110.5
145	Q	32.7	Very low	31.6	Very low	176 Å²	176	156 Å²	156	82%	0.822	81%	0.808	S	S	*	*			trans	-82.5	125.3	-169	-69.2	163.9	-111.9	0	0	112.1
146	E	25.3	Very low	31.6	Very low	190 Å²	190	150.2 Å²	150.2	89%	0.888	79%	0.79	S	S	*	*			trans	-90.6	107.3	160.7	-169.7	161.1	-132.1	0	0	109.7	R148	E146-R148 PolarHBondContact O-N 2.75Å
147	S	27	Very low	31.4	Very low	92 Å²	92	155.6 Å²	155.6	64%	0.643	80%	0.796	S	S	*	*			trans	-79.6	99.2	-174.4	-67.9	0	0	0	0	111.5	Y149	S147-Y149 PolarHBondContact O-N 3.47Å
148	R	30.2	Very low	31.3	Very low	234 Å²	234	152.6 Å²	152.6	88%	0.883	80%	0.799	S	S	*	*			trans	-66.1	97.2	174.7	-65.8	-173.2	-65.3	173.9	-0.2	111.8	E146	E146-R148 PolarHBondContact O-N 2.75Å
149	Y	30.8	Very low	31.1	Very low	224 Å²	224	152.1 Å²	152.1	88%	0.878	79%	0.794	S	S	*	*			trans	-115.8	74.2	163.1	-94.7	-78.8	0	0	0	110.3	S147	S147-Y149 PolarHBondContact O-N 3.47Å
150	T	29.3	Very low	30.8	Very low	125 Å²	125	158.4 Å²	158.4	77%	0.767	81%	0.807	S	S	*	*			trans	-89.6	109.8	159.7	48.7	0	0	0	0	107.7
151	S	27.1	Very low	30.7	Very low	113 Å²	113	158.3 Å²	158.3	79%	0.79	80%	0.802	S	S	*	*			trans	-89.7	119	173.7	-172.1	0	0	0	0	109.8
152	D	29.3	Very low	30.4	Very low	136 Å²	136	156.8 Å²	156.8	73%	0.727	80%	0.803	S	S	*	*			trans	-67.2	147.8	173.8	-61.4	-73.3	0	0	0	112.3
153	Y	32	Very low	30.6	Very low	228 Å²	228	160 Å²	160	89%	0.894	81%	0.805	S	S	*	*			trans	-146.8	56	155.1	-119.3	-75	0	0	0	113.2
154	F	30	Very low	30	Very low	159 Å²	159	159 Å²	159	70%	0.697	81%	0.809	S	S	*	*			trans	40.1	114.2	131.3	-149.2	-93.4	0	0	0	120.3	S156	F154-S156 VanDerWaalsContact CE1-OG 3.25Å; F154-S156 WeakPolarHBondContact CE1-OG 3.24Å; F154-S156 WeakPolarHBondContact CZ-OG 3.5Å
155	V	29.4	Very low	30.2	Very low	144 Å²	144	155.4 Å²	155.4	87%	0.873	80%	0.804	S	S	*	*			trans	-129.7	128	134.9	179.6	0	0	0	0	107.9
156	S	30	Very low	30.5	Very low	63 Å²	63	152.3 Å²	152.3	44%	0.441	80%	0.798	S	S	.	*			trans	-91.5	153	178.4	-93.7	0	0	0	0	112.8	F154	F154-S156 VanDerWaalsContact CE1-OG 3.25Å; F154-S156 WeakPolarHBondContact CE1-OG 3.24Å; F154-S156 WeakPolarHBondContact CZ-OG 3.5Å
157	Y	35.4	Very low	31	Very low	239 Å²	239	149.6 Å²	149.6	94%	0.937	80%	0.798	S	S	*	*			trans	166.6	122.3	137.4	-80.8	-57.4	0	0	0	106.9
158	G	28.4	Very low	31.2	Very low	75 Å²	75	150.9 Å²	150.9	77%	0.773	81%	0.807	S	S	*	*			cis	-174.2	145.9	-11.3	0	0	0	0	0	108
159	I	31.2	Very low	31.2	Very low	157 Å²	157	147.7 Å²	147.7	81%	0.805	80%	0.802	S	S	*	*			trans	-115	126.3	-178.6	-65	176.1	0	0	0	109.4
160	E	33.8	Very low	31.3	Very low	194 Å²	194	147 Å²	147	91%	0.907	80%	0.799	S	S	*	*			trans	-98.4	143.8	160	-67.8	-157.7	135.7	0	0	110.5
161	H	32.8	Very low	31.4	Very low	175 Å²	175	147.1 Å²	147.1	81%	0.81	81%	0.805	S	S	*	*			trans	-85.7	145.2	-178.7	-86	-104.9	0	0	0	112.2
162	A	29	Very low	31.7	Very low	100 Å²	100	150.5 Å²	150.5	83%	0.826	81%	0.808	S	S	*	*			trans	-125.3	136.1	151.6	0	0	0	0	0	108.7
163	Q	30.1	Very low	32.5	Very low	177 Å²	177	149.4 Å²	149.4	83%	0.827	81%	0.808	S	S	*	*			trans	-102.3	144.2	-173.4	-63.7	173.9	-81.5	0	0	111.5
164	C	27.3	Very low	32.4	Very low	133 Å²	133	141.9 Å²	141.9	90%	0.899	80%	0.8	S	S	*	*			trans	-72.8	140.4	172.7	-57.9	0	0	0	0	111.3
165	V	32.7	Very low	32.4	Very low	130 Å²	130	143.6 Å²	143.6	79%	0.788	81%	0.808	S	S	*	*			trans	-124.8	133.2	175.3	-177.6	0	0	0	0	108.8
166	P	39	Very low	32.5	Very low	110 Å²	110	143.5 Å²	143.5	71%	0.714	80%	0.801	S	S	*	*			trans	-77.7	156.5	177.3	32.9	-35.6	0	0	0	112.3
167	P	35.8	Very low	32.7	Very low	134 Å²	134	145.7 Å²	145.7	87%	0.87	81%	0.812	S	S	*	*			trans	-78.4	155.3	-174.7	32.1	-35.9	0	0	0	113.5
168	S	31.9	Very low	32.6	Very low	119 Å²	119	142.7 Å²	142.7	83%	0.832	81%	0.806	S	S	*	*			trans	-124.8	152	167.9	62.1	0	0	0	0	111.3
169	E	31	Very low	32.9	Very low	167 Å²	167	144.2 Å²	144.2	78%	0.78	81%	0.805	S	S	*	*			trans	-82.1	173.8	-171.2	-59	177.8	141.6	0	0	114.3
170	Y	32.1	Very low	32.9	Very low	210 Å²	210	147 Å²	147	82%	0.824	81%	0.807	S	S	*	*			trans	67.5	95.1	170.4	-66.8	-90.6	0	0	0	118.9
171	S	31.6	Very low	33	Very low	126 Å²	126	145.4 Å²	145.4	88%	0.881	80%	0.799	S	S	*	*				175.3	143.3	104.1	-72.4	0	0	0	0	112.8
172	E	33.3	Very low	33.2	Very low	185 Å²	185	142.2 Å²	142.2	86%	0.864	79%	0.793	S	S	*	*			trans	-119.5	179.3	174.9	-117.9	-157.1	178.1	0	0	109.5
173	P	46.6	Very low	33.6	Very low	112 Å²	112	145.5 Å²	145.5	73%	0.727	80%	0.795	S	S	*	*			cis	-132.1	178.1	-9.4	32.6	-12.6	0	0	0	114.9
174	G	29.2	Very low	33.9	Very low	71 Å²	71	144.7 Å²	144.7	73%	0.732	79%	0.791	S	S	*	*			trans	-176.7	88	168.1	0	0	0	0	0	116.7
175	F	30.3	Very low	34.7	Very low	195 Å²	195	144.1 Å²	144.1	86%	0.855	79%	0.786	S	S	*	*			trans	3.5	129.5	150.6	-76.6	-108.2	0	0	0	117.4
176	I	31.6	Very low	34.7	Very low	142 Å²	142	145.5 Å²	145.5	73%	0.728	79%	0.787	S	S	*	*			cis	-159.5	-178.7	10	25.6	170.4	0	0	0	108.5
177	T	32.8	Very low	34.4	Very low	109 Å²	109	144.2 Å²	144.2	67%	0.669	78%	0.781	S	S	*	*			cis	-154.2	-160.9	24.7	-25.3	0	0	0	0	112.5
178	E	34.7	Very low	34.9	Very low	175 Å²	175	143.3 Å²	143.3	82%	0.818	78%	0.778	S	S	*	*			trans	-44.7	155.9	167.9	-70.5	163.6	128.3	0	0	116.6
179	S	33.5	Very low	35.3	Very low	107 Å²	107	144.7 Å²	144.7	75%	0.748	77%	0.771	S	S	*	*			cis	-162.2	146.4	-7.5	45.7	0	0	0	0	112.5
180	Y	32.7	Very low	35.6	Very low	215 Å²	215	146.1 Å²	146.1	84%	0.843	78%	0.778	S	S	*	*			trans	-75.8	178.8	163.3	-71.6	-100	0	0	0	110.3
181	Q	34.7	Very low	35.7	Very low	161 Å²	161	143.8 Å²	143.8	75%	0.752	78%	0.778	S	S	*	*			cis	-162.5	158.1	13.4	-132.6	147.7	19.9	0	0	105.8
182	T	36.8	Very low	35.9	Very low	109 Å²	109	145.3 Å²	145.3	67%	0.669	78%	0.776	S	S	*	*			cis	-157.8	174.2	6	-23.2	0	0	0	0	108.8
183	L	37.3	Very low	35.7	Very low	168 Å²	168	142.3 Å²	142.3	88%	0.88	77%	0.771	S	S	*	*			trans	-101.4	148.2	153.6	-81.2	171.8	0	0	0	110.2
184	H	37.4	Very low	34.8	Very low	161 Å²	161	144 Å²	144	75%	0.745	77%	0.773	S	S	*	*			trans	-139.8	137.3	163.3	-99.7	-87.8	0	0	0	110.5
185	P	44.7	Very low	34.8	Very low	121 Å²	121	150.1 Å²	150.1	79%	0.786	78%	0.779	S	S	*	*			trans	-86.5	150.2	173.3	35.4	-33.7	0	0	0	111.3
186	I	32.2	Very low	34.9	Very low	158 Å²	158	152 Å²	152	81%	0.81	78%	0.782	S	S	*	*			trans	-134	146	177.4	-58.2	-176.3	0	0	0	110.6
187	S	33.4	Very low	34.7	Very low	83 Å²	83	154.1 Å²	154.1	58%	0.58	79%	0.789	S	S	*	*			trans	-74.5	171.7	-179.4	-169.6	0	0	0	0	113.4	E189	S187-E189 VanDerWaalsContact CB-OE1 3.28Å; S187-E189 WeakPolarHBondContact CB-OE1 3.42Å; S187-E189 PolarHBondContact O-N 3.28Å; S187-E189 PolarHBondContact OG-OE1 3.07Å
188	S	45.4	Very low	34.3	Very low	115 Å²	115	153.5 Å²	153.5	80%	0.804	79%	0.789	S	S	*	*	S	Bend	trans	-85.7	64.1	-177.9	57.3	0	0	0	0	113.8
189	E	40.8	Very low	34	Very low	149 Å²	149	153.6 Å²	153.6	70%	0.696	79%	0.79	S	S	*	*			trans	-157	73.3	172.9	51.7	-124.6	116.5	0	0	115.7	S187	S187-E189 VanDerWaalsContact CB-OE1 3.28Å; S187-E189 WeakPolarHBondContact CB-OE1 3.42Å; S187-E189 PolarHBondContact O-N 3.28Å; S187-E189 PolarHBondContact OG-OE1 3.07Å
190	E	36.3	Very low	33.8	Very low	197 Å²	197	158.8 Å²	158.8	92%	0.921	79%	0.794	S	S	*	*			trans	-124.9	103.8	155.9	-74	-161.1	141.1	0	0	111
191	L	35.1	Very low	34.3	Very low	160 Å²	160	154.3 Å²	154.3	84%	0.838	79%	0.792	S	S	*	*			trans	-100.1	127.3	171.5	-93.3	170.2	0	0	0	109.9
192	L	35	Very low	34.2	Very low	158 Å²	158	149.7 Å²	149.7	83%	0.827	79%	0.788	S	S	*	*			trans	64	127.1	164.5	-51.4	170.6	0	0	0	116.5
193	T	28.5	Very low	34	Very low	123 Å²	123	152.1 Å²	152.1	76%	0.755	80%	0.795	S	S	*	*				178.3	166.1	101.7	-63.3	0	0	0	0	108.7
194	L	27.6	Very low	33.9	Very low	148 Å²	148	151.1 Å²	151.1	78%	0.775	79%	0.789	S	S	*	*			trans	72.4	152.6	172	-52.7	180	0	0	0	116.5
195	K	30.1	Very low	33.6	Very low	199 Å²	199	150.4 Å²	150.4	87%	0.865	79%	0.79	S	S	*	*			cis	-159.4	150.2	-45.4	-130.9	-171.9	-178.2	-170.3	0	106.8
196	Y	31.5	Very low	33	Very low	233 Å²	233	154.9 Å²	154.9	91%	0.914	79%	0.791	S	S	*	*			trans	-115	115.5	-170.1	-164.6	-76.7	0	0	0	111.1
197	E	27.5	Very low	32.7	Very low	187 Å²	187	153.7 Å²	153.7	87%	0.874	79%	0.786	S	S	*	*			trans	-166.8	173.5	166.7	-131	171.5	177.3	0	0	113
198	S	25.6	Very low	32.4	Very low	96 Å²	96	156.5 Å²	156.5	67%	0.671	80%	0.8	S	S	*	*			trans	74.9	125.2	-177.2	-167.5	0	0	0	0	114.6
199	E	27.3	Very low	31.5	Very low	178 Å²	178	155 Å²	155	83%	0.832	80%	0.795	S	S	*	*			cis	-153.4	-175.3	-3.5	-133	150	-97	0	0	115.2
200	Y	29.8	Very low	31	Very low	215 Å²	215	155.2 Å²	155.2	84%	0.843	80%	0.8	S	S	*	*			trans	-74.4	-179.6	-170.7	-106.4	-123.8	0	0	0	115.1
201	P	44.1	Very low	30.6	Very low	121 Å²	121	152.4 Å²	152.4	79%	0.786	79%	0.791	S	S	*	*			cis	-131.8	171.2	11.3	39.2	-21	0	0	0	117.7
202	G	32.1	Very low	30	Very low	65 Å²	65	149.4 Å²	149.4	67%	0.67	78%	0.784	S	S	*	*			trans	-127.8	-179.3	172.9	0	0	0	0	0	114.1
203	I	32.6	Very low	29.7	Very low	160 Å²	160	148.9 Å²	148.9	82%	0.821	78%	0.779	S	S	*	*			trans	-130.9	113.4	-175.3	-72.6	-177.7	0	0	0	112.5
204	I	35.3	Very low	29.5	Very low	146 Å²	146	151.8 Å²	151.8	75%	0.749	78%	0.784	S	S	*	*			trans	56.7	111.3	137.6	-61.5	178.7	0	0	0	120.8
205	L	30.5	Very low	29.4	Very low	147 Å²	147	147.9 Å²	147.9	77%	0.77	78%	0.779	S	S	*	*			trans	60.2	156.7	145.2	-91	63.2	0	0	0	119.7
206	R	31.7	Very low	29.2	Very low	215 Å²	215	145.4 Å²	145.4	81%	0.811	78%	0.775	S	S	*	*			cis	-146.8	164.3	10.2	-153.7	172.8	-175.5	-179.1	1.9	113.1
207	D	27.1	Very low	29	Very low	132 Å²	132	144 Å²	144	71%	0.706	77%	0.77	S	S	*	*			trans	-65.1	150.7	177	-37.4	-101.6	0	0	0	115.3
208	T	27.4	Very low	29	Very low	142 Å²	142	143.4 Å²	143.4	87%	0.871	76%	0.764	S	S	*	*				163.4	150.2	107.8	-57.7	0	0	0	0	109.5
209	A	26.8	Very low	29	Very low	85 Å²	85	144.5 Å²	144.5	70%	0.702	77%	0.772	S	S	*	*			trans	-120.8	178.6	-169.8	0	0	0	0	0	114.8
210	L	29.3	Very low	28.9	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	77%	0.767	S	S	*	*			trans	97.5	137.4	155.4	-67.5	163.4	0	0	0	121.3
211	N	27.3	Very low	28.7	Very low	139 Å²	139	139.8 Å²	139.8	74%	0.743	76%	0.763	S	S	*	*			trans	62.3	104	152.6	-58.5	-17.7	0	0	0	119
212	S	23.6	Very low	27.7	Very low	97 Å²	97	141 Å²	141	68%	0.678	76%	0.758	S	S	*	*				71.9	138.2	61.8	-161.4	0	0	0	0	115.4
213	M	28.6	Very low	27.5	Very low	147 Å²	147	145.2 Å²	145.2	72%	0.724	76%	0.76	S	S	*	*			trans	85.9	106	169.4	-62.2	-63.2	101.6	0	0	120.7
214	Q	24.8	Very low	27.2	Very low	184 Å²	184	142.7 Å²	142.7	86%	0.86	75%	0.752	S	S	*	*				76.7	136.8	115	-163.3	173	14.8	0	0	120.4
215	G	24.9	Very low	26.8	Very low	65 Å²	65	142.3 Å²	142.3	67%	0.67	76%	0.757	S	S	*	*			trans	133.7	70.5	155.6	0	0	0	0	0	119.5
216	D	26.1	Very low	26.6	Very low	148 Å²	148	140.2 Å²	140.2	79%	0.791	75%	0.754	S	S	*	*				56.1	149.4	126.2	-89.8	-55.8	0	0	0	126.6
217	Y	27.9	Very low	27.4	Very low	203 Å²	203	134.9 Å²	134.9	80%	0.796	75%	0.747	S	S	*	*			trans	81.8	124.6	152.5	-95.5	-108.1	0	0	0	125
218	F	27.1	Very low	27.6	Very low	174 Å²	174	134.9 Å²	134.9	76%	0.763	75%	0.747	S	S	*	*			trans	-35	149	168.3	-70.9	-102.7	0	0	0	120.4
219	S	25.9	Very low	27.9	Very low	119 Å²	119	134.2 Å²	134.2	83%	0.832	74%	0.738	S	S	*	*				-171.6	129.9	111.1	-83.5	0	0	0	0	118.4
220	V	24	Very low	28.1	Very low	119 Å²	119	138.5 Å²	138.5	72%	0.721	75%	0.746	S	S	*	*			trans	-12.3	136.2	155.5	-155.2	0	0	0	0	121.2
221	K	26	Very low	28.4	Very low	176 Å²	176	137.1 Å²	137.1	77%	0.765	75%	0.747	S	S	*	*				162	139.7	125.6	-86.7	177.8	-177.5	-177	0	111.7
222	Q	23.9	Very low	28.8	Very low	147 Å²	147	137.7 Å²	137.7	69%	0.687	76%	0.756	S	S	*	*				56.7	130.7	75.1	-91.2	-167	-67.8	0	0	112.3
223	E	26.6	Very low	29	Very low	152 Å²	152	136.2 Å²	136.2	71%	0.71	76%	0.756	S	S	*	*			cis	-156.8	178.3	11.1	-73.4	-129.5	126.9	0	0	110.3
224	V	26.6	Very low	29.3	Very low	108 Å²	108	140.1 Å²	140.1	66%	0.655	76%	0.762	S	S	*	*			cis	-173.3	151.4	-30	149.3	0	0	0	0	105.9
225	V	27.8	Very low	29.7	Very low	138 Å²	138	138.1 Å²	138.1	84%	0.836	76%	0.757	S	S	*	*			trans	175.2	138.3	141.6	148.4	0	0	0	0	111.8
226	S	25.8	Very low	30.1	Very low	103 Å²	103	139.6 Å²	139.6	72%	0.72	76%	0.757	S	S	*	*			trans	-108.1	-153.3	-179.5	-34	0	0	0	0	110.1
227	P	47.8	Very low	30.2	Very low	102 Å²	102	144.2 Å²	144.2	66%	0.662	76%	0.763	S	S	*	*			cis	-126.5	-162	-1	41.3	-19.7	0	0	0	112.2
228	D	30.8	Very low	30.3	Very low	132 Å²	132	137.8 Å²	137.8	71%	0.706	76%	0.759	S	S	*	*			cis	-137.9	139.6	9.6	-92.6	-55.5	0	0	0	109.1
229	N	34	Very low	30.6	Very low	128 Å²	128	139 Å²	139	68%	0.684	76%	0.764	S	S	*	*				71.3	107.9	66.8	-67.1	-42.7	0	0	0	116.2
230	M	31.6	Very low	30.9	Very low	176 Å²	176	140.7 Å²	140.7	87%	0.867	76%	0.763	S	S	*	*				-176.2	138.5	103.3	-97.8	-62.8	-178.4	0	0	112.4
231	C	34.4	Very low	31.2	Very low	122 Å²	122	138.5 Å²	138.5	82%	0.824	77%	0.765	S	S	*	*			trans	-142.8	131.3	-177.9	-60.8	0	0	0	0	112.1
232	V	36.3	Very low	31.3	Very low	152 Å²	152	133.5 Å²	133.5	92%	0.921	76%	0.763	S	S	*	*			trans	-162.4	139.5	161.5	-101.3	0	0	0	0	110.2
233	G	29	Very low	31.7	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	77%	0.769	S	S	*	*			cis	156.9	163.7	-12.2	0	0	0	0	0	114.1
234	R	34.5	Very low	31.7	Very low	230 Å²	230	134.1 Å²	134.1	87%	0.868	77%	0.77	S	S	*	*			trans	75.4	150.6	172	-56.6	-173.4	-166.5	-90.2	1.9	116.2
235	L	32.3	Very low	31.9	Very low	141 Å²	141	135.4 Å²	135.4	74%	0.738	78%	0.784	S	S	*	*			cis	-170.4	160.6	-11.5	-99.5	169.9	0	0	0	105.8
236	S	33.3	Very low	31.8	Very low	96 Å²	96	137.1 Å²	137.1	67%	0.671	78%	0.78	S	S	*	*			cis	-170.5	169.5	-11.6	-160.8	0	0	0	0	111
237	R	29.5	Very low	32	Very low	245 Å²	245	139.2 Å²	139.2	93%	0.925	78%	0.779	S	S	*	*			trans	64.4	139.5	170.8	-70.2	179	167.1	177.1	-4.5	117.9
238	G	29.1	Very low	31.1	Very low	69 Å²	69	140.3 Å²	140.3	71%	0.711	79%	0.789	S	S	*	*			cis	140.6	134.7	-18.7	0	0	0	0	0	116
239	K	33.8	Very low	31.2	Very low	199 Å²	199	140.9 Å²	140.9	87%	0.865	79%	0.791	S	S	*	*			trans	69.9	151.7	176.6	-71.9	-170.4	170.5	-171	0	115.2
240	L	31.8	Very low	30.9	Very low	154 Å²	154	141.3 Å²	141.3	81%	0.806	79%	0.793	S	S	*	*			cis	-155.4	151.3	3.1	-128.9	169.4	0	0	0	110.9
241	G	29.5	Very low	30.8	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	80%	0.795	S	S	*	*			trans	85.4	148.7	167.3	0	0	0	0	0	115.8
242	G	29	Very low	30.6	Very low	71 Å²	71	142 Å²	142	73%	0.732	79%	0.794	S	S	*	*			cis	171.7	116.7	-9.6	0	0	0	0	0	114.6
243	Q	32.2	Very low	30.4	Very low	176 Å²	176	142 Å²	142	82%	0.822	78%	0.784	S	S	*	*			trans	61.8	119	154.6	-70.5	177.7	-41.5	0	0	121.1
244	D	26.5	Very low	30.3	Very low	136 Å²	136	144.3 Å²	144.3	73%	0.727	79%	0.789	S	S	*	*				60.5	104.5	122.8	-43.9	-19.8	0	0	0	120.2
245	S	31.3	Very low	29.9	Very low	134 Å²	134	139.4 Å²	139.4	94%	0.937	79%	0.789	S	S	*	*				-160.9	162.4	120.9	-82	0	0	0	0	111.7
246	F	25.8	Very low	29.7	Very low	175 Å²	175	139.8 Å²	139.8	77%	0.768	79%	0.792	S	S	*	*			trans	-131.4	173.6	-169.3	146.7	-99.5	0	0	0	109.6
247	E	29	Very low	29.5	Very low	146 Å²	146	146.1 Å²	146.1	68%	0.682	80%	0.801	S	S	*	*			trans	72.6	114.8	166.3	-134.2	160	-140.6	0	0	118.3
248	S	29.4	Very low	29.6	Very low	126 Å²	126	142.2 Å²	142.2	88%	0.881	80%	0.797	S	S	*	*				-165.3	151.1	115.2	-79.3	0	0	0	0	110.6
249	I	33	Very low	29.8	Very low	144 Å²	144	145.3 Å²	145.3	74%	0.738	80%	0.803	S	S	*	*			trans	-124.2	158.8	178.2	-164.4	172.4	0	0	0	108.7
250	D	28.3	Very low	29.6	Very low	136 Å²	136	144.9 Å²	144.9	73%	0.727	80%	0.804	S	S	*	*			trans	54.2	122.7	168.9	-62.6	-36.5	0	0	0	119.4
251	S	27.7	Very low	29.6	Very low	130 Å²	130	142 Å²	142	91%	0.909	80%	0.797	S	S	*	*				-170.5	161.3	114.6	-81.5	0	0	0	0	111.8
252	F	31.6	Very low	29.6	Very low	184 Å²	184	151.1 Å²	151.1	81%	0.807	81%	0.808	S	S	*	*			trans	-117.2	168.3	-176.1	177.9	-104.5	0	0	0	111.1
253	E	32.5	Very low	29.6	Very low	152 Å²	152	152 Å²	152	71%	0.71	80%	0.803	S	S	*	*			trans	91.6	138.8	159.5	-145.6	156.3	-108.3	0	0	120.6
254	S	25.6	Very low	29.3	Very low	112 Å²	112	148.4 Å²	148.4	78%	0.783	80%	0.797	S	S	*	*			trans	49.7	126.5	163.7	-66.5	0	0	0	0	119.7
255	C	26	Very low	29.6	Very low	128 Å²	128	151 Å²	151	87%	0.865	81%	0.805	S	S	*	*				-165.2	172.4	55.1	-163.2	0	0	0	0	112.8
256	D	29.4	Very low	29.4	Very low	148 Å²	148	150.3 Å²	150.3	79%	0.791	80%	0.8	S	S	*	*			trans	-76.6	166.7	179.4	-90.2	-69.6	0	0	0	115.6
257	R	29.2	Very low	29.7	Very low	229 Å²	229	147.5 Å²	147.5	86%	0.864	80%	0.803	S	S	*	*			trans	70.2	96.1	160.4	-32.1	-163.7	108.5	167.7	5.1	118.6
258	L	31.8	Very low	29.6	Very low	163 Å²	163	150.4 Å²	150.4	85%	0.853	81%	0.813	S	S	*	*				-167.1	123	117.5	-122.2	72.1	0	0	0	106.9
259	T	32.7	Very low	29.7	Very low	134 Å²	134	148.6 Å²	148.6	82%	0.822	80%	0.8	S	S	*	*				-168.2	125	86.6	24.6	0	0	0	0	111.1
260	Q	30.2	Very low	29.5	Very low	191 Å²	191	146.8 Å²	146.8	89%	0.893	80%	0.8	S	S	*	*			trans	-131.2	154.4	154.2	-80.4	-169.8	-7.1	0	0	108
261	S	30.4	Very low	29.6	Very low	94 Å²	94	148.4 Å²	148.4	66%	0.657	81%	0.808	S	S	*	*			trans	64.2	104.4	172.5	-153.2	0	0	0	0	117.3
262	W	30.8	Very low	30	Very low	265 Å²	265	150.9 Å²	150.9	100%	1.004	81%	0.805	S	S	*	*			trans	-124.7	101.5	134	-92.4	79.2	0	0	0	107.6
263	S	28.4	Very low	30	Very low	88 Å²	88	153 Å²	153	62%	0.615	81%	0.808	S	S	*	*			trans	-99.2	-178.3	173	60.9	0	0	0	0	110.9
264	S	26	Very low	29.9	Very low	101 Å²	101	152.1 Å²	152.1	71%	0.706	81%	0.813	S	S	*	*			trans	78.2	109.1	-179.7	-48.8	0	0	0	0	113.2
265	Q	31.6	Very low	30.8	Very low	191 Å²	191	152.4 Å²	152.4	89%	0.893	81%	0.812	S	S	*	*				64.3	109.5	65	-62.7	-175.7	14	0	0	113.8
266	S	28	Very low	31.1	Very low	120 Å²	120	151.7 Å²	151.7	84%	0.839	81%	0.808	S	S	*	*			trans	-144.4	150.8	143	64.3	0	0	0	0	108.3
267	S	32.3	Very low	31.4	Very low	116 Å²	116	154.6 Å²	154.6	81%	0.811	81%	0.81	S	S	*	*			trans	-143.4	137.3	-174.7	-57	0	0	0	0	110.1
268	F	26.8	Very low	31.6	Very low	207 Å²	207	149.5 Å²	149.5	91%	0.908	80%	0.8	S	S	*	*			trans	-149.4	122.3	158.1	-158.2	-113.4	0	0	0	111.9
269	S	31	Very low	31.8	Very low	87 Å²	87	146.4 Å²	146.4	61%	0.608	79%	0.792	S	S	*	*			trans	-69.7	153.4	167.2	-51.1	0	0	0	0	108.8
270	S	28.6	Very low	31.6	Very low	106 Å²	106	149 Å²	149	74%	0.741	79%	0.792	S	S	*	*				-179.8	153.2	58.4	-55.2	0	0	0	0	109.9
271	L	31.6	Very low	32.1	Very low	171 Å²	171	145.6 Å²	145.6	90%	0.895	78%	0.78	S	S	*	*				-164.7	130	125.8	-107.9	178.3	0	0	0	109.7
272	Q	36.1	Very low	32.6	Very low	181 Å²	181	146 Å²	146	85%	0.846	78%	0.783	S	S	*	*			trans	-84.8	130	178.9	-63.5	165.4	-85.6	0	0	111.2
273	R	31.5	Very low	33.2	Very low	228 Å²	228	142.2 Å²	142.2	86%	0.86	78%	0.776	S	S	*	*				-161.3	140	128.9	-140.6	164.4	-69.4	123.8	1.6	113.9
274	V	30.8	Very low	33.9	Very low	135 Å²	135	144.8 Å²	144.8	82%	0.818	78%	0.783	S	S	*	*			trans	-151	164.3	166.7	-114.1	0	0	0	0	105.3
275	P	43.3	Very low	34.2	Very low	118 Å²	118	150.5 Å²	150.5	77%	0.766	79%	0.791	S	S	*	*			cis	-132.7	170.6	-4.5	40.8	-25.9	0	0	0	114.8
276	S	32.8	Very low	34.7	Very low	112 Å²	112	147.4 Å²	147.4	78%	0.783	79%	0.787	S	S	*	*			trans	-178.2	138.1	132.4	59.2	0	0	0	0	113.2
277	Y	35.8	Very low	35	Very low	209 Å²	209	147 Å²	147	82%	0.82	78%	0.78	S	S	*	*			trans	4.3	132.8	133.6	-139.2	-110.1	0	0	0	115.7
278	D	32.2	Very low	35.6	Very low	122 Å²	122	145.6 Å²	145.6	65%	0.652	78%	0.775	S	S	*	*			cis	-164	169.7	40	-160.1	-6.1	0	0	0	112.3
279	S	37.3	Very low	36.2	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	77%	0.773	S	S	*	*			trans	41.2	115.8	153.9	-164.8	0	0	0	0	122.1
280	F	27.8	Very low	36.6	Very low	190 Å²	190	147.4 Å²	147.4	83%	0.833	78%	0.781	S	S	*	*				-154	147.7	107.7	-163.7	-112.2	0	0	0	111.5
281	D	41.9	Very low	37	Very low	119 Å²	119	146.2 Å²	146.2	64%	0.636	79%	0.786	S	S	*	*			trans	-94.1	137.4	-178.5	176.8	22.9	0	0	0	111.4
282	S	40.1	Very low	37.3	Very low	103 Å²	103	146.3 Å²	146.3	72%	0.72	78%	0.781	S	S	*	*			trans	-165.7	71	175.1	-74.6	0	0	0	0	112.5	D284	S282-D284 PolarHBondContact O-N 2.96Å
283	E	43.7	Very low	37.8	Very low	185 Å²	185	146.4 Å²	146.4	86%	0.864	78%	0.779	S	S	*	*			trans	-64.1	89.9	163.9	-75.5	-85	118.4	0	0	112
284	D	41.8	Very low	38.7	Very low	141 Å²	141	138.2 Å²	138.2	75%	0.754	76%	0.755	S	S	*	*			trans	-156.6	44.7	164.6	-149.9	2.5	0	0	0	115.5	S282	S282-D284 PolarHBondContact O-N 2.96Å
285	Y	33.3	Very low	39.6	Very low	221 Å²	221	142 Å²	142	87%	0.867	76%	0.76	S	S	*	*			trans	-141.1	109.4	166.6	-96.1	-86.5	0	0	0	111.9	T287	Y285-T287 VanDerWaalsContact C-N 3.25Å; Y285-T287 PolarHBondContact O-N 3.43Å
286	P	41.7	Very low	40.6	Very low	127 Å²	127	138 Å²	138	83%	0.825	74%	0.74	S	S	*	*			trans	-70.5	84.4	169.6	29.1	-33.5	0	0	0	110	A288	P286-A288 PolarHBondContact O-N 2.87Å
287	T	35.5	Very low	42.6	Very low	110 Å²	110	134.6 Å²	134.6	68%	0.675	72%	0.715	S	S	*	*			trans	-55.1	135.7	173.7	-67.2	0	0	0	0	109.8	Y285 L289	Y285-T287 VanDerWaalsContact C-N 3.25Å; Y285-T287 PolarHBondContact O-N 3.43Å; T287-L289 PolarHBondContact O-N 3.3Å
288	A	44.5	Very low	44.7	Very low	87 Å²	87	124.7 Å²	124.7	72%	0.719	68%	0.676	S	S	*	*			trans	-65.1	91.2	-176.9	0	0	0	0	0	111.9	P286 H290	P286-A288 PolarHBondContact O-N 2.87Å; A288-H290 PolarHBondContact O-ND1 3.08Å
289	L	38.8	Very low	46.8	Very low	165 Å²	165	120.2 Å²	120.2	86%	0.864	65%	0.651	S	S	*	*			trans	-67.5	137.8	-179.5	-74.9	-179.6	0	0	0	111.9	T287	T287-L289 PolarHBondContact O-N 3.3Å
290	H	39.6	Very low	48.6	Very low	168 Å²	168	119.2 Å²	119.2	78%	0.778	64%	0.638	S	S	*	*			trans	-75.5	148.9	-170.2	-69.5	34.6	0	0	0	112.9	A288 H292	A288-H290 PolarHBondContact O-ND1 3.08Å; H290-H292 VanDerWaalsContact C-N 3.29Å; H290-H292 PolarHBondContact O-N 2.72Å
291	G	37.8	Very low	50.7	Low	81 Å²	81	112.3 Å²	112.3	84%	0.835	61%	0.607	S	S	*	*			trans	72.7	-9	133.6	0	0	0	0	0	119.8	K293	G291-K293 PolarHBondContact O-N 2.86Å
292	H	36.6	Very low	52.1	Low	173 Å²	173	107.9 Å²	107.9	80%	0.801	58%	0.584	S	S	*	*			trans	-70.3	103.2	177.6	-87.3	-97.2	0	0	0	111.8	H290	H290-H292 VanDerWaalsContact C-N 3.29Å; H290-H292 PolarHBondContact O-N 2.72Å
293	K	46.7	Very low	53.5	Low	183 Å²	183	110.9 Å²	110.9	80%	0.796	58%	0.579	S	S	*	*			trans	-55.2	125.1	155.4	-71.7	-173.7	178.7	-178.1	0	107.5	G291 K295	G291-K293 PolarHBondContact O-N 2.86Å; K293-K295 PolarHBondContact O-N 3.07Å
294	P	51.4	Low	54.3	Low	55 Å²	55	110 Å²	110	36%	0.357	58%	0.575	S	S	.	*			trans	-61.9	122.1	-179.3	23	-31.9	0	0	0	110.2	G296 Y301 Y323	P294-G296 VanDerWaalsContact C-N 3.32Å; P294-G296 PolarHBondContact O-N 3.15Å; P294-Y301 HydrophobicContact CB-CD2 3.99Å; P294-Y301 HydrophobicContact CG-CD2 4.27Å; P294-Y323 HydrophobicContact CB-CD2 4.39Å; P294-Y323 HydrophobicContact CB-CE2 4.25Å; P294-Y323 HydrophobicContact CG-CD2 3.48Å; P294-Y323 VanDerWaalsContact CG-CD2 3.48Å; P294-Y323 HydrophobicContact CG-CE2 3.58Å; P294-Y323 HydrophobicContact CG-CG 4.48Å
295	K	49.3	Very low	55.2	Low	215 Å²	215	111.7 Å²	111.7	94%	0.935	57%	0.571	S	S	*	*	S	Bend	trans	-87.6	72.3	175.9	-71.7	-173.9	176.4	-177.9	0	109.7	K293	K293-K295 PolarHBondContact O-N 3.07Å
296	G	64.2	Low	56.3	Low	34 Å²	34	103.7 Å²	103.7	35%	0.351	55%	0.547	S	S	.	.	S	Bend	trans	179.8	176	-178.9	0	0	0	0	0	110.1	P294 Y323	P294-G296 VanDerWaalsContact C-N 3.32Å; P294-G296 PolarHBondContact O-N 3.15Å; G296-Y323 PolarHBondContact O-OH 3.29Å
297	T	75.1	Confident	56.6	Low	41 Å²	41	104.5 Å²	104.5	25%	0.252	55%	0.545	S	S	.	.			trans	-78.3	167.8	171.9	66.7	0	0	0	0	110.8	K299 D300 Y301	T297-K299 PolarHBondContact O-N 2.68Å; T297-D300 WeakPolarHBondContact CB-OD2 3.24Å; T297-D300 PolarHBondContact N-OD2 2.78Å; T297-D300 WeakPolarHBondContact O-CB 3.27Å; T297-D300 PolarHBondContact O-N 2.72Å; T297-D300 PolarHBondContact OG1-OD2 3.33Å; T297-Y301 PolarHBondContact O-N 2.82Å
298	F	78.6	Confident	57.2	Low	0 Å²	0	106.5 Å²	106.5	0%	0	55%	0.551	C	S	.	*	H	α-helix	trans	-61	-30.4	176.3	-173.1	-103.2	0	0	0	113	D300 Y301 V302 I315 A319 L320 Y323 L415 L416	F298-D300 VanDerWaalsContact C-N 3.29Å; F298-D300 PolarHBondContact O-N 3.16Å; F298-Y301 HydrophobicContact CD2-CD1 4.11Å; F298-Y301 AromaticContact CE2-CD1 3.94Å; F298-Y301 HydrophobicContact CE2-CD1 3.94Å; F298-Y301 HydrophobicContact CE2-CE1 4.4Å; F298-Y301 PolarHBondContact O-N 3.16Å; F298-V302 HydrophobicContact CD1-CG2 3.75Å; F298-V302 HydrophobicContact CE1-CG2 3.24Å; F298-V302 HydrophobicContact CE2-CG2 4.1Å; F298-V302 HydrophobicContact CG-CG2 4.36Å; F298-V302 HydrophobicContact CZ-CG2 3.45Å; F298-V302 VanDerWaalsContact CZ-CG2 3.45Å; F298-V302 WeakPolarHBondContact O-CG2 3.44Å; F298-V302 PolarHBondContact O-N 3.21Å; F298-I315 HydrophobicContact CD1-CG1 4.48Å; F298-I315 HydrophobicContact CD1-CG2 4.35Å; F298-I315 HydrophobicContact CE1-CB 4.13Å; F298-I315 HydrophobicContact CE1-CG1 4.12Å; F298-I315 HydrophobicContact CE1-CG2 3.66Å; F298-I315 HydrophobicContact CZ-CG2 4.28Å; F298-A319 HydrophobicContact CE2-CB 4.1Å; F298-A319 HydrophobicContact CZ-CB 3.98Å; F298-L320 HydrophobicContact CD1-CD1 4.42Å; F298-L320 HydrophobicContact CD2-CD1 3.91Å; F298-L320 HydrophobicContact CE2-CB 4.04Å; F298-L320 HydrophobicContact CE2-CD1 4.12Å; F298-L320 HydrophobicContact CG-CD1 4.07Å; F298-L320 HydrophobicContact CZ-CB 4Å; F298-L320 HydrophobicContact CZ-CD1 4.45Å; F298-Y323 HydrophobicContact CB-CE2 4.46Å; F298-Y323 HydrophobicContact CD2-CD1 4.26Å; F298-Y323 AromaticContact CD2-CD2 3.97Å; F298-Y323 HydrophobicContact CD2-CD2 3.97Å; F298-Y323 AromaticContact CD2-CG 3.79Å; F298-Y323 HydrophobicContact CD2-CG 3.79Å; F298-L415 PolarHBondContact N-O 3.29Å; F298-L416 HydrophobicContact CB-CD2 4.47Å; F298-L416 HydrophobicContact CD1-CD2 4.19Å
299	K	77.1	Confident	57.5	Low	29 Å²	29	104.8 Å²	104.8	13%	0.126	53%	0.533	C	S	.	.	H	α-helix	trans	-57	-38.7	171.8	179.6	169.3	-174.4	177.2	0	112.8	T297 R303 L416 G417 Y418 E422	T297-K299 PolarHBondContact O-N 2.68Å; K299-R303 WeakPolarHBondContact O-CB 3.41Å; K299-R303 PolarHBondContact O-N 2.93Å; K299-L416 WeakPolarHBondContact CB-O 3.33Å; K299-L416 PolarHBondContact N-O 2.89Å; K299-G417 WeakPolarHBondContact CD-O 3.41Å; K299-G417 PolarHBondContact NZ-O 2.95Å; K299-Y418 HydrophobicContact CB-CD2 3.84Å; K299-Y418 HydrophobicContact CB-CE2 3.48Å; K299-Y418 VanDerWaalsContact CB-CE2 3.48Å; K299-Y418 HydrophobicContact CD-CD1 3.85Å; K299-Y418 HydrophobicContact CD-CD2 3.95Å; K299-Y418 HydrophobicContact CD-CE1 3.81Å; K299-Y418 HydrophobicContact CD-CE2 3.92Å; K299-Y418 HydrophobicContact CD-CG 3.92Å; K299-Y418 HydrophobicContact CG-CD1 4.47Å; K299-Y418 HydrophobicContact CG-CD2 4.1Å; K299-Y418 HydrophobicContact CG-CE1 4.01Å; K299-Y418 HydrophobicContact CG-CE2 3.6Å; K299-E422 IonicContact NZ-OE1 3.1Å; K299-E422 PolarHBondContact NZ-OE1 3.1Å; K299-E422 IonicContact NZ-OE2 2.68Å; K299-E422 PolarHBondContact NZ-OE2 3.23Å
300	D	74.4	Confident	58.2	Low	76 Å²	76	106.6 Å²	106.6	41%	0.406	53%	0.534	S	S	.	.	H	α-helix	trans	-71.9	-46.5	177.3	-51.2	-56	0	0	0	110.3	T297 F298 V302 R303 E304	T297-D300 WeakPolarHBondContact CB-OD2 3.24Å; T297-D300 PolarHBondContact N-OD2 2.78Å; T297-D300 WeakPolarHBondContact O-CB 3.27Å; T297-D300 PolarHBondContact O-N 2.72Å; T297-D300 PolarHBondContact OG1-OD2 3.33Å; F298-D300 VanDerWaalsContact C-N 3.29Å; F298-D300 PolarHBondContact O-N 3.16Å; D300-V302 VanDerWaalsContact C-N 3.34Å; D300-V302 PolarHBondContact O-N 3.45Å; D300-R303 PolarHBondContact O-N 3.35Å; D300-E304 PolarHBondContact O-N 3.15Å
301	Y	72.3	Confident	58.9	Low	46 Å²	46	105.5 Å²	105.5	18%	0.18	53%	0.534	C	S	.	.	H	α-helix	trans	-61.3	-35.9	177.1	-178.3	-99	0	0	0	113.9	P294 T297 F298 R305 A319 Y323	P294-Y301 HydrophobicContact CB-CD2 3.99Å; P294-Y301 HydrophobicContact CG-CD2 4.27Å; T297-Y301 PolarHBondContact O-N 2.82Å; F298-Y301 HydrophobicContact CD2-CD1 4.11Å; F298-Y301 AromaticContact CE2-CD1 3.94Å; F298-Y301 HydrophobicContact CE2-CD1 3.94Å; F298-Y301 HydrophobicContact CE2-CE1 4.4Å; F298-Y301 PolarHBondContact O-N 3.16Å; Y301-R305 PolarHBondContact OH-NH1 2.88Å; Y301-R305 VanDerWaalsContact OH-NH1 3.09Å; Y301-A319 HydrophobicContact CE1-CB 4.4Å; Y301-Y323 HydrophobicContact CD1-CD2 4.44Å; Y301-Y323 HydrophobicContact CG-CD2 4.21Å
302	V	71.3	Confident	60.2	Low	25 Å²	25	107.9 Å²	107.9	15%	0.152	52%	0.521	C	S	.	.	H	α-helix	trans	-73.6	-43.7	173.3	170.9	0	0	0	0	110.8	F298 D300 E304 R305 S306	F298-V302 HydrophobicContact CD1-CG2 3.75Å; F298-V302 HydrophobicContact CE1-CG2 3.24Å; F298-V302 HydrophobicContact CE2-CG2 4.1Å; F298-V302 HydrophobicContact CG-CG2 4.36Å; F298-V302 HydrophobicContact CZ-CG2 3.45Å; F298-V302 VanDerWaalsContact CZ-CG2 3.45Å; F298-V302 WeakPolarHBondContact O-CG2 3.44Å; F298-V302 PolarHBondContact O-N 3.21Å; D300-V302 VanDerWaalsContact C-N 3.34Å; D300-V302 PolarHBondContact O-N 3.45Å; V302-E304 VanDerWaalsContact C-N 3.28Å; V302-E304 PolarHBondContact O-N 2.91Å; V302-R305 CarbonylContact O-C 3.57Å; V302-R305 PolarHBondContact O-N 3.17Å; V302-S306 VanDerWaalsContact O-CB 3.29Å; V302-S306 WeakPolarHBondContact O-CB 3.49Å; V302-S306 PolarHBondContact O-N 2.93Å; V302-S306 PolarHBondContact O-OG 3.2Å
303	R	69.6	Low	62	Low	167 Å²	167	101.1 Å²	101.1	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-59.7	-36.9	-179.6	180	176.6	-68.2	-177.7	-2.8	112.8	K299 D300 R305 S306	K299-R303 WeakPolarHBondContact O-CB 3.41Å; K299-R303 PolarHBondContact O-N 2.93Å; D300-R303 PolarHBondContact O-N 3.35Å; R303-R305 PolarHBondContact O-N 3.43Å; R303-S306 PolarHBondContact O-OG 2.93Å
304	E	60.2	Low	63.4	Low	166 Å²	166	93.7 Å²	93.7	78%	0.776	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.1	175.2	-168.7	175	-148.5	0	0	113.2	D300 V302	D300-E304 PolarHBondContact O-N 3.15Å; V302-E304 VanDerWaalsContact C-N 3.28Å; V302-E304 PolarHBondContact O-N 2.91Å
305	R	61.4	Low	64.8	Low	177 Å²	177	91.1 Å²	91.1	67%	0.668	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	-1.5	-175.3	-69.8	-178.3	164.8	-153.9	-7.8	114.7	Y301 V302 R303 D307	Y301-R305 PolarHBondContact OH-NH1 2.88Å; Y301-R305 VanDerWaalsContact OH-NH1 3.09Å; V302-R305 CarbonylContact O-C 3.57Å; V302-R305 PolarHBondContact O-N 3.17Å; R303-R305 PolarHBondContact O-N 3.43Å; R305-D307 PolarHBondContact O-N 3.49Å; R305-D307 VanDerWaalsContact O-N 3.14Å
306	S	56.8	Low	66.6	Low	53 Å²	53	82.9 Å²	82.9	37%	0.371	41%	0.414	S	S	.	.			trans	-87.2	79.1	-173.6	59.8	0	0	0	0	112.2	V302 R303	V302-S306 VanDerWaalsContact O-CB 3.29Å; V302-S306 WeakPolarHBondContact O-CB 3.49Å; V302-S306 PolarHBondContact O-N 2.93Å; V302-S306 PolarHBondContact O-OG 3.2Å; R303-S306 PolarHBondContact O-OG 2.93Å
307	D	48	Very low	67.5	Low	144 Å²	144	81.3 Å²	81.3	77%	0.77	40%	0.398	S	S	*	.			trans	-68.9	126.8	160.9	-170.7	11.9	0	0	0	109.9	R305 S309	R305-D307 PolarHBondContact O-N 3.49Å; R305-D307 VanDerWaalsContact O-N 3.14Å; D307-S309 PolarHBondContact O-N 2.98Å
308	L	47.1	Very low	67.8	Low	152 Å²	152	82.4 Å²	82.4	80%	0.796	41%	0.411	S	S	*	.			trans	-88.3	68.5	-146.7	-71.1	174	0	0	0	114.6
309	S	50.5	Low	68	Low	50 Å²	50	83.8 Å²	83.8	35%	0.35	42%	0.422	S	S	.	.			trans	-85.8	126.6	162.1	61.3	0	0	0	0	111	D307 D311 K312	D307-S309 PolarHBondContact O-N 2.98Å; S309-D311 PolarHBondContact O-N 2.72Å; S309-D311 VanDerWaalsContact O-N 3.15Å; S309-K312 WeakPolarHBondContact OG-CD 3.38Å; S309-K312 WeakPolarHBondContact OG-CE 3.34Å; S309-K312 WeakPolarHBondContact OG-CG 3.33Å; S309-K312 PolarHBondContact OG-NZ 2.63Å
310	K	54.2	Low	68.4	Low	204 Å²	204	82.4 Å²	82.4	89%	0.887	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-14.4	-173.2	-65.5	-178.9	179	178.8	0	115.1
311	D	53.7	Low	68.8	Low	145 Å²	145	79 Å²	79	78%	0.775	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	26.1	-169.8	-40.2	-77.7	0	0	0	113.6	S309	S309-D311 PolarHBondContact O-N 2.72Å; S309-D311 VanDerWaalsContact O-N 3.15Å
312	K	66.6	Low	69.2	Low	131 Å²	131	79.4 Å²	79.4	57%	0.57	42%	0.417	S	S	*	.	S	Bend	trans	-115.7	145.5	178.4	-71.2	179.2	-172.6	138.8	0	111.4	S309	S309-K312 WeakPolarHBondContact OG-CD 3.38Å; S309-K312 WeakPolarHBondContact OG-CE 3.34Å; S309-K312 WeakPolarHBondContact OG-CG 3.33Å; S309-K312 PolarHBondContact OG-NZ 2.63Å
313	P	73.3	Confident	69.5	Low	30 Å²	30	80.9 Å²	80.9	20%	0.195	42%	0.42	C	S	.	.			trans	-61.5	141.8	172.6	24.3	-33.1	0	0	0	111.6	I315 P316 E337 T340 D341	P313-I315 PolarHBondContact O-N 3Å; P313-P316 HydrophobicContact CG-CG 4.41Å; P313-E337 HydrophobicContact CB-CG 3.93Å; P313-E337 WeakPolarHBondContact CB-O 3.2Å; P313-E337 HydrophobicContact CG-CG 3.82Å; P313-T340 WeakPolarHBondContact CA-O 3.49Å; P313-D341 HydrophobicContact CB-CB 4.14Å
314	V	76.3	Confident	70.1	Confident	28 Å²	28	75.4 Å²	75.4	17%	0.17	41%	0.405	C	S	.	.	S	Bend	trans	-63.5	-29.6	174.4	-169	0	0	0	0	111.1	T340 Y418 L423 M426	V314-T340 HydrophobicContact CB-CG2 4.39Å; V314-T340 PolarHBondContact N-O 2.71Å; V314-Y418 HydrophobicContact CG1-CE2 4.45Å; V314-L423 HydrophobicContact CG1-CD2 4.32Å; V314-M426 HydrophobicContact CG1-CE 3.82Å; V314-M426 HydrophobicContact CG2-CE 4Å
315	I	81.8	Confident	71.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	40%	0.399	C	S	.	.	S	Bend	trans	-124.6	85.5	-179.7	-56.8	175	0	0	0	110.5	F298 P313 A317 L320 L336 E337 T340 L416 L423	F298-I315 HydrophobicContact CD1-CG1 4.48Å; F298-I315 HydrophobicContact CD1-CG2 4.35Å; F298-I315 HydrophobicContact CE1-CB 4.13Å; F298-I315 HydrophobicContact CE1-CG1 4.12Å; F298-I315 HydrophobicContact CE1-CG2 3.66Å; F298-I315 HydrophobicContact CZ-CG2 4.28Å; P313-I315 PolarHBondContact O-N 3Å; I315-A317 PolarHBondContact O-N 3.32Å; I315-L320 HydrophobicContact CG2-CB 4.32Å; I315-L320 HydrophobicContact CG2-CD2 3.87Å; I315-L336 HydrophobicContact CB-CG 4.42Å; I315-L336 HydrophobicContact CD1-CD1 4.07Å; I315-L336 HydrophobicContact CD1-CD2 4.06Å; I315-L336 HydrophobicContact CD1-CG 3.94Å; I315-L336 HydrophobicContact CG2-CD2 3.97Å; I315-L336 HydrophobicContact CG2-CG 4.04Å; I315-E337 WeakPolarHBondContact O-CA 3.34Å; I315-E337 VanDerWaalsContact O-CB 3.3Å; I315-E337 WeakPolarHBondContact O-CB 3.26Å; I315-T340 HydrophobicContact CB-CG2 4.25Å; I315-T340 WeakPolarHBondContact CB-OG1 3.48Å; I315-T340 HydrophobicContact CD1-CG2 3.78Å; I315-T340 HydrophobicContact CG1-CG2 3.94Å; I315-T340 PolarHBondContact N-OG1 3.25Å; I315-L416 HydrophobicContact CD1-CD1 3.7Å; I315-L416 HydrophobicContact CD1-CD2 3.97Å; I315-L416 HydrophobicContact CD1-CG 4.34Å; I315-L423 HydrophobicContact CD1-CD1 4.41Å
316	P	85.6	Confident	72	Confident	43 Å²	43	63.5 Å²	63.5	28%	0.279	38%	0.378	S	S	.	.			trans	-64.4	123.5	173.7	-19.7	32.2	0	0	0	111	P313 A318 A319 L320	P313-P316 HydrophobicContact CG-CG 4.41Å; P316-A318 PolarHBondContact O-N 2.86Å; P316-A319 HydrophobicContact CB-CB 4.11Å; P316-A319 WeakPolarHBondContact O-CB 3.32Å; P316-A319 PolarHBondContact O-N 3.16Å; P316-L320 PolarHBondContact O-N 2.86Å
317	A	84.3	Confident	73.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.2	-29.5	-174.7	0	0	0	0	0	112.5	I315 A321 I329 Q333 E337	I315-A317 PolarHBondContact O-N 3.32Å; A317-A321 VanDerWaalsContact O-CB 3.23Å; A317-A321 WeakPolarHBondContact O-CB 3.2Å; A317-A321 PolarHBondContact O-N 3.28Å; A317-I329 HydrophobicContact CB-CG2 3.79Å; A317-Q333 HydrophobicContact CB-CB 4.1Å; A317-Q333 WeakPolarHBondContact CB-O 3.14Å; A317-E337 HydrophobicContact CB-CB 3.92Å; A317-E337 HydrophobicContact CB-CG 4.45Å; A317-E337 WeakPolarHBondContact CB-OE2 3.03Å; A317-E337 PolarHBondContact N-OE2 3.32Å
318	A	81.6	Confident	75.4	Confident	64 Å²	64	61.3 Å²	61.3	53%	0.529	38%	0.379	S	S	.	.	H	α-helix	trans	-66.9	-39.7	174.2	0	0	0	0	0	112.2	P316 G322 I329	P316-A318 PolarHBondContact O-N 2.86Å; A318-G322 PolarHBondContact O-N 3.31Å; A318-G322 VanDerWaalsContact O-N 3.1Å; A318-I329 HydrophobicContact CB-CD1 3.99Å
319	A	82.8	Confident	77.5	Confident	29 Å²	29	55.8 Å²	55.8	24%	0.24	35%	0.35	C	S	.	.	H	α-helix	trans	-69.6	-42.4	176	0	0	0	0	0	111	F298 Y301 P316 G322 Y323	F298-A319 HydrophobicContact CE2-CB 4.1Å; F298-A319 HydrophobicContact CZ-CB 3.98Å; Y301-A319 HydrophobicContact CE1-CB 4.4Å; P316-A319 HydrophobicContact CB-CB 4.11Å; P316-A319 WeakPolarHBondContact O-CB 3.32Å; P316-A319 PolarHBondContact O-N 3.16Å; A319-G322 PolarHBondContact O-N 2.9Å; A319-Y323 WeakPolarHBondContact O-CB 3.38Å; A319-Y323 PolarHBondContact O-N 3.29Å
320	L	85.1	Confident	79.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-66.3	-38.2	177.4	-175	61.7	0	0	0	112.5	F298 I315 P316 G322 Y323 T324 W332 Q333 L336 L416	F298-L320 HydrophobicContact CD1-CD1 4.42Å; F298-L320 HydrophobicContact CD2-CD1 3.91Å; F298-L320 HydrophobicContact CE2-CB 4.04Å; F298-L320 HydrophobicContact CE2-CD1 4.12Å; F298-L320 HydrophobicContact CG-CD1 4.07Å; F298-L320 HydrophobicContact CZ-CB 4Å; F298-L320 HydrophobicContact CZ-CD1 4.45Å; I315-L320 HydrophobicContact CG2-CB 4.32Å; I315-L320 HydrophobicContact CG2-CD2 3.87Å; P316-L320 PolarHBondContact O-N 2.86Å; L320-G322 VanDerWaalsContact C-N 3.35Å; L320-Y323 PolarHBondContact O-N 3.06Å; L320-T324 HydrophobicContact CD1-CG2 4.19Å; L320-T324 WeakPolarHBondContact O-CB 3.37Å; L320-T324 WeakPolarHBondContact O-CG2 3.48Å; L320-T324 PolarHBondContact O-N 3.25Å; L320-T324 PolarHBondContact O-OG1 3.33Å; L320-W332 HydrophobicContact CD2-CH2 4.14Å; L320-W332 HydrophobicContact CD2-CZ3 3.88Å; L320-Q333 HydrophobicContact CD2-CB 4.41Å; L320-Q333 HydrophobicContact CD2-CG 4.13Å; L320-Q333 HydrophobicContact CG-CG 4.46Å; L320-L336 HydrophobicContact CD2-CD2 3.81Å; L320-L416 HydrophobicContact CD1-CD2 4.11Å; L320-L416 HydrophobicContact CD2-CD2 4.42Å
321	A	83.6	Confident	81.7	Confident	6 Å²	6	47 Å²	47	5%	0.05	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-37	173.4	0	0	0	0	0	112.4	A317 G325 S326 I329	A317-A321 VanDerWaalsContact O-CB 3.23Å; A317-A321 WeakPolarHBondContact O-CB 3.2Å; A317-A321 PolarHBondContact O-N 3.28Å; A321-G325 CarbonylContact O-C 3.59Å; A321-G325 PolarHBondContact O-N 3.43Å; A321-G325 VanDerWaalsContact O-N 3.13Å; A321-S326 WeakPolarHBondContact CA-OG 3.41Å; A321-S326 PolarHBondContact O-N 3.43Å; A321-I329 HydrophobicContact CB-CG1 4.09Å
322	G	78.9	Confident	83.7	Confident	54 Å²	54	41.2 Å²	41.2	56%	0.557	27%	0.274	S	S	*	.	H	α-helix	trans	-65.3	-49.9	171.9	0	0	0	0	0	112.7	A318 A319 L320 T324 G325	A318-G322 PolarHBondContact O-N 3.31Å; A318-G322 VanDerWaalsContact O-N 3.1Å; A319-G322 PolarHBondContact O-N 2.9Å; L320-G322 VanDerWaalsContact C-N 3.35Å; G322-T324 PolarHBondContact O-N 3.23Å; G322-G325 PolarHBondContact O-N 3.03Å; G322-G325 VanDerWaalsContact O-N 3.13Å
323	Y	78.4	Confident	85.1	Confident	56 Å²	56	35 Å²	35	22%	0.22	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-44.6	178	174.8	-82.9	0	0	0	112.4	P294 G296 F298 Y301 A319 L320 G325 L415	P294-Y323 HydrophobicContact CB-CD2 4.39Å; P294-Y323 HydrophobicContact CB-CE2 4.25Å; P294-Y323 HydrophobicContact CG-CD2 3.48Å; P294-Y323 VanDerWaalsContact CG-CD2 3.48Å; P294-Y323 HydrophobicContact CG-CE2 3.58Å; P294-Y323 HydrophobicContact CG-CG 4.48Å; G296-Y323 PolarHBondContact O-OH 3.29Å; F298-Y323 HydrophobicContact CB-CE2 4.46Å; F298-Y323 HydrophobicContact CD2-CD1 4.26Å; F298-Y323 AromaticContact CD2-CD2 3.97Å; F298-Y323 HydrophobicContact CD2-CD2 3.97Å; F298-Y323 AromaticContact CD2-CG 3.79Å; F298-Y323 HydrophobicContact CD2-CG 3.79Å; Y301-Y323 HydrophobicContact CD1-CD2 4.44Å; Y301-Y323 HydrophobicContact CG-CD2 4.21Å; A319-Y323 WeakPolarHBondContact O-CB 3.38Å; A319-Y323 PolarHBondContact O-N 3.29Å; L320-Y323 PolarHBondContact O-N 3.06Å; Y323-G325 VanDerWaalsContact C-N 3.28Å; Y323-G325 PolarHBondContact O-N 3.05Å; Y323-L415 HydrophobicContact CD1-CD1 4.43Å; Y323-L415 HydrophobicContact CE1-CD1 3.97Å
324	T	81.8	Confident	86.2	Confident	51 Å²	51	33.6 Å²	33.6	31%	0.313	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-3.6	178.7	53.7	0	0	0	0	114	L320 G322 S326 Q333 L415	L320-T324 HydrophobicContact CD1-CG2 4.19Å; L320-T324 WeakPolarHBondContact O-CB 3.37Å; L320-T324 WeakPolarHBondContact O-CG2 3.48Å; L320-T324 PolarHBondContact O-N 3.25Å; L320-T324 PolarHBondContact O-OG1 3.33Å; G322-T324 PolarHBondContact O-N 3.23Å; T324-S326 PolarHBondContact O-N 2.87Å; T324-S326 VanDerWaalsContact O-N 3.13Å; T324-S326 WeakPolarHBondContact OG1-CB 3.39Å; T324-S326 PolarHBondContact OG1-OG 3.02Å; T324-Q333 PolarHBondContact OG1-NE2 2.68Å; T324-L415 HydrophobicContact CG2-CD1 3.84Å
325	G	81	Confident	87.2	Confident	63 Å²	63	32.3 Å²	32.3	65%	0.649	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	17.1	-174.2	0	0	0	0	0	114.2	A321 G322 Y323 G327	A321-G325 CarbonylContact O-C 3.59Å; A321-G325 PolarHBondContact O-N 3.43Å; A321-G325 VanDerWaalsContact O-N 3.13Å; G322-G325 PolarHBondContact O-N 3.03Å; G322-G325 VanDerWaalsContact O-N 3.13Å; Y323-G325 VanDerWaalsContact C-N 3.28Å; Y323-G325 PolarHBondContact O-N 3.05Å; G325-G327 PolarHBondContact O-N 3.02Å
326	S	80.6	Confident	87.9	Confident	30 Å²	30	32.3 Å²	32.3	21%	0.21	23%	0.23	C	C	.	.			trans	-74.8	9.5	-163.7	75.9	0	0	0	0	115.4	A321 T324 Q333	A321-S326 WeakPolarHBondContact CA-OG 3.41Å; A321-S326 PolarHBondContact O-N 3.43Å; T324-S326 PolarHBondContact O-N 2.87Å; T324-S326 VanDerWaalsContact O-N 3.13Å; T324-S326 WeakPolarHBondContact OG1-CB 3.39Å; T324-S326 PolarHBondContact OG1-OG 3.02Å; S326-Q333 PolarHBondContact OG-NE2 3.45Å; S326-Q333 PolarHBondContact OG-OE1 2.9Å
327	G	88.1	Confident	88.3	Confident	48 Å²	48	31.2 Å²	31.2	50%	0.495	22%	0.221	S	C	.	.	S	Bend	trans	62.1	-134.7	-173.9	0	0	0	0	0	112.4	G325 I329	G325-G327 PolarHBondContact O-N 3.02Å; G327-I329 PolarHBondContact O-N 3.37Å
328	P	89.1	Confident	88.8	Confident	103 Å²	103	31.6 Å²	31.6	67%	0.669	22%	0.223	S	C	*	.	S	Bend	trans	-60.5	132.1	-178.8	-22.9	33.6	0	0	0	113.4	Q330	P328-Q330 PolarHBondContact O-N 3.12Å
329	I	91.2	Very high	89.5	Confident	37 Å²	37	28.8 Å²	28.8	19%	0.19	20%	0.199	C	C	.	.			trans	-43.7	126.9	179.9	-61.3	171.2	0	0	0	112	A317 A318 A321 G327 Q333 F334 W369 K373	A317-I329 HydrophobicContact CB-CG2 3.79Å; A318-I329 HydrophobicContact CB-CD1 3.99Å; A321-I329 HydrophobicContact CB-CG1 4.09Å; G327-I329 PolarHBondContact O-N 3.37Å; I329-Q333 HydrophobicContact CG2-CB 4.44Å; I329-F334 HydrophobicContact CG2-CB 4.35Å; I329-W369 HydrophobicContact CG2-CZ3 4.47Å; I329-K373 PolarHBondContact O-NZ 3.41Å
330	Q	94.8	Very high	90	Very high	62 Å²	62	27.5 Å²	27.5	29%	0.29	19%	0.188	S	C	.	.			trans	-93.5	161.3	-178.5	-53.8	-171	12.3	0	0	111.5	P328 W332 Q333 F334	P328-Q330 PolarHBondContact O-N 3.12Å; Q330-W332 PolarHBondContact O-N 3.33Å; Q330-Q333 HydrophobicContact CB-CG 4.4Å; Q330-Q333 PolarHBondContact O-N 2.72Å; Q330-F334 PolarHBondContact O-N 3.22Å; Q330-F334 VanDerWaalsContact O-N 3.12Å
331	L	96.9	Very high	90.2	Very high	8 Å²	8	28.9 Å²	28.9	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-63.3	-41.2	-177	171.1	63.5	0	0	0	111.7	Q333 F334 L335 W369 L383 L387 Y390	L331-Q333 PolarHBondContact O-N 3.42Å; L331-F334 HydrophobicContact CD1-CD1 4.32Å; L331-F334 PolarHBondContact O-N 3.12Å; L331-L335 HydrophobicContact CD1-CD1 3.97Å; L331-L335 HydrophobicContact CD1-CD2 4.38Å; L331-L335 HydrophobicContact CD1-CG 3.94Å; L331-L335 HydrophobicContact CG-CD1 3.93Å; L331-L335 HydrophobicContact CG-CG 4.35Å; L331-L335 WeakPolarHBondContact O-CG 3.08Å; L331-L335 PolarHBondContact O-N 2.96Å; L331-W369 HydrophobicContact CB-CH2 4.16Å; L331-W369 HydrophobicContact CB-CZ2 3.73Å; L331-W369 HydrophobicContact CD1-CD2 3.89Å; L331-W369 HydrophobicContact CD1-CE3 4.45Å; L331-W369 HydrophobicContact CD1-CG 3.99Å; L331-W369 HydrophobicContact CD1-CZ2 4.38Å; L331-L383 HydrophobicContact CD1-CD1 3.95Å; L331-L383 HydrophobicContact CD1-CG 4.03Å; L331-L383 HydrophobicContact CD2-CD2 4.48Å; L331-L383 HydrophobicContact CD2-CG 4.08Å; L331-L387 HydrophobicContact CD2-CD2 4.27Å; L331-L387 HydrophobicContact CD2-CG 4.32Å; L331-Y390 HydrophobicContact CB-CE2 3.93Å; L331-Y390 HydrophobicContact CD2-CE2 4.21Å; L331-Y390 HydrophobicContact CG-CE2 4.19Å; L331-Y390 PolarHBondContact N-OH 3.35Å
332	W	96.8	Very high	90.5	Very high	23 Å²	23	33.6 Å²	33.6	9%	0.087	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-39.5	179.2	72.7	-96.1	0	0	0	112.7	L320 Q330 L335 L336 Y390 I395 I396 F408 L412 L415	L320-W332 HydrophobicContact CD2-CH2 4.14Å; L320-W332 HydrophobicContact CD2-CZ3 3.88Å; Q330-W332 PolarHBondContact O-N 3.33Å; W332-L335 PolarHBondContact O-N 3.31Å; W332-L336 HydrophobicContact CZ3-CD2 4.5Å; W332-L336 WeakPolarHBondContact O-CB 3.48Å; W332-L336 PolarHBondContact O-N 3.47Å; W332-Y390 HydrophobicContact CB-CD2 4.4Å; W332-Y390 HydrophobicContact CB-CE2 3.89Å; W332-Y390 AromaticContact CD1-CE1 3.88Å; W332-Y390 AromaticContact CD1-CZ 3.71Å; W332-Y390 PolarHBondContact N-OH 3.32Å; W332-I395 HydrophobicContact CB-CG2 3.83Å; W332-I395 HydrophobicContact CD2-CG2 4.13Å; W332-I395 HydrophobicContact CG-CG2 3.74Å; W332-I396 HydrophobicContact CB-CD1 3.88Å; W332-F408 HydrophobicContact CB-CE1 4.13Å; W332-F408 HydrophobicContact CE3-CE1 4.33Å; W332-L412 HydrophobicContact CZ3-CD2 4.42Å; W332-L415 HydrophobicContact CH2-CD2 3.88Å; W332-L415 HydrophobicContact CZ3-CD2 4.14Å
333	Q	95.1	Very high	91.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-40.5	175.3	-63.2	167.9	-34.4	0	0	111.4	A317 L320 T324 S326 I329 Q330 L331 L336 E337	A317-Q333 HydrophobicContact CB-CB 4.1Å; A317-Q333 WeakPolarHBondContact CB-O 3.14Å; L320-Q333 HydrophobicContact CD2-CB 4.41Å; L320-Q333 HydrophobicContact CD2-CG 4.13Å; L320-Q333 HydrophobicContact CG-CG 4.46Å; T324-Q333 PolarHBondContact OG1-NE2 2.68Å; S326-Q333 PolarHBondContact OG-NE2 3.45Å; S326-Q333 PolarHBondContact OG-OE1 2.9Å; I329-Q333 HydrophobicContact CG2-CB 4.44Å; Q330-Q333 HydrophobicContact CB-CG 4.4Å; Q330-Q333 PolarHBondContact O-N 2.72Å; L331-Q333 PolarHBondContact O-N 3.42Å; Q333-L336 PolarHBondContact O-N 3.43Å; Q333-E337 PolarHBondContact O-N 3.2Å
334	F	96.9	Very high	91.9	Very high	1 Å²	1	32.1 Å²	32.1	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-68.1	-39.1	177	170.4	-101.2	0	0	0	112.8	I329 Q330 L331 L336 E337 L338 R368 W369 R372	I329-F334 HydrophobicContact CG2-CB 4.35Å; Q330-F334 PolarHBondContact O-N 3.22Å; Q330-F334 VanDerWaalsContact O-N 3.12Å; L331-F334 HydrophobicContact CD1-CD1 4.32Å; L331-F334 PolarHBondContact O-N 3.12Å; F334-L336 VanDerWaalsContact C-N 3.33Å; F334-E337 WeakPolarHBondContact O-CB 3.18Å; F334-E337 PolarHBondContact O-N 2.89Å; F334-L338 HydrophobicContact CD1-CD1 4.31Å; F334-L338 HydrophobicContact CE1-CD1 3.57Å; F334-L338 HydrophobicContact CE1-CG 4.24Å; F334-L338 HydrophobicContact CE2-CD1 4.38Å; F334-L338 HydrophobicContact CE2-CD2 4.24Å; F334-L338 HydrophobicContact CE2-CG 4.27Å; F334-L338 HydrophobicContact CZ-CD1 3.61Å; F334-L338 HydrophobicContact CZ-CD2 4.11Å; F334-L338 HydrophobicContact CZ-CG 3.99Å; F334-L338 WeakPolarHBondContact O-CG 3.33Å; F334-L338 PolarHBondContact O-N 3.3Å; F334-L338 VanDerWaalsContact O-N 3.12Å; F334-R368 HydrophobicContact CZ-CB 3.8Å; F334-W369 HydrophobicContact CB-CE3 3.76Å; F334-W369 HydrophobicContact CB-CZ3 3.55Å; F334-W369 HydrophobicContact CD1-CB 4.08Å; F334-W369 HydrophobicContact CD1-CD2 4.03Å; F334-W369 AromaticContact CD1-CE3 3.4Å; F334-W369 HydrophobicContact CD1-CE3 3.4Å; F334-W369 VanDerWaalsContact CD1-CE3 3.4Å; F334-W369 HydrophobicContact CD1-CG 4.34Å; F334-W369 HydrophobicContact CD1-CZ3 4.12Å; F334-W369 HydrophobicContact CD2-CE3 4.09Å; F334-W369 HydrophobicContact CD2-CZ3 4.43Å; F334-W369 HydrophobicContact CE1-CB 3.6Å; F334-W369 HydrophobicContact CE1-CD2 4.43Å; F334-W369 AromaticContact CE1-CE3 3.99Å; F334-W369 HydrophobicContact CE1-CE3 3.99Å; F334-W369 HydrophobicContact CE1-CG 4.34Å; F334-W369 HydrophobicContact CG-CD2 4.49Å; F334-W369 AromaticContact CG-CE3 3.45Å; F334-W369 HydrophobicContact CG-CE3 3.45Å; F334-W369 VanDerWaalsContact CG-CE3 3.45Å; F334-W369 AromaticContact CG-CZ3 3.77Å; F334-W369 HydrophobicContact CG-CZ3 3.77Å; F334-W369 HydrophobicContact CZ-CB 4.25Å; F334-R372 HydrophobicContact CD2-CB 4.24Å; F334-R372 HydrophobicContact CD2-CG 3.9Å; F334-R372 HydrophobicContact CE2-CB 4Å; F334-R372 HydrophobicContact CE2-CG 4.13Å
335	L	97.6	Very high	92.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-40	174	-68.1	168.4	0	0	0	111.1	L331 W332 E337 L338 L339 I348 F357 L359 V365 L387 I396	L331-L335 HydrophobicContact CD1-CD1 3.97Å; L331-L335 HydrophobicContact CD1-CD2 4.38Å; L331-L335 HydrophobicContact CD1-CG 3.94Å; L331-L335 HydrophobicContact CG-CD1 3.93Å; L331-L335 HydrophobicContact CG-CG 4.35Å; L331-L335 WeakPolarHBondContact O-CG 3.08Å; L331-L335 PolarHBondContact O-N 2.96Å; W332-L335 PolarHBondContact O-N 3.31Å; L335-E337 VanDerWaalsContact C-N 3.33Å; L335-E337 PolarHBondContact O-N 3.03Å; L335-L338 PolarHBondContact O-N 3.19Å; L335-L339 VanDerWaalsContact O-CB 3.3Å; L335-L339 WeakPolarHBondContact O-CB 3.47Å; L335-L339 WeakPolarHBondContact O-CD1 3.42Å; L335-L339 VanDerWaalsContact O-CG 3.27Å; L335-L339 WeakPolarHBondContact O-CG 3.44Å; L335-L339 PolarHBondContact O-N 2.89Å; L335-I348 HydrophobicContact CB-CD1 4.41Å; L335-I348 HydrophobicContact CD2-CD1 3.66Å; L335-F357 HydrophobicContact CD1-CZ 4.42Å; L335-L359 HydrophobicContact CD2-CD2 4.42Å; L335-V365 HydrophobicContact CD2-CG1 3.64Å; L335-L387 HydrophobicContact CD1-CD2 3.64Å; L335-I396 HydrophobicContact CD1-CD1 4.31Å
336	L	95.5	Very high	93.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-32.7	175.6	-173.9	61.2	0	0	0	113.1	I315 L320 W332 Q333 F334 T340 W350 F408 L412 L416	I315-L336 HydrophobicContact CB-CG 4.42Å; I315-L336 HydrophobicContact CD1-CD1 4.07Å; I315-L336 HydrophobicContact CD1-CD2 4.06Å; I315-L336 HydrophobicContact CD1-CG 3.94Å; I315-L336 HydrophobicContact CG2-CD2 3.97Å; I315-L336 HydrophobicContact CG2-CG 4.04Å; L320-L336 HydrophobicContact CD2-CD2 3.81Å; W332-L336 HydrophobicContact CZ3-CD2 4.5Å; W332-L336 WeakPolarHBondContact O-CB 3.48Å; W332-L336 PolarHBondContact O-N 3.47Å; Q333-L336 PolarHBondContact O-N 3.43Å; F334-L336 VanDerWaalsContact C-N 3.33Å; L336-T340 WeakPolarHBondContact O-CG2 3.3Å; L336-T340 PolarHBondContact O-N 3.46Å; L336-T340 VanDerWaalsContact O-N 3.15Å; L336-T340 PolarHBondContact O-OG1 3.42Å; L336-W350 HydrophobicContact CD1-CH2 3.99Å; L336-W350 HydrophobicContact CD1-CZ2 3.87Å; L336-F408 HydrophobicContact CB-CZ 4.24Å; L336-L412 HydrophobicContact CD1-CD1 4.43Å; L336-L412 HydrophobicContact CD2-CD2 4.39Å; L336-L416 HydrophobicContact CD1-CD1 4.45Å; L336-L416 HydrophobicContact CD2-CD1 3.95Å; L336-L416 HydrophobicContact CD2-CD2 4.07Å
337	E	94.3	Very high	93.9	Very high	21 Å²	21	33.6 Å²	33.6	10%	0.098	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-48.9	170.7	-179.7	-168.4	101.7	0	0	111.8	P313 I315 A317 Q333 F334 L335 L339 T340 D341 R372	P313-E337 HydrophobicContact CB-CG 3.93Å; P313-E337 WeakPolarHBondContact CB-O 3.2Å; P313-E337 HydrophobicContact CG-CG 3.82Å; I315-E337 WeakPolarHBondContact O-CA 3.34Å; I315-E337 VanDerWaalsContact O-CB 3.3Å; I315-E337 WeakPolarHBondContact O-CB 3.26Å; A317-E337 HydrophobicContact CB-CB 3.92Å; A317-E337 HydrophobicContact CB-CG 4.45Å; A317-E337 WeakPolarHBondContact CB-OE2 3.03Å; A317-E337 PolarHBondContact N-OE2 3.32Å; Q333-E337 PolarHBondContact O-N 3.2Å; F334-E337 WeakPolarHBondContact O-CB 3.18Å; F334-E337 PolarHBondContact O-N 2.89Å; L335-E337 VanDerWaalsContact C-N 3.33Å; L335-E337 PolarHBondContact O-N 3.03Å; E337-L339 VanDerWaalsContact C-N 3.33Å; E337-L339 PolarHBondContact O-N 2.75Å; E337-T340 PolarHBondContact O-N 3.13Å; E337-T340 VanDerWaalsContact O-N 3.16Å; E337-T340 PolarHBondContact O-OG1 2.97Å; E337-D341 PolarHBondContact O-N 3.09Å; E337-R372 IonicContact OE1-CZ 2.64Å; E337-R372 IonicContact OE1-NH1 3.54Å; E337-R372 PolarHBondContact OE1-NH1 3.31Å; E337-R372 IonicContact OE1-NH2 3.57Å; E337-R372 PolarHBondContact OE1-NH2 3.5Å; E337-R372 IonicContact OE2-CZ 2.65Å; E337-R372 IonicContact OE2-NH1 3.95Å; E337-R372 PolarHBondContact OE2-NH1 2.84Å; E337-R372 IonicContact OE2-NH2 2.79Å
338	L	95.5	Very high	94.3	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-40.7	176.1	-60.3	177.8	0	0	0	111.6	F334 L335 T340 D341 C344 F347 I348 V365	F334-L338 HydrophobicContact CD1-CD1 4.31Å; F334-L338 HydrophobicContact CE1-CD1 3.57Å; F334-L338 HydrophobicContact CE1-CG 4.24Å; F334-L338 HydrophobicContact CE2-CD1 4.38Å; F334-L338 HydrophobicContact CE2-CD2 4.24Å; F334-L338 HydrophobicContact CE2-CG 4.27Å; F334-L338 HydrophobicContact CZ-CD1 3.61Å; F334-L338 HydrophobicContact CZ-CD2 4.11Å; F334-L338 HydrophobicContact CZ-CG 3.99Å; F334-L338 WeakPolarHBondContact O-CG 3.33Å; F334-L338 PolarHBondContact O-N 3.3Å; F334-L338 VanDerWaalsContact O-N 3.12Å; L335-L338 PolarHBondContact O-N 3.19Å; L338-T340 PolarHBondContact O-N 3.19Å; L338-D341 PolarHBondContact O-N 3.31Å; L338-D341 VanDerWaalsContact O-N 3.15Å; L338-C344 HydrophobicContact CB-CB 4.21Å; L338-C344 VanDerWaalsContact O-CB 3.24Å; L338-C344 WeakPolarHBondContact O-CB 3.48Å; L338-F347 HydrophobicContact CD1-CE2 4.36Å; L338-F347 HydrophobicContact CD2-CE2 4.46Å; L338-I348 HydrophobicContact CB-CD1 4.45Å; L338-I348 HydrophobicContact CB-CG2 3.57Å; L338-I348 HydrophobicContact CD1-CG2 4.1Å; L338-I348 HydrophobicContact CG-CG2 4.47Å; L338-V365 HydrophobicContact CD1-CG1 4.29Å
339	L	95.6	Very high	94.7	Very high	6 Å²	6	27.6 Å²	27.6	3%	0.031	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.1	177.2	-78.4	165.6	0	0	0	114.1	L335 E337 I348 W350 F357 F408 L427	L335-L339 VanDerWaalsContact O-CB 3.3Å; L335-L339 WeakPolarHBondContact O-CB 3.47Å; L335-L339 WeakPolarHBondContact O-CD1 3.42Å; L335-L339 VanDerWaalsContact O-CG 3.27Å; L335-L339 WeakPolarHBondContact O-CG 3.44Å; L335-L339 PolarHBondContact O-N 2.89Å; E337-L339 VanDerWaalsContact C-N 3.33Å; E337-L339 PolarHBondContact O-N 2.75Å; L339-I348 HydrophobicContact CD1-CD1 4.27Å; L339-I348 HydrophobicContact CD2-CD1 4.24Å; L339-I348 HydrophobicContact CD2-CG1 3.69Å; L339-I348 HydrophobicContact CG-CD1 3.86Å; L339-I348 HydrophobicContact CG-CG1 3.86Å; L339-W350 HydrophobicContact CB-CH2 4.41Å; L339-W350 HydrophobicContact CB-CZ2 3.66Å; L339-W350 HydrophobicContact CD1-CH2 3.9Å; L339-W350 HydrophobicContact CD1-CZ2 3.99Å; L339-W350 HydrophobicContact CD1-CZ3 4.18Å; L339-W350 HydrophobicContact CD2-CD2 4.08Å; L339-W350 HydrophobicContact CD2-CG 4.25Å; L339-W350 HydrophobicContact CG-CZ2 4.28Å; L339-W350 PolarHBondContact O-NE1 3.29Å; L339-F357 HydrophobicContact CD1-CB 3.78Å; L339-F357 HydrophobicContact CD1-CD1 4.02Å; L339-F357 HydrophobicContact CD1-CD2 3.89Å; L339-F357 HydrophobicContact CD1-CE2 4.46Å; L339-F357 HydrophobicContact CD1-CG 3.64Å; L339-F357 HydrophobicContact CD2-CB 3.69Å; L339-F357 HydrophobicContact CD2-CG 4.35Å; L339-F357 HydrophobicContact CG-CB 4.4Å; L339-F408 HydrophobicContact CD1-CE2 3.81Å; L339-F408 HydrophobicContact CD1-CZ 4.43Å; L339-L427 VanDerWaalsContact O-CD1 3.23Å; L339-L427 WeakPolarHBondContact O-CD1 3.33Å
340	T	92.5	Very high	94.9	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.012	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	14.3	174.7	55.7	0	0	0	0	113.5	P313 V314 I315 L336 E337 L338 L423 L427	P313-T340 WeakPolarHBondContact CA-O 3.49Å; V314-T340 HydrophobicContact CB-CG2 4.39Å; V314-T340 PolarHBondContact N-O 2.71Å; I315-T340 HydrophobicContact CB-CG2 4.25Å; I315-T340 WeakPolarHBondContact CB-OG1 3.48Å; I315-T340 HydrophobicContact CD1-CG2 3.78Å; I315-T340 HydrophobicContact CG1-CG2 3.94Å; I315-T340 PolarHBondContact N-OG1 3.25Å; L336-T340 WeakPolarHBondContact O-CG2 3.3Å; L336-T340 PolarHBondContact O-N 3.46Å; L336-T340 VanDerWaalsContact O-N 3.15Å; L336-T340 PolarHBondContact O-OG1 3.42Å; E337-T340 PolarHBondContact O-N 3.13Å; E337-T340 VanDerWaalsContact O-N 3.16Å; E337-T340 PolarHBondContact O-OG1 2.97Å; L338-T340 PolarHBondContact O-N 3.19Å; T340-L423 HydrophobicContact CG2-CD2 4.06Å; T340-L427 HydrophobicContact CG2-CD1 4.37Å
341	D	90.1	Very high	95	Very high	28 Å²	28	23.7 Å²	23.7	15%	0.15	13%	0.132	C	C	.	.			trans	-110.6	117.7	172.6	179.8	-7.7	0	0	0	110	P313 E337 L338 S343 C344	P313-D341 HydrophobicContact CB-CB 4.14Å; E337-D341 PolarHBondContact O-N 3.09Å; L338-D341 PolarHBondContact O-N 3.31Å; L338-D341 VanDerWaalsContact O-N 3.15Å; D341-S343 PolarHBondContact O-N 3.2Å; D341-S343 WeakPolarHBondContact OD1-CA 3.27Å; D341-S343 VanDerWaalsContact OD1-CB 3.27Å; D341-S343 WeakPolarHBondContact OD1-CB 3.48Å; D341-S343 PolarHBondContact OD1-N 3.37Å; D341-S343 PolarHBondContact OD1-OG 3.4Å; D341-S343 PolarHBondContact OD2-OG 3.39Å; D341-C344 HydrophobicContact CB-CB 4.1Å; D341-C344 VanDerWaalsContact CG-SG 3.58Å; D341-C344 WeakPolarHBondContact O-CB 3.2Å; D341-C344 PolarHBondContact O-N 3.24Å; D341-C344 PolarHBondContact OD2-SG 3.37Å
342	K	90.6	Very high	94.8	Very high	105 Å²	105	24.6 Å²	24.6	46%	0.457	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-60.2	-28	178	-70.9	-171.6	173.7	-178.7	0	112.9	C344 M426 L427 D428	K342-C344 PolarHBondContact O-N 3.07Å; K342-M426 WeakPolarHBondContact CE-O 3.45Å; K342-M426 PolarHBondContact NZ-O 3.31Å; K342-L427 VanDerWaalsContact CE-CA 3.42Å; K342-L427 HydrophobicContact CG-CD2 4.1Å; K342-D428 IonicContact NZ-OD2 3.93Å; K342-D428 PolarHBondContact NZ-OD2 3.48Å
343	S	91.8	Very high	94.7	Very high	79 Å²	79	27.7 Å²	27.7	55%	0.552	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-73.1	-12	177.1	80.3	0	0	0	0	113.8	D341	D341-S343 PolarHBondContact O-N 3.2Å; D341-S343 WeakPolarHBondContact OD1-CA 3.27Å; D341-S343 VanDerWaalsContact OD1-CB 3.27Å; D341-S343 WeakPolarHBondContact OD1-CB 3.48Å; D341-S343 PolarHBondContact OD1-N 3.37Å; D341-S343 PolarHBondContact OD1-OG 3.4Å; D341-S343 PolarHBondContact OD2-OG 3.39Å
344	C	93.3	Very high	94.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-96.4	-10.7	-178	-68.9	0	0	0	0	114.5	L338 D341 K342 S346 F347 I348	L338-C344 HydrophobicContact CB-CB 4.21Å; L338-C344 VanDerWaalsContact O-CB 3.24Å; L338-C344 WeakPolarHBondContact O-CB 3.48Å; D341-C344 HydrophobicContact CB-CB 4.1Å; D341-C344 VanDerWaalsContact CG-SG 3.58Å; D341-C344 WeakPolarHBondContact O-CB 3.2Å; D341-C344 PolarHBondContact O-N 3.24Å; D341-C344 PolarHBondContact OD2-SG 3.37Å; K342-C344 PolarHBondContact O-N 3.07Å; C344-S346 PolarHBondContact O-N 3.06Å; C344-F347 HydrophobicContact CB-CE1 4.27Å; C344-F347 HydrophobicContact CB-CE2 3.76Å; C344-F347 HydrophobicContact CB-CZ 3.49Å; C344-F347 VanDerWaalsContact CB-CZ 3.49Å; C344-F347 PolarHBondContact O-N 3.19Å; C344-F347 VanDerWaalsContact O-N 3.1Å; C344-F347 WeakPolarHBondContact SG-CZ 3.5Å; C344-I348 HydrophobicContact CB-CG2 4.17Å; C344-I348 PolarHBondContact O-N 3.05Å
345	Q	93.2	Very high	94.7	Very high	67 Å²	67	30.1 Å²	30.1	31%	0.313	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-23	-172.4	-67.9	-176	3.9	0	0	115	F347 I348 L427	Q345-F347 VanDerWaalsContact C-N 3.28Å; Q345-F347 PolarHBondContact O-N 2.95Å; Q345-I348 WeakPolarHBondContact CA-O 3.45Å; Q345-L427 PolarHBondContact NE2-O 3.45Å
346	S	95.4	Very high	94.7	Very high	98 Å²	98	30.4 Å²	30.4	69%	0.685	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.6	178.3	52.2	0	0	0	0	114.1	C344	C344-S346 PolarHBondContact O-N 3.06Å
347	F	96.8	Very high	94.8	Very high	11 Å²	11	30.4 Å²	30.4	5%	0.048	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-19.2	179.7	51.7	-94.5	0	0	0	113.9	L338 C344 Q345 L359 S360 D361 E364 V365 R368	L338-F347 HydrophobicContact CD1-CE2 4.36Å; L338-F347 HydrophobicContact CD2-CE2 4.46Å; C344-F347 HydrophobicContact CB-CE1 4.27Å; C344-F347 HydrophobicContact CB-CE2 3.76Å; C344-F347 HydrophobicContact CB-CZ 3.49Å; C344-F347 VanDerWaalsContact CB-CZ 3.49Å; C344-F347 PolarHBondContact O-N 3.19Å; C344-F347 VanDerWaalsContact O-N 3.1Å; C344-F347 WeakPolarHBondContact SG-CZ 3.5Å; Q345-F347 VanDerWaalsContact C-N 3.28Å; Q345-F347 PolarHBondContact O-N 2.95Å; F347-L359 CarbonylContact O-C 3.55Å; F347-S360 PolarHBondContact O-N 3.35Å; F347-D361 HydrophobicContact CB-CB 3.69Å; F347-D361 PolarHBondContact O-N 3.41Å; F347-D361 VanDerWaalsContact O-N 3.09Å; F347-E364 HydrophobicContact CB-CB 4.21Å; F347-E364 HydrophobicContact CB-CG 4.05Å; F347-E364 HydrophobicContact CD1-CG 3.78Å; F347-E364 HydrophobicContact CD2-CG 3.96Å; F347-E364 HydrophobicContact CE1-CG 4.21Å; F347-E364 HydrophobicContact CE2-CG 4.37Å; F347-E364 HydrophobicContact CG-CB 4.33Å; F347-E364 HydrophobicContact CG-CG 3.65Å; F347-E364 HydrophobicContact CZ-CG 4.48Å; F347-V365 HydrophobicContact CD2-CG2 3.74Å; F347-R368 VanDerWaalsContact CZ-NE 3.33Å
348	I	97.6	Very high	95	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	122.7	172.4	-177.4	172.5	0	0	0	111.2	L335 L338 L339 C344 Q345 F357 K358 L359 V365	L335-I348 HydrophobicContact CB-CD1 4.41Å; L335-I348 HydrophobicContact CD2-CD1 3.66Å; L338-I348 HydrophobicContact CB-CD1 4.45Å; L338-I348 HydrophobicContact CB-CG2 3.57Å; L338-I348 HydrophobicContact CD1-CG2 4.1Å; L338-I348 HydrophobicContact CG-CG2 4.47Å; L339-I348 HydrophobicContact CD1-CD1 4.27Å; L339-I348 HydrophobicContact CD2-CD1 4.24Å; L339-I348 HydrophobicContact CD2-CG1 3.69Å; L339-I348 HydrophobicContact CG-CD1 3.86Å; L339-I348 HydrophobicContact CG-CG1 3.86Å; C344-I348 HydrophobicContact CB-CG2 4.17Å; C344-I348 PolarHBondContact O-N 3.05Å; Q345-I348 WeakPolarHBondContact CA-O 3.45Å; I348-F357 HydrophobicContact CD1-CD2 4.35Å; I348-F357 HydrophobicContact CG1-CD2 4.48Å; I348-K358 WeakPolarHBondContact CA-O 3.4Å; I348-L359 HydrophobicContact CB-CD2 4.33Å; I348-L359 HydrophobicContact CD1-CD2 3.49Å; I348-L359 VanDerWaalsContact CD1-CD2 3.49Å; I348-L359 HydrophobicContact CG1-CD2 3.74Å; I348-V365 HydrophobicContact CB-CG2 3.88Å; I348-V365 HydrophobicContact CG2-CG2 4.2Å
349	S	96.5	Very high	95.1	Very high	24 Å²	24	32.2 Å²	32.2	17%	0.168	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	157.2	-176.6	67.4	0	0	0	0	112.2	F357 K358	S349-F357 CarbonylContact O-C 3.54Å; S349-F357 VanDerWaalsContact O-CA 3.25Å; S349-F357 WeakPolarHBondContact O-CA 3.49Å; S349-F357 WeakPolarHBondContact O-CB 3.22Å; S349-K358 PolarHBondContact N-O 3.39Å; S349-K358 VanDerWaalsContact N-O 3.13Å; S349-K358 PolarHBondContact O-N 3.44Å
350	W	97.2	Very high	95.2	Very high	7 Å²	7	35 Å²	35	3%	0.027	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	154.4	160.6	-57.6	104	0	0	0	110.1	L336 L339 W355 F357 F408 H424 V429	L336-W350 HydrophobicContact CD1-CH2 3.99Å; L336-W350 HydrophobicContact CD1-CZ2 3.87Å; L339-W350 HydrophobicContact CB-CH2 4.41Å; L339-W350 HydrophobicContact CB-CZ2 3.66Å; L339-W350 HydrophobicContact CD1-CH2 3.9Å; L339-W350 HydrophobicContact CD1-CZ2 3.99Å; L339-W350 HydrophobicContact CD1-CZ3 4.18Å; L339-W350 HydrophobicContact CD2-CD2 4.08Å; L339-W350 HydrophobicContact CD2-CG 4.25Å; L339-W350 HydrophobicContact CG-CZ2 4.28Å; L339-W350 PolarHBondContact O-NE1 3.29Å; W350-W355 AromaticContact CH2-CE3 3.75Å; W350-W355 HydrophobicContact CH2-CE3 3.75Å; W350-W355 HydrophobicContact CH2-CZ3 4.3Å; W350-W355 HydrophobicContact CZ2-CE3 4.38Å; W350-W355 HydrophobicContact CZ3-CB 4.25Å; W350-W355 HydrophobicContact CZ3-CE3 4.01Å; W350-F357 HydrophobicContact CE3-CB 3.97Å; W350-F357 HydrophobicContact CZ3-CB 4.28Å; W350-F357 HydrophobicContact CZ3-CD1 4.41Å; W350-F408 HydrophobicContact CH2-CD2 4.01Å; W350-F408 AromaticContact CH2-CE2 3.93Å; W350-F408 HydrophobicContact CH2-CE2 3.93Å; W350-F408 HydrophobicContact CZ3-CD2 4.01Å; W350-F408 HydrophobicContact CZ3-CE2 4.2Å; W350-H424 WeakPolarHBondContact CB-NE2 3.45Å; W350-H424 AromaticContact CD1-CD2 3.94Å; W350-H424 AromaticContact CD2-NE2 3.83Å; W350-H424 AromaticContact CG-CD2 3.71Å; W350-H424 AromaticContact CG-NE2 3.51Å; W350-V429 HydrophobicContact CB-CG1 4.05Å; W350-V429 HydrophobicContact CB-CG2 4.13Å; W350-V429 HydrophobicContact CG-CG2 4.46Å
351	T	95.8	Very high	95.4	Very high	10 Å²	10	38.2 Å²	38.2	6%	0.061	22%	0.223	C	C	.	.			trans	-92.3	-11.1	175.7	59.5	0	0	0	0	113.4	D353 E356 K358 V405 P431 D432	T351-D353 PolarHBondContact OG1-N 3.5Å; T351-E356 HydrophobicContact CG2-CG 3.93Å; T351-E356 PolarHBondContact N-O 3.11Å; T351-E356 WeakPolarHBondContact OG1-CB 3.3Å; T351-E356 PolarHBondContact OG1-O 2.83Å; T351-K358 HydrophobicContact CG2-CB 4.14Å; T351-V405 HydrophobicContact CG2-CG1 4.3Å; T351-P431 CarbonylContact O-C 3.26Å; T351-P431 VanDerWaalsContact O-CA 3.27Å; T351-P431 WeakPolarHBondContact O-CA 3.39Å; T351-D432 PolarHBondContact O-N 3.08Å
352	G	93.1	Very high	95.8	Very high	27 Å²	27	37.7 Å²	37.7	28%	0.278	22%	0.221	S	C	.	.	S	Bend	trans	94	-23.9	-170.1	0	0	0	0	0	114.2	G354 H424	G352-G354 PolarHBondContact O-N 2.96Å; G352-H424 PolarHBondContact O-CE1 3.07Å; G352-H424 PolarHBondContact O-ND1 3.4Å
353	D	94.1	Very high	96.2	Very high	87 Å²	87	37.2 Å²	37.2	47%	0.465	22%	0.223	S	C	.	.	S	Bend	trans	-85.8	95.4	178.3	179.5	-6.5	0	0	0	111.5	T351 W355 E356 R407	T351-D353 PolarHBondContact OG1-N 3.5Å; D353-W355 PolarHBondContact O-N 2.65Å; D353-E356 VanDerWaalsContact O-CB 3.24Å; D353-E356 WeakPolarHBondContact O-CB 3.47Å; D353-E356 PolarHBondContact O-N 3.22Å; D353-R407 VanDerWaalsContact CG-NH1 3.27Å; D353-R407 IonicContact OD1-CZ 3.08Å; D353-R407 IonicContact OD1-NH1 3.36Å; D353-R407 PolarHBondContact OD1-NH1 3.25Å; D353-R407 IonicContact OD1-NH2 2.72Å; D353-R407 IonicContact OD2-CZ 3.85Å; D353-R407 IonicContact OD2-NH1 2.64Å; D353-R407 PolarHBondContact OD2-NH1 3.06Å; D353-R407 IonicContact OD2-NH2 3.07Å; D353-R407 PolarHBondContact OD2-NH2 2.79Å
354	G	94.9	Very high	96.5	Very high	20 Å²	20	34.9 Å²	34.9	21%	0.206	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-122.9	174.9	0	0	0	0	0	112.1	G352 P420 H424	G352-G354 PolarHBondContact O-N 2.96Å; G354-P420 WeakPolarHBondContact O-CB 3.29Å; G354-H424 PolarHBondContact O-CE1 3.4Å; G354-H424 PolarHBondContact O-NE2 3.04Å
355	W	96.9	Very high	96.7	Very high	33 Å²	33	34.9 Å²	34.9	13%	0.125	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	27.9	176.3	-55.1	109.7	0	0	0	113.9	W350 D353 R407 F408 L412 K413 L416 P420 L423	W350-W355 AromaticContact CH2-CE3 3.75Å; W350-W355 HydrophobicContact CH2-CE3 3.75Å; W350-W355 HydrophobicContact CH2-CZ3 4.3Å; W350-W355 HydrophobicContact CZ2-CE3 4.38Å; W350-W355 HydrophobicContact CZ3-CB 4.25Å; W350-W355 HydrophobicContact CZ3-CE3 4.01Å; D353-W355 PolarHBondContact O-N 2.65Å; W355-R407 WeakPolarHBondContact O-CA 3.17Å; W355-F408 HydrophobicContact CB-CB 3.94Å; W355-F408 PolarHBondContact O-N 3.39Å; W355-L412 HydrophobicContact CD2-CB 4.09Å; W355-L412 HydrophobicContact CD2-CD1 3.93Å; W355-L412 HydrophobicContact CE3-CB 4.37Å; W355-L412 HydrophobicContact CE3-CD1 3.76Å; W355-L412 HydrophobicContact CG-CD1 4.38Å; W355-L412 HydrophobicContact CH2-CB 3.97Å; W355-L412 HydrophobicContact CZ2-CB 3.65Å; W355-L412 HydrophobicContact CZ3-CB 4.31Å; W355-L412 HydrophobicContact CZ3-CD1 4.11Å; W355-K413 HydrophobicContact CZ2-CB 4.49Å; W355-L416 HydrophobicContact CH2-CD1 4.12Å; W355-L416 HydrophobicContact CZ3-CD1 4.36Å; W355-P420 HydrophobicContact CD2-CB 3.9Å; W355-P420 HydrophobicContact CD2-CG 4.33Å; W355-P420 HydrophobicContact CE3-CB 4.04Å; W355-P420 HydrophobicContact CG-CB 4.44Å; W355-P420 HydrophobicContact CH2-CB 4.4Å; W355-P420 HydrophobicContact CZ2-CB 4.26Å; W355-P420 HydrophobicContact CZ2-CG 4.33Å; W355-P420 HydrophobicContact CZ3-CB 4.29Å; W355-L423 HydrophobicContact CH2-CD1 3.83Å; W355-L423 HydrophobicContact CZ3-CD1 3.66Å
356	E	97.9	Very high	96.9	Very high	6 Å²	6	31.7 Å²	31.7	3%	0.028	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.6	175.9	-176.4	160.8	119.8	0	0	112.7	T351 D353 T399 V405 Y406 R407	T351-E356 HydrophobicContact CG2-CG 3.93Å; T351-E356 PolarHBondContact N-O 3.11Å; T351-E356 WeakPolarHBondContact OG1-CB 3.3Å; T351-E356 PolarHBondContact OG1-O 2.83Å; D353-E356 VanDerWaalsContact O-CB 3.24Å; D353-E356 WeakPolarHBondContact O-CB 3.47Å; D353-E356 PolarHBondContact O-N 3.22Å; E356-T399 VanDerWaalsContact CD-OG1 3.23Å; E356-T399 WeakPolarHBondContact OE2-CB 3.2Å; E356-T399 WeakPolarHBondContact OE2-CG2 3.41Å; E356-T399 PolarHBondContact OE2-OG1 3.13Å; E356-V405 HydrophobicContact CG-CG1 3.37Å; E356-V405 VanDerWaalsContact OE1-CG1 3.22Å; E356-V405 WeakPolarHBondContact OE1-CG1 3.07Å; E356-Y406 CarbonylContact C-O 3.51Å; E356-Y406 WeakPolarHBondContact CA-O 3.3Å; E356-R407 HydrophobicContact CB-CB 4.23Å; E356-R407 HydrophobicContact CB-CG 4.13Å; E356-R407 VanDerWaalsContact CD-NH2 3.27Å; E356-R407 IonicContact OE1-NH2 2.7Å; E356-R407 IonicContact OE2-CZ 2.81Å; E356-R407 VanDerWaalsContact OE2-CZ 3.3Å; E356-R407 IonicContact OE2-NE 3.42Å; E356-R407 PolarHBondContact OE2-NE 3Å; E356-R407 VanDerWaalsContact OE2-NE 3.07Å; E356-R407 IonicContact OE2-NH2 3.5Å; E356-R407 PolarHBondContact OE2-NH2 3.3Å
357	F	98.1	Very high	97.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	158.6	-176	70.3	-87.9	0	0	0	112.7	L335 L339 I348 S349 W350 L359 I396 V405 Y406 F408	L335-F357 HydrophobicContact CD1-CZ 4.42Å; L339-F357 HydrophobicContact CD1-CB 3.78Å; L339-F357 HydrophobicContact CD1-CD1 4.02Å; L339-F357 HydrophobicContact CD1-CD2 3.89Å; L339-F357 HydrophobicContact CD1-CE2 4.46Å; L339-F357 HydrophobicContact CD1-CG 3.64Å; L339-F357 HydrophobicContact CD2-CB 3.69Å; L339-F357 HydrophobicContact CD2-CG 4.35Å; L339-F357 HydrophobicContact CG-CB 4.4Å; I348-F357 HydrophobicContact CD1-CD2 4.35Å; I348-F357 HydrophobicContact CG1-CD2 4.48Å; S349-F357 CarbonylContact O-C 3.54Å; S349-F357 VanDerWaalsContact O-CA 3.25Å; S349-F357 WeakPolarHBondContact O-CA 3.49Å; S349-F357 WeakPolarHBondContact O-CB 3.22Å; W350-F357 HydrophobicContact CE3-CB 3.97Å; W350-F357 HydrophobicContact CZ3-CB 4.28Å; W350-F357 HydrophobicContact CZ3-CD1 4.41Å; F357-L359 HydrophobicContact CD2-CD2 4.16Å; F357-L359 HydrophobicContact CE2-CD2 4Å; F357-I396 HydrophobicContact CE1-CD1 4.44Å; F357-I396 HydrophobicContact CE1-CG1 4.43Å; F357-I396 HydrophobicContact CE1-CG2 4.31Å; F357-I396 HydrophobicContact CZ-CD1 4.18Å; F357-I396 HydrophobicContact CZ-CG2 4.28Å; F357-V405 WeakPolarHBondContact O-CA 3.38Å; F357-V405 WeakPolarHBondContact O-CG1 3.48Å; F357-Y406 VanDerWaalsContact CD1-O 3.25Å; F357-Y406 WeakPolarHBondContact CD1-O 3.46Å; F357-Y406 HydrophobicContact CE2-CD2 4.39Å; F357-Y406 HydrophobicContact CZ-CG 4.35Å; F357-Y406 PolarHBondContact N-O 3.3Å; F357-Y406 PolarHBondContact O-N 3.2Å; F357-Y406 VanDerWaalsContact O-O 3.06Å; F357-F408 AromaticContact CD1-CD2 3.67Å; F357-F408 HydrophobicContact CD1-CD2 3.67Å; F357-F408 AromaticContact CD1-CE2 3.56Å; F357-F408 HydrophobicContact CD1-CE2 3.56Å; F357-F408 AromaticContact CE1-CD2 3.52Å; F357-F408 HydrophobicContact CE1-CD2 3.52Å; F357-F408 AromaticContact CE1-CE2 3.33Å; F357-F408 HydrophobicContact CE1-CE2 3.33Å; F357-F408 HydrophobicContact CE1-CG 4.4Å; F357-F408 HydrophobicContact CE1-CZ 4.11Å; F357-F408 HydrophobicContact CG-CE2 4.5Å; F357-F408 HydrophobicContact CZ-CE2 4.11Å
358	K	97.6	Very high	97.1	Very high	63 Å²	63	36.9 Å²	36.9	27%	0.274	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132	-170.5	-177.3	174.3	178.8	-177.2	0	109.5	I348 S349 T351 S360 V405 D432	I348-K358 WeakPolarHBondContact CA-O 3.4Å; S349-K358 PolarHBondContact N-O 3.39Å; S349-K358 VanDerWaalsContact N-O 3.13Å; S349-K358 PolarHBondContact O-N 3.44Å; T351-K358 HydrophobicContact CG2-CB 4.14Å; K358-S360 PolarHBondContact O-N 3.17Å; K358-V405 HydrophobicContact CB-CG2 4.12Å; K358-V405 HydrophobicContact CD-CG2 4.36Å; K358-V405 HydrophobicContact CG-CG2 3.96Å; K358-D432 WeakPolarHBondContact CD-OD2 3.44Å; K358-D432 WeakPolarHBondContact CE-OD2 3.36Å; K358-D432 IonicContact NZ-OD1 2.72Å; K358-D432 PolarHBondContact NZ-OD1 2.89Å; K358-D432 VanDerWaalsContact NZ-OD1 3.13Å; K358-D432 IonicContact NZ-OD2 2.66Å; K358-D432 PolarHBondContact NZ-OD2 3.49Å
359	L	98	Very high	97.1	Very high	2 Å²	2	38 Å²	38	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	95.8	168.9	-45.9	-178.3	0	0	0	108.1	L335 F347 I348 F357 P362 V365 Y380 L383 L387 Y404 Y406	L335-L359 HydrophobicContact CD2-CD2 4.42Å; F347-L359 CarbonylContact O-C 3.55Å; I348-L359 HydrophobicContact CB-CD2 4.33Å; I348-L359 HydrophobicContact CD1-CD2 3.49Å; I348-L359 VanDerWaalsContact CD1-CD2 3.49Å; I348-L359 HydrophobicContact CG1-CD2 3.74Å; F357-L359 HydrophobicContact CD2-CD2 4.16Å; F357-L359 HydrophobicContact CE2-CD2 4Å; L359-P362 HydrophobicContact CB-CB 4.14Å; L359-P362 HydrophobicContact CB-CG 4.04Å; L359-P362 HydrophobicContact CD1-CB 4.36Å; L359-V365 HydrophobicContact CD2-CG1 4.31Å; L359-V365 HydrophobicContact CD2-CG2 4.3Å; L359-Y380 HydrophobicContact CD1-CE2 4.13Å; L359-L383 HydrophobicContact CD1-CD2 4.32Å; L359-L387 HydrophobicContact CD1-CD1 4.38Å; L359-Y404 PolarHBondContact N-O 3.1Å; L359-Y404 WeakPolarHBondContact O-CB 3.41Å; L359-Y406 HydrophobicContact CD1-CE2 4.2Å
360	S	97.4	Very high	97.2	Very high	64 Å²	64	37 Å²	37	45%	0.448	19%	0.191	S	C	.	.	S	Bend	trans	-71.8	-35.5	179.9	-58.4	0	0	0	0	112.2	F347 K358	F347-S360 PolarHBondContact O-N 3.35Å; K358-S360 PolarHBondContact O-N 3.17Å
361	D	97.8	Very high	97.1	Very high	70 Å²	70	45.1 Å²	45.1	37%	0.374	23%	0.227	S	C	.	.	S	Bend	trans	-125.3	95.4	162.9	178	-12.1	0	0	0	108.5	F347 D363 E364 V365	F347-D361 HydrophobicContact CB-CB 3.69Å; F347-D361 PolarHBondContact O-N 3.41Å; F347-D361 VanDerWaalsContact O-N 3.09Å; D361-D363 PolarHBondContact O-N 3.06Å; D361-D363 PolarHBondContact OD1-N 3.5Å; D361-E364 HydrophobicContact CB-CB 4.16Å; D361-E364 PolarHBondContact OD1-N 3.31Å; D361-E364 WeakPolarHBondContact OD2-CB 3.33Å; D361-V365 WeakPolarHBondContact O-CG2 3.46Å; D361-V365 PolarHBondContact O-N 3.01Å
362	P	97.9	Very high	97	Very high	18 Å²	18	49.4 Å²	49.4	12%	0.117	24%	0.242	C	C	.	.	H	α-helix	trans	-67.4	-21.3	-178.2	-16.6	28.7	0	0	0	114.3	L359 A366 Y380 Y404	L359-P362 HydrophobicContact CB-CB 4.14Å; L359-P362 HydrophobicContact CB-CG 4.04Å; L359-P362 HydrophobicContact CD1-CB 4.36Å; P362-A366 WeakPolarHBondContact O-CB 3.44Å; P362-A366 PolarHBondContact O-N 3.39Å; P362-A366 VanDerWaalsContact O-N 3.07Å; P362-Y380 HydrophobicContact CB-CD2 3.29Å; P362-Y380 HydrophobicContact CB-CE2 3.82Å; P362-Y380 HydrophobicContact CB-CG 3.77Å; P362-Y380 HydrophobicContact CG-CD2 4.44Å; P362-Y404 HydrophobicContact CB-CD1 4.22Å; P362-Y404 HydrophobicContact CB-CE1 4.48Å; P362-Y404 HydrophobicContact CG-CD1 3.54Å; P362-Y404 HydrophobicContact CG-CD2 4.19Å; P362-Y404 HydrophobicContact CG-CE1 3.84Å; P362-Y404 HydrophobicContact CG-CE2 4.45Å; P362-Y404 HydrophobicContact CG-CG 3.74Å
363	D	98	Very high	97.1	Very high	94 Å²	94	51.8 Å²	51.8	50%	0.503	24%	0.244	S	C	.	.	H	α-helix	trans	-88.1	-33.5	-178.1	-81	-48.5	0	0	0	112	D361 V365 A366 R367 Y380	D361-D363 PolarHBondContact O-N 3.06Å; D361-D363 PolarHBondContact OD1-N 3.5Å; D363-V365 VanDerWaalsContact C-N 3.34Å; D363-A366 PolarHBondContact O-N 2.94Å; D363-R367 VanDerWaalsContact O-CB 3.24Å; D363-R367 WeakPolarHBondContact O-CB 3.22Å; D363-R367 PolarHBondContact O-N 3.07Å; D363-Y380 WeakPolarHBondContact OD1-CB 3.44Å; D363-Y380 PolarHBondContact OD1-N 3.49Å; D363-Y380 VanDerWaalsContact OD1-N 3.15Å
364	E	98	Very high	97.1	Very high	31 Å²	31	54.1 Å²	54.1	15%	0.145	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-43.1	166.2	171.7	60.3	179.2	0	0	111	F347 D361 A366 R367 R368	F347-E364 HydrophobicContact CB-CB 4.21Å; F347-E364 HydrophobicContact CB-CG 4.05Å; F347-E364 HydrophobicContact CD1-CG 3.78Å; F347-E364 HydrophobicContact CD2-CG 3.96Å; F347-E364 HydrophobicContact CE1-CG 4.21Å; F347-E364 HydrophobicContact CE2-CG 4.37Å; F347-E364 HydrophobicContact CG-CB 4.33Å; F347-E364 HydrophobicContact CG-CG 3.65Å; F347-E364 HydrophobicContact CZ-CG 4.48Å; D361-E364 HydrophobicContact CB-CB 4.16Å; D361-E364 PolarHBondContact OD1-N 3.31Å; D361-E364 WeakPolarHBondContact OD2-CB 3.33Å; E364-A366 PolarHBondContact O-N 2.94Å; E364-R367 PolarHBondContact O-N 2.85Å; E364-R367 IonicContact OE1-CZ 2.72Å; E364-R367 IonicContact OE1-NH2 2.63Å; E364-R367 PolarHBondContact OE1-NH2 2.87Å; E364-R367 IonicContact OE2-CZ 3.65Å; E364-R367 IonicContact OE2-NE 2.85Å; E364-R367 PolarHBondContact OE2-NE 3.09Å; E364-R367 IonicContact OE2-NH2 2.71Å; E364-R367 PolarHBondContact OE2-NH2 3.13Å; E364-R368 WeakPolarHBondContact O-CG 3.46Å; E364-R368 PolarHBondContact O-N 3.36Å; E364-R368 IonicContact OE1-CZ 2.72Å; E364-R368 IonicContact OE1-NE 3.13Å; E364-R368 PolarHBondContact OE1-NE 2.69Å; E364-R368 IonicContact OE1-NH2 2.63Å; E364-R368 PolarHBondContact OE1-NH2 3.46Å; E364-R368 VanDerWaalsContact OE1-NH2 3.08Å
365	V	98.3	Very high	97.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-45.9	173.6	175.8	0	0	0	0	110.9	L335 L338 F347 I348 L359 D361 D363 R368 W369 L383	L335-V365 HydrophobicContact CD2-CG1 3.64Å; L338-V365 HydrophobicContact CD1-CG1 4.29Å; F347-V365 HydrophobicContact CD2-CG2 3.74Å; I348-V365 HydrophobicContact CB-CG2 3.88Å; I348-V365 HydrophobicContact CG2-CG2 4.2Å; L359-V365 HydrophobicContact CD2-CG1 4.31Å; L359-V365 HydrophobicContact CD2-CG2 4.3Å; D361-V365 WeakPolarHBondContact O-CG2 3.46Å; D361-V365 PolarHBondContact O-N 3.01Å; D363-V365 VanDerWaalsContact C-N 3.34Å; V365-R368 PolarHBondContact O-N 3.5Å; V365-W369 WeakPolarHBondContact O-CB 3.46Å; V365-W369 PolarHBondContact O-N 3.23Å; V365-L383 HydrophobicContact CG1-CD1 3.93Å
366	A	98.4	Very high	97	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.7	-36.4	177.9	0	0	0	0	0	113.2	P362 D363 E364 W369 G370 M378 L383	P362-A366 WeakPolarHBondContact O-CB 3.44Å; P362-A366 PolarHBondContact O-N 3.39Å; P362-A366 VanDerWaalsContact O-N 3.07Å; D363-A366 PolarHBondContact O-N 2.94Å; E364-A366 PolarHBondContact O-N 2.94Å; A366-W369 PolarHBondContact O-N 2.94Å; A366-G370 PolarHBondContact O-N 3Å; A366-M378 HydrophobicContact CB-CG 4.45Å; A366-M378 WeakPolarHBondContact O-CG 3.41Å; A366-L383 HydrophobicContact CB-CB 4.22Å; A366-L383 HydrophobicContact CB-CD1 4.06Å
367	R	98.1	Very high	96.9	Very high	138 Å²	138	71.6 Å²	71.6	52%	0.521	34%	0.34	S	S	.	.	H	α-helix	trans	-66.7	-43.5	175.2	-170.8	-166.6	68.4	93.1	2.5	111.2	D363 E364 G370 K371	D363-R367 VanDerWaalsContact O-CB 3.24Å; D363-R367 WeakPolarHBondContact O-CB 3.22Å; D363-R367 PolarHBondContact O-N 3.07Å; E364-R367 PolarHBondContact O-N 2.85Å; E364-R367 IonicContact OE1-CZ 2.72Å; E364-R367 IonicContact OE1-NH2 2.63Å; E364-R367 PolarHBondContact OE1-NH2 2.87Å; E364-R367 IonicContact OE2-CZ 3.65Å; E364-R367 IonicContact OE2-NE 2.85Å; E364-R367 PolarHBondContact OE2-NE 3.09Å; E364-R367 IonicContact OE2-NH2 2.71Å; E364-R367 PolarHBondContact OE2-NH2 3.13Å; R367-G370 PolarHBondContact O-N 3.24Å; R367-K371 PolarHBondContact O-N 2.95Å
368	R	97.6	Very high	96.9	Very high	79 Å²	79	73.6 Å²	73.6	30%	0.298	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-40.8	174.1	-70.1	-169.7	-178.5	-146.3	2.2	111.6	F334 F347 E364 V365 K371 R372	F334-R368 HydrophobicContact CZ-CB 3.8Å; F347-R368 VanDerWaalsContact CZ-NE 3.33Å; E364-R368 WeakPolarHBondContact O-CG 3.46Å; E364-R368 PolarHBondContact O-N 3.36Å; E364-R368 IonicContact OE1-CZ 2.72Å; E364-R368 IonicContact OE1-NE 3.13Å; E364-R368 PolarHBondContact OE1-NE 2.69Å; E364-R368 IonicContact OE1-NH2 2.63Å; E364-R368 PolarHBondContact OE1-NH2 3.46Å; E364-R368 VanDerWaalsContact OE1-NH2 3.08Å; V365-R368 PolarHBondContact O-N 3.5Å; R368-K371 PolarHBondContact O-N 3.33Å; R368-R372 WeakPolarHBondContact O-CB 3.42Å; R368-R372 PolarHBondContact O-N 3.48Å
369	W	97.8	Very high	96.9	Very high	25 Å²	25	73.6 Å²	73.6	10%	0.095	35%	0.353	C	S	.	.	H	α-helix	trans	-62.9	-42.7	173	-179.2	-130.9	0	0	0	112.2	I329 L331 F334 V365 A366 K371 R372 K373 L383	I329-W369 HydrophobicContact CG2-CZ3 4.47Å; L331-W369 HydrophobicContact CB-CH2 4.16Å; L331-W369 HydrophobicContact CB-CZ2 3.73Å; L331-W369 HydrophobicContact CD1-CD2 3.89Å; L331-W369 HydrophobicContact CD1-CE3 4.45Å; L331-W369 HydrophobicContact CD1-CG 3.99Å; L331-W369 HydrophobicContact CD1-CZ2 4.38Å; F334-W369 HydrophobicContact CB-CE3 3.76Å; F334-W369 HydrophobicContact CB-CZ3 3.55Å; F334-W369 HydrophobicContact CD1-CB 4.08Å; F334-W369 HydrophobicContact CD1-CD2 4.03Å; F334-W369 AromaticContact CD1-CE3 3.4Å; F334-W369 HydrophobicContact CD1-CE3 3.4Å; F334-W369 VanDerWaalsContact CD1-CE3 3.4Å; F334-W369 HydrophobicContact CD1-CG 4.34Å; F334-W369 HydrophobicContact CD1-CZ3 4.12Å; F334-W369 HydrophobicContact CD2-CE3 4.09Å; F334-W369 HydrophobicContact CD2-CZ3 4.43Å; F334-W369 HydrophobicContact CE1-CB 3.6Å; F334-W369 HydrophobicContact CE1-CD2 4.43Å; F334-W369 AromaticContact CE1-CE3 3.99Å; F334-W369 HydrophobicContact CE1-CE3 3.99Å; F334-W369 HydrophobicContact CE1-CG 4.34Å; F334-W369 HydrophobicContact CG-CD2 4.49Å; F334-W369 AromaticContact CG-CE3 3.45Å; F334-W369 HydrophobicContact CG-CE3 3.45Å; F334-W369 VanDerWaalsContact CG-CE3 3.45Å; F334-W369 AromaticContact CG-CZ3 3.77Å; F334-W369 HydrophobicContact CG-CZ3 3.77Å; F334-W369 HydrophobicContact CZ-CB 4.25Å; V365-W369 WeakPolarHBondContact O-CB 3.46Å; V365-W369 PolarHBondContact O-N 3.23Å; A366-W369 PolarHBondContact O-N 2.94Å; W369-K371 PolarHBondContact O-N 3.01Å; W369-R372 HydrophobicContact CE3-CB 4.23Å; W369-R372 HydrophobicContact CE3-CG 4.29Å; W369-R372 HydrophobicContact CZ3-CG 4.28Å; W369-R372 PolarHBondContact O-N 2.8Å; W369-K373 HydrophobicContact CD2-CG 3.91Å; W369-K373 HydrophobicContact CE3-CD 4.37Å; W369-K373 HydrophobicContact CE3-CG 3.75Å; W369-K373 HydrophobicContact CH2-CD 3.49Å; W369-K373 VanDerWaalsContact CH2-CD 3.49Å; W369-K373 HydrophobicContact CH2-CG 3.53Å; W369-K373 HydrophobicContact CZ2-CD 4.02Å; W369-K373 HydrophobicContact CZ2-CG 3.65Å; W369-K373 HydrophobicContact CZ3-CD 3.68Å; W369-K373 HydrophobicContact CZ3-CG 3.57Å; W369-K373 PolarHBondContact O-N 3.15Å; W369-L383 HydrophobicContact CB-CD1 4.04Å; W369-L383 HydrophobicContact CG-CD1 4.29Å
370	G	97.3	Very high	96.9	Very high	4 Å²	4	75 Å²	75	4%	0.041	36%	0.358	C	S	.	.	H	α-helix	trans	-56	-47.7	172.5	0	0	0	0	0	112.2	A366 R367 K373 N374 K375	A366-G370 PolarHBondContact O-N 3Å; R367-G370 PolarHBondContact O-N 3.24Å; G370-K373 PolarHBondContact O-N 2.87Å; G370-N374 WeakPolarHBondContact O-CA 3.34Å; G370-N374 PolarHBondContact O-N 2.83Å; G370-N374 VanDerWaalsContact O-N 3.08Å; G370-K375 VanDerWaalsContact CA-O 3.3Å; G370-K375 WeakPolarHBondContact CA-O 3.43Å; G370-K375 PolarHBondContact O-N 3.18Å
371	K	96.1	Very high	96.9	Very high	177 Å²	177	77.3 Å²	77.3	77%	0.77	36%	0.362	S	S	*	.	H	α-helix	trans	-60.5	-45.8	173.9	-172.8	176.4	178.8	-178.7	0	111.6	R367 R368 W369 K373 N374	R367-K371 PolarHBondContact O-N 2.95Å; R368-K371 PolarHBondContact O-N 3.33Å; W369-K371 PolarHBondContact O-N 3.01Å; K371-K373 VanDerWaalsContact C-N 3.3Å; K371-K373 PolarHBondContact O-N 2.91Å; K371-N374 PolarHBondContact O-N 2.88Å
372	R	94.7	Very high	96.9	Very high	100 Å²	100	79.4 Å²	79.4	38%	0.377	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-30.5	-179.2	-176.5	59.2	61.2	86.9	8.1	113.8	F334 E337 R368 W369	F334-R372 HydrophobicContact CD2-CB 4.24Å; F334-R372 HydrophobicContact CD2-CG 3.9Å; F334-R372 HydrophobicContact CE2-CB 4Å; F334-R372 HydrophobicContact CE2-CG 4.13Å; E337-R372 IonicContact OE1-CZ 2.64Å; E337-R372 IonicContact OE1-NH1 3.54Å; E337-R372 PolarHBondContact OE1-NH1 3.31Å; E337-R372 IonicContact OE1-NH2 3.57Å; E337-R372 PolarHBondContact OE1-NH2 3.5Å; E337-R372 IonicContact OE2-CZ 2.65Å; E337-R372 IonicContact OE2-NH1 3.95Å; E337-R372 PolarHBondContact OE2-NH1 2.84Å; E337-R372 IonicContact OE2-NH2 2.79Å; R368-R372 WeakPolarHBondContact O-CB 3.42Å; R368-R372 PolarHBondContact O-N 3.48Å; W369-R372 HydrophobicContact CE3-CB 4.23Å; W369-R372 HydrophobicContact CE3-CG 4.29Å; W369-R372 HydrophobicContact CZ3-CG 4.28Å; W369-R372 PolarHBondContact O-N 2.8Å
373	K	93.5	Very high	96.9	Very high	77 Å²	77	78.6 Å²	78.6	34%	0.335	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	9.9	-178.4	-58.2	-66.8	-75.1	-167.9	0	114.1	I329 W369 G370 K371 K375	I329-K373 PolarHBondContact O-NZ 3.41Å; W369-K373 HydrophobicContact CD2-CG 3.91Å; W369-K373 HydrophobicContact CE3-CD 4.37Å; W369-K373 HydrophobicContact CE3-CG 3.75Å; W369-K373 HydrophobicContact CH2-CD 3.49Å; W369-K373 VanDerWaalsContact CH2-CD 3.49Å; W369-K373 HydrophobicContact CH2-CG 3.53Å; W369-K373 HydrophobicContact CZ2-CD 4.02Å; W369-K373 HydrophobicContact CZ2-CG 3.65Å; W369-K373 HydrophobicContact CZ3-CD 3.68Å; W369-K373 HydrophobicContact CZ3-CG 3.57Å; W369-K373 PolarHBondContact O-N 3.15Å; G370-K373 PolarHBondContact O-N 2.87Å; K371-K373 VanDerWaalsContact C-N 3.3Å; K371-K373 PolarHBondContact O-N 2.91Å; K373-K375 VanDerWaalsContact C-N 3.33Å; K373-K375 HydrophobicContact CB-CG 4.24Å; K373-K375 PolarHBondContact O-N 3Å
374	N	94.8	Very high	96.9	Very high	136 Å²	136	74.2 Å²	74.2	73%	0.727	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	51.1	-171.1	-164.4	15.8	0	0	0	113.3	G370 K371	G370-N374 WeakPolarHBondContact O-CA 3.34Å; G370-N374 PolarHBondContact O-N 2.83Å; G370-N374 VanDerWaalsContact O-N 3.08Å; K371-N374 PolarHBondContact O-N 2.88Å
375	K	96.5	Very high	96.9	Very high	127 Å²	127	77.5 Å²	77.5	55%	0.552	35%	0.351	S	S	*	.			trans	-121.3	85.1	175.8	-61.5	-57.9	175.4	-172.2	0	109.2	G370 K373 K377 M378	G370-K375 VanDerWaalsContact CA-O 3.3Å; G370-K375 WeakPolarHBondContact CA-O 3.43Å; G370-K375 PolarHBondContact O-N 3.18Å; K373-K375 VanDerWaalsContact C-N 3.33Å; K373-K375 HydrophobicContact CB-CG 4.24Å; K373-K375 PolarHBondContact O-N 3Å; K375-K377 PolarHBondContact O-N 3.29Å; K375-M378 HydrophobicContact CB-CE 4.2Å; K375-M378 VanDerWaalsContact O-CB 3.3Å; K375-M378 WeakPolarHBondContact O-CB 3.44Å; K375-M378 PolarHBondContact O-N 2.75Å; K375-M378 VanDerWaalsContact O-N 3.13Å
376	P	93.6	Very high	96.9	Very high	121 Å²	121	78.5 Å²	78.5	79%	0.786	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.9	-176.3	25.5	-34.7	0	0	0	113.8	M378	P376-M378 VanDerWaalsContact C-N 3.3Å; P376-M378 PolarHBondContact O-N 2.65Å
377	K	95.8	Very high	96.8	Very high	177 Å²	177	78.5 Å²	78.5	77%	0.77	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	27	173.8	-58.1	-171.8	-179.9	-175.8	0	113.2	K375 K382	K375-K377 PolarHBondContact O-N 3.29Å; K377-K382 WeakPolarHBondContact O-CD 3.43Å; K377-K382 PolarHBondContact O-NZ 3.08Å
378	M	97.9	Very high	96.8	Very high	42 Å²	42	76.3 Å²	76.3	21%	0.207	35%	0.352	C	S	.	.			trans	-80.5	143.2	172.4	-170.5	62.3	69.6	0	0	110.2	A366 K375 P376 K382	A366-M378 HydrophobicContact CB-CG 4.45Å; A366-M378 WeakPolarHBondContact O-CG 3.41Å; K375-M378 HydrophobicContact CB-CE 4.2Å; K375-M378 VanDerWaalsContact O-CB 3.3Å; K375-M378 WeakPolarHBondContact O-CB 3.44Å; K375-M378 PolarHBondContact O-N 2.75Å; K375-M378 VanDerWaalsContact O-N 3.13Å; P376-M378 VanDerWaalsContact C-N 3.3Å; P376-M378 PolarHBondContact O-N 2.65Å; M378-K382 HydrophobicContact SD-CB 3.73Å
379	N	98.1	Very high	96.8	Very high	64 Å²	64	79.1 Å²	79.1	34%	0.342	36%	0.364	S	S	.	.			trans	-154.2	170.3	178.6	63.6	-12	0	0	0	109.6	E381 K382 L383	N379-E381 VanDerWaalsContact C-N 3.26Å; N379-E381 PolarHBondContact O-N 3.32Å; N379-K382 PolarHBondContact O-N 3.4Å; N379-K382 VanDerWaalsContact O-N 3.15Å; N379-K382 WeakPolarHBondContact OD1-CD 3.29Å; N379-K382 VanDerWaalsContact OD1-CG 3.27Å; N379-K382 WeakPolarHBondContact OD1-CG 3.49Å; N379-K382 PolarHBondContact OD1-N 2.81Å; N379-L383 PolarHBondContact O-N 3.37Å
380	Y	98.1	Very high	96.8	Very high	31 Å²	31	79.2 Å²	79.2	12%	0.122	36%	0.364	C	S	.	.	H	α-helix	trans	-55.9	-37.2	-178.1	173.5	-102.9	0	0	0	113.5	L359 P362 D363 K382 L383 S384 Y404 Y406	L359-Y380 HydrophobicContact CD1-CE2 4.13Å; P362-Y380 HydrophobicContact CB-CD2 3.29Å; P362-Y380 HydrophobicContact CB-CE2 3.82Å; P362-Y380 HydrophobicContact CB-CG 3.77Å; P362-Y380 HydrophobicContact CG-CD2 4.44Å; D363-Y380 WeakPolarHBondContact OD1-CB 3.44Å; D363-Y380 PolarHBondContact OD1-N 3.49Å; D363-Y380 VanDerWaalsContact OD1-N 3.15Å; Y380-K382 VanDerWaalsContact C-N 3.32Å; Y380-K382 PolarHBondContact O-N 2.79Å; Y380-L383 PolarHBondContact O-N 3.43Å; Y380-S384 VanDerWaalsContact O-CB 3.25Å; Y380-S384 WeakPolarHBondContact O-CB 3.43Å; Y380-S384 PolarHBondContact O-N 3.45Å; Y380-S384 PolarHBondContact O-OG 3.36Å; Y380-Y404 HydrophobicContact CD1-CE1 4.3Å; Y380-Y404 HydrophobicContact CE1-CD1 4.16Å; Y380-Y404 AromaticContact CE1-CE1 3.7Å; Y380-Y404 HydrophobicContact CE1-CE1 3.7Å; Y380-Y404 AromaticContact CE2-CD1 3.98Å; Y380-Y404 HydrophobicContact CE2-CD1 3.98Å; Y380-Y404 HydrophobicContact CE2-CE1 4.29Å; Y380-Y404 AromaticContact CZ-CD1 3.62Å; Y380-Y404 AromaticContact CZ-CE1 3.67Å; Y380-Y406 PolarHBondContact OH-OH 2.93Å
381	E	97.3	Very high	96.8	Very high	112 Å²	112	81.9 Å²	81.9	52%	0.523	37%	0.374	S	S	.	.	H	α-helix	trans	-59.6	-39.4	178.4	-73.2	-50.2	121.6	0	0	113.8	N379 S384 R385	N379-E381 VanDerWaalsContact C-N 3.26Å; N379-E381 PolarHBondContact O-N 3.32Å; E381-S384 PolarHBondContact O-OG 3.45Å; E381-R385 PolarHBondContact O-N 2.93Å; E381-R385 VanDerWaalsContact O-N 3.11Å
382	K	97.9	Very high	96.7	Very high	114 Å²	114	80.1 Å²	80.1	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-76.1	-37.8	176.7	-68.2	167.2	-163	174	0	111.8	K377 M378 N379 Y380 R385 G386	K377-K382 WeakPolarHBondContact O-CD 3.43Å; K377-K382 PolarHBondContact O-NZ 3.08Å; M378-K382 HydrophobicContact SD-CB 3.73Å; N379-K382 PolarHBondContact O-N 3.4Å; N379-K382 VanDerWaalsContact O-N 3.15Å; N379-K382 WeakPolarHBondContact OD1-CD 3.29Å; N379-K382 VanDerWaalsContact OD1-CG 3.27Å; N379-K382 WeakPolarHBondContact OD1-CG 3.49Å; N379-K382 PolarHBondContact OD1-N 2.81Å; Y380-K382 VanDerWaalsContact C-N 3.32Å; Y380-K382 PolarHBondContact O-N 2.79Å; K382-R385 PolarHBondContact O-N 3.23Å; K382-G386 PolarHBondContact O-N 3.38Å; K382-G386 VanDerWaalsContact O-N 3.16Å
383	L	98.4	Very high	96.6	Very high	2 Å²	2	81.9 Å²	81.9	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-65.2	-43.8	175.6	-174.6	148.3	0	0	0	111.2	L331 L359 V365 A366 W369 N379 Y380 R385 G386 L387	L331-L383 HydrophobicContact CD1-CD1 3.95Å; L331-L383 HydrophobicContact CD1-CG 4.03Å; L331-L383 HydrophobicContact CD2-CD2 4.48Å; L331-L383 HydrophobicContact CD2-CG 4.08Å; L359-L383 HydrophobicContact CD1-CD2 4.32Å; V365-L383 HydrophobicContact CG1-CD1 3.93Å; A366-L383 HydrophobicContact CB-CB 4.22Å; A366-L383 HydrophobicContact CB-CD1 4.06Å; W369-L383 HydrophobicContact CB-CD1 4.04Å; W369-L383 HydrophobicContact CG-CD1 4.29Å; N379-L383 PolarHBondContact O-N 3.37Å; Y380-L383 PolarHBondContact O-N 3.43Å; L383-R385 VanDerWaalsContact C-N 3.34Å; L383-R385 PolarHBondContact O-N 3.5Å; L383-G386 CarbonylContact O-C 3.44Å; L383-G386 VanDerWaalsContact O-CA 3.24Å; L383-G386 WeakPolarHBondContact O-CA 3.47Å; L383-G386 PolarHBondContact O-N 2.93Å; L383-L387 HydrophobicContact CD2-CD1 3.79Å; L383-L387 HydrophobicContact CD2-CG 4.1Å; L383-L387 PolarHBondContact O-N 3.19Å
384	S	98	Very high	96.6	Very high	2 Å²	2	82.6 Å²	82.6	1%	0.014	39%	0.391	C	S	.	.	H	α-helix	trans	-68.4	-31.7	178.7	79.6	0	0	0	0	111.9	Y380 E381 G386 L387 R388	Y380-S384 VanDerWaalsContact O-CB 3.25Å; Y380-S384 WeakPolarHBondContact O-CB 3.43Å; Y380-S384 PolarHBondContact O-N 3.45Å; Y380-S384 PolarHBondContact O-OG 3.36Å; E381-S384 PolarHBondContact O-OG 3.45Å; S384-G386 VanDerWaalsContact C-N 3.26Å; S384-G386 PolarHBondContact O-N 3.02Å; S384-L387 PolarHBondContact O-N 3.08Å; S384-R388 WeakPolarHBondContact O-CG 3.44Å; S384-R388 PolarHBondContact O-N 3.02Å; S384-R388 PolarHBondContact O-NH1 3.21Å; S384-R388 VanDerWaalsContact O-NH1 3.1Å; S384-R388 PolarHBondContact OG-NH1 3.28Å
385	R	97.9	Very high	96.7	Very high	100 Å²	100	77.2 Å²	77.2	38%	0.377	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-34.1	167.7	-174.1	64.2	-167.7	95.9	-15.3	112.1	E381 K382 L383 R388 Y389	E381-R385 PolarHBondContact O-N 2.93Å; E381-R385 VanDerWaalsContact O-N 3.11Å; K382-R385 PolarHBondContact O-N 3.23Å; L383-R385 VanDerWaalsContact C-N 3.34Å; L383-R385 PolarHBondContact O-N 3.5Å; R385-R388 PolarHBondContact O-N 3.42Å; R385-Y389 HydrophobicContact CG-CE2 4.01Å; R385-Y389 VanDerWaalsContact CZ-CE1 3.44Å; R385-Y389 VanDerWaalsContact NH1-CD1 3.33Å; R385-Y389 VanDerWaalsContact NH1-CE1 3.28Å; R385-Y389 VanDerWaalsContact NH1-CZ 3.31Å; R385-Y389 PolarHBondContact NH2-OH 2.88Å; R385-Y389 WeakPolarHBondContact O-CD2 3.14Å; R385-Y389 PolarHBondContact O-N 3.39Å
386	G	96.5	Very high	96.8	Very high	20 Å²	20	71.2 Å²	71.2	21%	0.206	34%	0.335	C	S	.	.	H	α-helix	trans	-61.4	-49.5	168.5	0	0	0	0	0	112.7	K382 L383 S384 R388 Y389	K382-G386 PolarHBondContact O-N 3.38Å; K382-G386 VanDerWaalsContact O-N 3.16Å; L383-G386 CarbonylContact O-C 3.44Å; L383-G386 VanDerWaalsContact O-CA 3.24Å; L383-G386 WeakPolarHBondContact O-CA 3.47Å; L383-G386 PolarHBondContact O-N 2.93Å; S384-G386 VanDerWaalsContact C-N 3.26Å; S384-G386 PolarHBondContact O-N 3.02Å; G386-R388 VanDerWaalsContact C-N 3.31Å; G386-R388 PolarHBondContact O-N 3.05Å; G386-Y389 WeakPolarHBondContact O-CB 3Å; G386-Y389 PolarHBondContact O-N 3.2Å
387	L	98.1	Very high	97	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.4	-40.9	174.7	-68.4	175.4	0	0	0	112.3	L331 L335 L359 L383 S384 Y389 Y390 Y391 I396 Y406	L331-L387 HydrophobicContact CD2-CD2 4.27Å; L331-L387 HydrophobicContact CD2-CG 4.32Å; L335-L387 HydrophobicContact CD1-CD2 3.64Å; L359-L387 HydrophobicContact CD1-CD1 4.38Å; L383-L387 HydrophobicContact CD2-CD1 3.79Å; L383-L387 HydrophobicContact CD2-CG 4.1Å; L383-L387 PolarHBondContact O-N 3.19Å; S384-L387 PolarHBondContact O-N 3.08Å; L387-Y389 PolarHBondContact O-N 3.03Å; L387-Y390 HydrophobicContact CD2-CD2 4.38Å; L387-Y390 WeakPolarHBondContact O-CB 3.41Å; L387-Y390 PolarHBondContact O-N 3.33Å; L387-Y391 WeakPolarHBondContact O-CD1 3.47Å; L387-Y391 VanDerWaalsContact O-CE1 3.24Å; L387-Y391 WeakPolarHBondContact O-CE1 3.23Å; L387-I396 HydrophobicContact CD2-CD1 3.97Å; L387-I396 HydrophobicContact CD2-CG2 4.41Å; L387-Y406 HydrophobicContact CB-CE1 4.17Å; L387-Y406 HydrophobicContact CD1-CD1 4.19Å; L387-Y406 HydrophobicContact CD1-CD2 4.05Å; L387-Y406 HydrophobicContact CD1-CE1 3.79Å; L387-Y406 HydrophobicContact CD1-CE2 3.64Å; L387-Y406 HydrophobicContact CD1-CG 4.32Å
388	R	97.8	Very high	97.1	Very high	92 Å²	92	64 Å²	64	35%	0.347	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-26.3	174.7	-72.6	-171.9	-69.7	-76.2	13.3	113.7	S384 R385 G386 Y390 Y391	S384-R388 WeakPolarHBondContact O-CG 3.44Å; S384-R388 PolarHBondContact O-N 3.02Å; S384-R388 PolarHBondContact O-NH1 3.21Å; S384-R388 VanDerWaalsContact O-NH1 3.1Å; S384-R388 PolarHBondContact OG-NH1 3.28Å; R385-R388 PolarHBondContact O-N 3.42Å; G386-R388 VanDerWaalsContact C-N 3.31Å; G386-R388 PolarHBondContact O-N 3.05Å; R388-Y390 VanDerWaalsContact C-N 3.25Å; R388-Y390 PolarHBondContact O-N 3.18Å; R388-Y391 HydrophobicContact CB-CE2 4.41Å; R388-Y391 HydrophobicContact CG-CE2 3.92Å
389	Y	96.9	Very high	97.1	Very high	139 Å²	139	63.3 Å²	63.3	55%	0.545	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-2.4	173.1	-70.4	-63.2	0	0	0	114	R385 G386 L387	R385-Y389 HydrophobicContact CG-CE2 4.01Å; R385-Y389 VanDerWaalsContact CZ-CE1 3.44Å; R385-Y389 VanDerWaalsContact NH1-CD1 3.33Å; R385-Y389 VanDerWaalsContact NH1-CE1 3.28Å; R385-Y389 VanDerWaalsContact NH1-CZ 3.31Å; R385-Y389 PolarHBondContact NH2-OH 2.88Å; R385-Y389 WeakPolarHBondContact O-CD2 3.14Å; R385-Y389 PolarHBondContact O-N 3.39Å; G386-Y389 WeakPolarHBondContact O-CB 3Å; G386-Y389 PolarHBondContact O-N 3.2Å; L387-Y389 PolarHBondContact O-N 3.03Å
390	Y	97.8	Very high	96.9	Very high	26 Å²	26	65.5 Å²	65.5	10%	0.102	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-5.2	176.7	-67	-41.3	0	0	0	114.2	L331 W332 L387 R388 N394 I395 I396	L331-Y390 HydrophobicContact CB-CE2 3.93Å; L331-Y390 HydrophobicContact CD2-CE2 4.21Å; L331-Y390 HydrophobicContact CG-CE2 4.19Å; L331-Y390 PolarHBondContact N-OH 3.35Å; W332-Y390 HydrophobicContact CB-CD2 4.4Å; W332-Y390 HydrophobicContact CB-CE2 3.89Å; W332-Y390 AromaticContact CD1-CE1 3.88Å; W332-Y390 AromaticContact CD1-CZ 3.71Å; W332-Y390 PolarHBondContact N-OH 3.32Å; L387-Y390 HydrophobicContact CD2-CD2 4.38Å; L387-Y390 WeakPolarHBondContact O-CB 3.41Å; L387-Y390 PolarHBondContact O-N 3.33Å; R388-Y390 VanDerWaalsContact C-N 3.25Å; R388-Y390 PolarHBondContact O-N 3.18Å; Y390-N394 PolarHBondContact O-N 2.86Å; Y390-I395 HydrophobicContact CD1-CB 4.24Å; Y390-I395 HydrophobicContact CD1-CD1 3.95Å; Y390-I395 HydrophobicContact CD1-CG2 4.4Å; Y390-I395 HydrophobicContact CE1-CD1 4.3Å; Y390-I395 HydrophobicContact CG-CB 4.34Å; Y390-I395 HydrophobicContact CG-CG2 4.42Å; Y390-I395 PolarHBondContact O-N 3.14Å; Y390-I395 VanDerWaalsContact O-N 3.11Å; Y390-I396 CarbonylContact C-O 3.58Å; Y390-I396 VanDerWaalsContact C-O 3.26Å; Y390-I396 HydrophobicContact CD2-CD1 4.05Å; Y390-I396 PolarHBondContact O-N 2.95Å; Y390-I396 VanDerWaalsContact O-O 3.12Å
391	Y	96.7	Very high	96.8	Very high	60 Å²	60	68.2 Å²	68.2	24%	0.235	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-63.3	-178	-63	3.8	0	0	0	110	L387 R388 K393 N394 I396 H397 K398	L387-Y391 WeakPolarHBondContact O-CD1 3.47Å; L387-Y391 VanDerWaalsContact O-CE1 3.24Å; L387-Y391 WeakPolarHBondContact O-CE1 3.23Å; R388-Y391 HydrophobicContact CB-CE2 4.41Å; R388-Y391 HydrophobicContact CG-CE2 3.92Å; Y391-K393 PolarHBondContact O-N 3.14Å; Y391-K393 VanDerWaalsContact O-N 3.14Å; Y391-N394 PolarHBondContact O-N 2.78Å; Y391-N394 PolarHBondContact O-OD1 3.44Å; Y391-I396 VanDerWaalsContact CD1-O 3.31Å; Y391-I396 WeakPolarHBondContact CD1-O 3.48Å; Y391-I396 PolarHBondContact N-O 2.84Å; Y391-H397 PolarHBondContact O-CD2 2.95Å; Y391-H397 PolarHBondContact O-NE2 3.11Å; Y391-K398 HydrophobicContact CE1-CB 4.08Å; Y391-K398 HydrophobicContact CE2-CB 4.37Å; Y391-K398 WeakPolarHBondContact OH-CB 3.19Å
392	D	93.7	Very high	96.7	Very high	141 Å²	141	66.1 Å²	66.1	75%	0.754	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.2	179.5	-35.5	-42.8	0	0	0	112.5	N394	D392-N394 VanDerWaalsContact C-N 3.31Å
393	K	92.6	Very high	96.6	Very high	136 Å²	136	69.5 Å²	69.5	59%	0.591	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-4.3	176	-65.6	-156.9	68.8	173.4	0	114.1	Y391 I395	Y391-K393 PolarHBondContact O-N 3.14Å; Y391-K393 VanDerWaalsContact O-N 3.14Å; K393-I395 VanDerWaalsContact C-N 3.25Å; K393-I395 HydrophobicContact CB-CD1 4.02Å; K393-I395 HydrophobicContact CB-CG1 4.23Å; K393-I395 HydrophobicContact CD-CD1 4.46Å; K393-I395 PolarHBondContact O-N 2.87Å
394	N	95.3	Very high	96.6	Very high	93 Å²	93	73 Å²	73	50%	0.497	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	43	-175.9	-59.8	-49.6	0	0	0	113.3	Y390 Y391 D392 H397 V409 C410	Y390-N394 PolarHBondContact O-N 2.86Å; Y391-N394 PolarHBondContact O-N 2.78Å; Y391-N394 PolarHBondContact O-OD1 3.44Å; D392-N394 VanDerWaalsContact C-N 3.31Å; N394-H397 PolarHBondContact OD1-NE2 2.86Å; N394-V409 HydrophobicContact CB-CG2 4.23Å; N394-C410 WeakPolarHBondContact O-CB 3.47Å; N394-C410 PolarHBondContact O-N 2.79Å
395	I	95.8	Very high	96.6	Very high	23 Å²	23	73 Å²	73	12%	0.118	36%	0.361	C	S	.	.	S	Bend	trans	-102.5	-52.9	174.3	-65.4	166.7	0	0	0	109.8	W332 Y390 K393 F408 V409	W332-I395 HydrophobicContact CB-CG2 3.83Å; W332-I395 HydrophobicContact CD2-CG2 4.13Å; W332-I395 HydrophobicContact CG-CG2 3.74Å; Y390-I395 HydrophobicContact CD1-CB 4.24Å; Y390-I395 HydrophobicContact CD1-CD1 3.95Å; Y390-I395 HydrophobicContact CD1-CG2 4.4Å; Y390-I395 HydrophobicContact CE1-CD1 4.3Å; Y390-I395 HydrophobicContact CG-CB 4.34Å; Y390-I395 HydrophobicContact CG-CG2 4.42Å; Y390-I395 PolarHBondContact O-N 3.14Å; Y390-I395 VanDerWaalsContact O-N 3.11Å; K393-I395 VanDerWaalsContact C-N 3.25Å; K393-I395 HydrophobicContact CB-CD1 4.02Å; K393-I395 HydrophobicContact CB-CG1 4.23Å; K393-I395 HydrophobicContact CD-CD1 4.46Å; K393-I395 PolarHBondContact O-N 2.87Å; I395-F408 WeakPolarHBondContact O-CA 3.36Å; I395-V409 PolarHBondContact O-N 3.32Å
396	I	98.2	Very high	96.6	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	129.3	174.9	-69.1	162.9	0	0	0	107.5	W332 L335 F357 L387 Y390 Y391 Y406 R407 F408	W332-I396 HydrophobicContact CB-CD1 3.88Å; L335-I396 HydrophobicContact CD1-CD1 4.31Å; F357-I396 HydrophobicContact CE1-CD1 4.44Å; F357-I396 HydrophobicContact CE1-CG1 4.43Å; F357-I396 HydrophobicContact CE1-CG2 4.31Å; F357-I396 HydrophobicContact CZ-CD1 4.18Å; F357-I396 HydrophobicContact CZ-CG2 4.28Å; L387-I396 HydrophobicContact CD2-CD1 3.97Å; L387-I396 HydrophobicContact CD2-CG2 4.41Å; Y390-I396 CarbonylContact C-O 3.58Å; Y390-I396 VanDerWaalsContact C-O 3.26Å; Y390-I396 HydrophobicContact CD2-CD1 4.05Å; Y390-I396 PolarHBondContact O-N 2.95Å; Y390-I396 VanDerWaalsContact O-O 3.12Å; Y391-I396 VanDerWaalsContact CD1-O 3.31Å; Y391-I396 WeakPolarHBondContact CD1-O 3.48Å; Y391-I396 PolarHBondContact N-O 2.84Å; I396-Y406 HydrophobicContact CG2-CD1 4.18Å; I396-Y406 HydrophobicContact CG2-CG 4.4Å; I396-R407 CarbonylContact C-O 3.56Å; I396-R407 VanDerWaalsContact CA-O 3.31Å; I396-R407 WeakPolarHBondContact CA-O 3.16Å; I396-F408 HydrophobicContact CD1-CD1 4.1Å; I396-F408 HydrophobicContact CD1-CE1 3.72Å; I396-F408 HydrophobicContact CD1-CZ 4.06Å; I396-F408 HydrophobicContact CG1-CD1 3.56Å; I396-F408 HydrophobicContact CG1-CE1 3.75Å; I396-F408 HydrophobicContact CG1-CG 4.03Å; I396-F408 HydrophobicContact CG1-CZ 4.33Å
397	H	98.1	Very high	96.7	Very high	73 Å²	73	70.8 Å²	70.8	34%	0.338	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	161.7	166.9	-77.4	-169.9	0	0	0	110.4	Y391 N394 Y406 R407 V409	Y391-H397 PolarHBondContact O-CD2 2.95Å; Y391-H397 PolarHBondContact O-NE2 3.11Å; N394-H397 PolarHBondContact OD1-NE2 2.86Å; H397-Y406 WeakPolarHBondContact O-CA 3.21Å; H397-R407 PolarHBondContact N-O 2.9Å; H397-R407 PolarHBondContact O-N 3.44Å; H397-V409 HydrophobicContact CB-CG1 3.9Å; H397-V409 HydrophobicContact CB-CG2 4.45Å
398	K	97.6	Very high	96.7	Very high	75 Å²	75	71 Å²	71	33%	0.326	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.6	171.4	170.9	159.2	175.9	39.7	0	110.8	Y391 S400 K402 V405 Y406	Y391-K398 HydrophobicContact CE1-CB 4.08Å; Y391-K398 HydrophobicContact CE2-CB 4.37Å; Y391-K398 WeakPolarHBondContact OH-CB 3.19Å; K398-S400 PolarHBondContact O-N 3.13Å; K398-K402 PolarHBondContact NZ-O 2.88Å; K398-V405 PolarHBondContact NZ-O 3Å; K398-Y406 HydrophobicContact CB-CD1 3.9Å; K398-Y406 HydrophobicContact CB-CE1 3.89Å; K398-Y406 HydrophobicContact CD-CE1 4.09Å; K398-Y406 HydrophobicContact CG-CD1 4.33Å; K398-Y406 HydrophobicContact CG-CE1 4.15Å
399	T	97.5	Very high	96.6	Very high	27 Å²	27	69.5 Å²	69.5	17%	0.166	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-66.5	127.1	170.4	-48.1	0	0	0	0	110.1	E356 V405	E356-T399 VanDerWaalsContact CD-OG1 3.23Å; E356-T399 WeakPolarHBondContact OE2-CB 3.2Å; E356-T399 WeakPolarHBondContact OE2-CG2 3.41Å; E356-T399 PolarHBondContact OE2-OG1 3.13Å; T399-V405 HydrophobicContact CG2-CG1 4.29Å; T399-V405 PolarHBondContact N-O 3.13Å
400	S	95.4	Very high	96.4	Very high	109 Å²	109	64.6 Å²	64.6	76%	0.762	33%	0.334	S	S	*	.	S	Bend	trans	-71.6	154.1	178.7	-70	0	0	0	0	111.5	K398 K402	K398-S400 PolarHBondContact O-N 3.13Å; S400-K402 PolarHBondContact O-N 3.44Å
401	G	94.4	Very high	96.1	Very high	89 Å²	89	68 Å²	68	92%	0.918	35%	0.354	S	S	*	.	S	Bend	trans	73	-48.5	-178.1	0	0	0	0	0	115.1
402	K	95.5	Very high	95.9	Very high	67 Å²	67	65.1 Å²	65.1	29%	0.291	34%	0.343	S	S	.	.	S	Bend	trans	-75.9	140.3	-176.1	-60.7	-160.8	176.7	-157	0	112.7	K398 S400 V405 D434	K398-K402 PolarHBondContact NZ-O 2.88Å; S400-K402 PolarHBondContact O-N 3.44Å; K402-V405 HydrophobicContact CB-CB 3.8Å; K402-V405 HydrophobicContact CB-CG1 4.49Å; K402-V405 HydrophobicContact CB-CG2 3.75Å; K402-V405 HydrophobicContact CD-CG2 4.23Å; K402-D434 IonicContact NZ-OD1 2.73Å; K402-D434 PolarHBondContact NZ-OD1 2.8Å; K402-D434 IonicContact NZ-OD2 3.3Å; K402-D434 PolarHBondContact NZ-OD2 3.49Å
403	R	96.2	Very high	95.7	Very high	186 Å²	186	64.1 Å²	64.1	70%	0.702	33%	0.332	S	S	*	.	S	Bend	trans	-84.1	137.1	174.8	-75.4	-178.4	64.7	-175.6	-0.4	111.2	V405	R403-V405 PolarHBondContact O-N 3.27Å
404	Y	97.9	Very high	95.5	Very high	74 Å²	74	61.6 Å²	61.6	29%	0.29	33%	0.331	S	S	.	.	S	Bend	trans	57.1	11.4	178.2	-46.7	-69.7	0	0	0	116.8	L359 P362 Y380 Y406	L359-Y404 PolarHBondContact N-O 3.1Å; L359-Y404 WeakPolarHBondContact O-CB 3.41Å; P362-Y404 HydrophobicContact CB-CD1 4.22Å; P362-Y404 HydrophobicContact CB-CE1 4.48Å; P362-Y404 HydrophobicContact CG-CD1 3.54Å; P362-Y404 HydrophobicContact CG-CD2 4.19Å; P362-Y404 HydrophobicContact CG-CE1 3.84Å; P362-Y404 HydrophobicContact CG-CE2 4.45Å; P362-Y404 HydrophobicContact CG-CG 3.74Å; Y380-Y404 HydrophobicContact CD1-CE1 4.3Å; Y380-Y404 HydrophobicContact CE1-CD1 4.16Å; Y380-Y404 AromaticContact CE1-CE1 3.7Å; Y380-Y404 HydrophobicContact CE1-CE1 3.7Å; Y380-Y404 AromaticContact CE2-CD1 3.98Å; Y380-Y404 HydrophobicContact CE2-CD1 3.98Å; Y380-Y404 HydrophobicContact CE2-CE1 4.29Å; Y380-Y404 AromaticContact CZ-CD1 3.62Å; Y380-Y404 AromaticContact CZ-CE1 3.67Å; Y404-Y406 WeakPolarHBondContact O-CD2 3.27Å
405	V	98.2	Very high	95.2	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.024	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	139.9	174.3	-176.1	0	0	0	0	111	T351 E356 F357 K358 K398 T399 K402 R403	T351-V405 HydrophobicContact CG2-CG1 4.3Å; E356-V405 HydrophobicContact CG-CG1 3.37Å; E356-V405 VanDerWaalsContact OE1-CG1 3.22Å; E356-V405 WeakPolarHBondContact OE1-CG1 3.07Å; F357-V405 WeakPolarHBondContact O-CA 3.38Å; F357-V405 WeakPolarHBondContact O-CG1 3.48Å; K358-V405 HydrophobicContact CB-CG2 4.12Å; K358-V405 HydrophobicContact CD-CG2 4.36Å; K358-V405 HydrophobicContact CG-CG2 3.96Å; K398-V405 PolarHBondContact NZ-O 3Å; T399-V405 HydrophobicContact CG2-CG1 4.29Å; T399-V405 PolarHBondContact N-O 3.13Å; K402-V405 HydrophobicContact CB-CB 3.8Å; K402-V405 HydrophobicContact CB-CG1 4.49Å; K402-V405 HydrophobicContact CB-CG2 3.75Å; K402-V405 HydrophobicContact CD-CG2 4.23Å; R403-V405 PolarHBondContact O-N 3.27Å
406	Y	98.5	Very high	94.8	Very high	4 Å²	4	58 Å²	58	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.5	-173.7	-64.2	-85.3	0	0	0	110.2	E356 F357 L359 Y380 L387 I396 H397 K398 Y404	E356-Y406 CarbonylContact C-O 3.51Å; E356-Y406 WeakPolarHBondContact CA-O 3.3Å; F357-Y406 VanDerWaalsContact CD1-O 3.25Å; F357-Y406 WeakPolarHBondContact CD1-O 3.46Å; F357-Y406 HydrophobicContact CE2-CD2 4.39Å; F357-Y406 HydrophobicContact CZ-CG 4.35Å; F357-Y406 PolarHBondContact N-O 3.3Å; F357-Y406 PolarHBondContact O-N 3.2Å; F357-Y406 VanDerWaalsContact O-O 3.06Å; L359-Y406 HydrophobicContact CD1-CE2 4.2Å; Y380-Y406 PolarHBondContact OH-OH 2.93Å; L387-Y406 HydrophobicContact CB-CE1 4.17Å; L387-Y406 HydrophobicContact CD1-CD1 4.19Å; L387-Y406 HydrophobicContact CD1-CD2 4.05Å; L387-Y406 HydrophobicContact CD1-CE1 3.79Å; L387-Y406 HydrophobicContact CD1-CE2 3.64Å; L387-Y406 HydrophobicContact CD1-CG 4.32Å; I396-Y406 HydrophobicContact CG2-CD1 4.18Å; I396-Y406 HydrophobicContact CG2-CG 4.4Å; H397-Y406 WeakPolarHBondContact O-CA 3.21Å; K398-Y406 HydrophobicContact CB-CD1 3.9Å; K398-Y406 HydrophobicContact CB-CE1 3.89Å; K398-Y406 HydrophobicContact CD-CE1 4.09Å; K398-Y406 HydrophobicContact CG-CD1 4.33Å; K398-Y406 HydrophobicContact CG-CE1 4.15Å; Y404-Y406 WeakPolarHBondContact O-CD2 3.27Å
407	R	98.2	Very high	94.4	Very high	68 Å²	68	59 Å²	59	26%	0.257	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	133.4	-179.5	-171.8	177.7	-63.8	-120.9	4.2	110.6	D353 W355 E356 I396 H397	D353-R407 VanDerWaalsContact CG-NH1 3.27Å; D353-R407 IonicContact OD1-CZ 3.08Å; D353-R407 IonicContact OD1-NH1 3.36Å; D353-R407 PolarHBondContact OD1-NH1 3.25Å; D353-R407 IonicContact OD1-NH2 2.72Å; D353-R407 IonicContact OD2-CZ 3.85Å; D353-R407 IonicContact OD2-NH1 2.64Å; D353-R407 PolarHBondContact OD2-NH1 3.06Å; D353-R407 IonicContact OD2-NH2 3.07Å; D353-R407 PolarHBondContact OD2-NH2 2.79Å; W355-R407 WeakPolarHBondContact O-CA 3.17Å; E356-R407 HydrophobicContact CB-CB 4.23Å; E356-R407 HydrophobicContact CB-CG 4.13Å; E356-R407 VanDerWaalsContact CD-NH2 3.27Å; E356-R407 IonicContact OE1-NH2 2.7Å; E356-R407 IonicContact OE2-CZ 2.81Å; E356-R407 VanDerWaalsContact OE2-CZ 3.3Å; E356-R407 IonicContact OE2-NE 3.42Å; E356-R407 PolarHBondContact OE2-NE 3Å; E356-R407 VanDerWaalsContact OE2-NE 3.07Å; E356-R407 IonicContact OE2-NH2 3.5Å; E356-R407 PolarHBondContact OE2-NH2 3.3Å; I396-R407 CarbonylContact C-O 3.56Å; I396-R407 VanDerWaalsContact CA-O 3.31Å; I396-R407 WeakPolarHBondContact CA-O 3.16Å; H397-R407 PolarHBondContact N-O 2.9Å; H397-R407 PolarHBondContact O-N 3.44Å
408	F	97.9	Very high	93.9	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.018	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.7	167	-67.5	-97.6	0	0	0	109.2	W332 L336 L339 W350 W355 F357 I395 I396 L412	W332-F408 HydrophobicContact CB-CE1 4.13Å; W332-F408 HydrophobicContact CE3-CE1 4.33Å; L336-F408 HydrophobicContact CB-CZ 4.24Å; L339-F408 HydrophobicContact CD1-CE2 3.81Å; L339-F408 HydrophobicContact CD1-CZ 4.43Å; W350-F408 HydrophobicContact CH2-CD2 4.01Å; W350-F408 AromaticContact CH2-CE2 3.93Å; W350-F408 HydrophobicContact CH2-CE2 3.93Å; W350-F408 HydrophobicContact CZ3-CD2 4.01Å; W350-F408 HydrophobicContact CZ3-CE2 4.2Å; W355-F408 HydrophobicContact CB-CB 3.94Å; W355-F408 PolarHBondContact O-N 3.39Å; F357-F408 AromaticContact CD1-CD2 3.67Å; F357-F408 HydrophobicContact CD1-CD2 3.67Å; F357-F408 AromaticContact CD1-CE2 3.56Å; F357-F408 HydrophobicContact CD1-CE2 3.56Å; F357-F408 AromaticContact CE1-CD2 3.52Å; F357-F408 HydrophobicContact CE1-CD2 3.52Å; F357-F408 AromaticContact CE1-CE2 3.33Å; F357-F408 HydrophobicContact CE1-CE2 3.33Å; F357-F408 HydrophobicContact CE1-CG 4.4Å; F357-F408 HydrophobicContact CE1-CZ 4.11Å; F357-F408 HydrophobicContact CG-CE2 4.5Å; F357-F408 HydrophobicContact CZ-CE2 4.11Å; I395-F408 WeakPolarHBondContact O-CA 3.36Å; I396-F408 HydrophobicContact CD1-CD1 4.1Å; I396-F408 HydrophobicContact CD1-CE1 3.72Å; I396-F408 HydrophobicContact CD1-CZ 4.06Å; I396-F408 HydrophobicContact CG1-CD1 3.56Å; I396-F408 HydrophobicContact CG1-CE1 3.75Å; I396-F408 HydrophobicContact CG1-CG 4.03Å; I396-F408 HydrophobicContact CG1-CZ 4.33Å; F408-L412 HydrophobicContact CB-CD1 3.6Å; F408-L412 HydrophobicContact CB-CG 4.19Å; F408-L412 HydrophobicContact CD1-CD1 3.84Å; F408-L412 HydrophobicContact CD1-CG 4.46Å; F408-L412 HydrophobicContact CD2-CD1 4.02Å; F408-L412 HydrophobicContact CE1-CD1 4.46Å; F408-L412 HydrophobicContact CG-CD1 3.58Å; F408-L412 HydrophobicContact CG-CG 4.46Å
409	V	96.1	Very high	93.7	Very high	61 Å²	61	54.3 Å²	54.3	37%	0.37	30%	0.303	S	S	.	.			trans	-121.1	-3.5	-178	-59.1	0	0	0	0	113.2	N394 I395 H397	N394-V409 HydrophobicContact CB-CG2 4.23Å; I395-V409 PolarHBondContact O-N 3.32Å; H397-V409 HydrophobicContact CB-CG1 3.9Å; H397-V409 HydrophobicContact CB-CG2 4.45Å
410	C	92.8	Very high	93.5	Very high	36 Å²	36	53.6 Å²	53.6	24%	0.243	30%	0.299	C	S	.	.	S	Bend	trans	-74.6	158.9	163.8	56.5	0	0	0	0	110.8	N394 L412	N394-C410 WeakPolarHBondContact O-CB 3.47Å; N394-C410 PolarHBondContact O-N 2.79Å; C410-L412 PolarHBondContact O-N 3.45Å
411	D	92.2	Very high	93.4	Very high	97 Å²	97	54 Å²	54	52%	0.519	29%	0.289	S	S	.	.			trans	-74	77.7	178.1	-172.3	1.1	0	0	0	112.2	K413 S414 L415	D411-K413 PolarHBondContact O-N 2.9Å; D411-K413 WeakPolarHBondContact OD1-CA 3.48Å; D411-K413 WeakPolarHBondContact OD1-CB 3.35Å; D411-K413 PolarHBondContact OD1-N 3.13Å; D411-S414 PolarHBondContact OD1-N 3.42Å; D411-S414 WeakPolarHBondContact OD2-CB 3.31Å; D411-S414 PolarHBondContact OD2-OG 3.07Å; D411-L415 WeakPolarHBondContact O-CB 3.44Å; D411-L415 PolarHBondContact O-N 3.24Å; D411-L415 VanDerWaalsContact O-N 3.16Å
412	L	91.4	Very high	93.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-22.6	169.6	-71.1	-170.1	0	0	0	112.4	W332 L336 W355 F408 C410 L415 L416	W332-L412 HydrophobicContact CZ3-CD2 4.42Å; L336-L412 HydrophobicContact CD1-CD1 4.43Å; L336-L412 HydrophobicContact CD2-CD2 4.39Å; W355-L412 HydrophobicContact CD2-CB 4.09Å; W355-L412 HydrophobicContact CD2-CD1 3.93Å; W355-L412 HydrophobicContact CE3-CB 4.37Å; W355-L412 HydrophobicContact CE3-CD1 3.76Å; W355-L412 HydrophobicContact CG-CD1 4.38Å; W355-L412 HydrophobicContact CH2-CB 3.97Å; W355-L412 HydrophobicContact CZ2-CB 3.65Å; W355-L412 HydrophobicContact CZ3-CB 4.31Å; W355-L412 HydrophobicContact CZ3-CD1 4.11Å; F408-L412 HydrophobicContact CB-CD1 3.6Å; F408-L412 HydrophobicContact CB-CG 4.19Å; F408-L412 HydrophobicContact CD1-CD1 3.84Å; F408-L412 HydrophobicContact CD1-CG 4.46Å; F408-L412 HydrophobicContact CD2-CD1 4.02Å; F408-L412 HydrophobicContact CE1-CD1 4.46Å; F408-L412 HydrophobicContact CG-CD1 3.58Å; F408-L412 HydrophobicContact CG-CG 4.46Å; C410-L412 PolarHBondContact O-N 3.45Å; L412-L415 HydrophobicContact CD2-CD2 4.16Å; L412-L416 HydrophobicContact CB-CD1 3.9Å; L412-L416 HydrophobicContact CB-CG 4.39Å; L412-L416 HydrophobicContact CD1-CD1 4.37Å; L412-L416 HydrophobicContact CD2-CD1 4.2Å; L412-L416 HydrophobicContact CD2-CG 4.48Å; L412-L416 HydrophobicContact CG-CD1 4.39Å; L412-L416 WeakPolarHBondContact O-CA 3.43Å; L412-L416 WeakPolarHBondContact O-CB 3.44Å; L412-L416 WeakPolarHBondContact O-CG 3.47Å; L412-L416 PolarHBondContact O-N 3.32Å
413	K	89.8	Confident	93.1	Very high	120 Å²	120	50.1 Å²	50.1	52%	0.522	25%	0.248	S	C	.	.	H	α-helix	trans	-70.4	-48.7	-179.9	-180	177.8	173.2	176.7	0	110.8	W355 D411 G417 Y418	W355-K413 HydrophobicContact CZ2-CB 4.49Å; D411-K413 PolarHBondContact O-N 2.9Å; D411-K413 WeakPolarHBondContact OD1-CA 3.48Å; D411-K413 WeakPolarHBondContact OD1-CB 3.35Å; D411-K413 PolarHBondContact OD1-N 3.13Å; K413-G417 WeakPolarHBondContact O-CA 3.25Å; K413-G417 PolarHBondContact O-N 3.39Å; K413-Y418 WeakPolarHBondContact CA-O 3.49Å
414	S	89.1	Confident	92.9	Very high	83 Å²	83	42.2 Å²	42.2	58%	0.58	22%	0.219	S	C	*	.	H	α-helix	trans	-70.9	-35.4	175.9	-60.8	0	0	0	0	112.7	D411	D411-S414 PolarHBondContact OD1-N 3.42Å; D411-S414 WeakPolarHBondContact OD2-CB 3.31Å; D411-S414 PolarHBondContact OD2-OG 3.07Å
415	L	88.1	Confident	92.6	Very high	42 Å²	42	42.1 Å²	42.1	22%	0.22	23%	0.234	C	C	.	.	H	α-helix	trans	-66.9	-47.2	176.1	175.9	62.9	0	0	0	112.2	F298 Y323 T324 W332 D411 L412	F298-L415 PolarHBondContact N-O 3.29Å; Y323-L415 HydrophobicContact CD1-CD1 4.43Å; Y323-L415 HydrophobicContact CE1-CD1 3.97Å; T324-L415 HydrophobicContact CG2-CD1 3.84Å; W332-L415 HydrophobicContact CH2-CD2 3.88Å; W332-L415 HydrophobicContact CZ3-CD2 4.14Å; D411-L415 WeakPolarHBondContact O-CB 3.44Å; D411-L415 PolarHBondContact O-N 3.24Å; D411-L415 VanDerWaalsContact O-N 3.16Å; L412-L415 HydrophobicContact CD2-CD2 4.16Å
416	L	88.3	Confident	92.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-91.6	-27.3	-170.3	-56.2	174.2	0	0	0	113.2	F298 K299 I315 L320 L336 W355 L412 Y418	F298-L416 HydrophobicContact CB-CD2 4.47Å; F298-L416 HydrophobicContact CD1-CD2 4.19Å; K299-L416 WeakPolarHBondContact CB-O 3.33Å; K299-L416 PolarHBondContact N-O 2.89Å; I315-L416 HydrophobicContact CD1-CD1 3.7Å; I315-L416 HydrophobicContact CD1-CD2 3.97Å; I315-L416 HydrophobicContact CD1-CG 4.34Å; L320-L416 HydrophobicContact CD1-CD2 4.11Å; L320-L416 HydrophobicContact CD2-CD2 4.42Å; L336-L416 HydrophobicContact CD1-CD1 4.45Å; L336-L416 HydrophobicContact CD2-CD1 3.95Å; L336-L416 HydrophobicContact CD2-CD2 4.07Å; W355-L416 HydrophobicContact CH2-CD1 4.12Å; W355-L416 HydrophobicContact CZ3-CD1 4.36Å; L412-L416 HydrophobicContact CB-CD1 3.9Å; L412-L416 HydrophobicContact CB-CG 4.39Å; L412-L416 HydrophobicContact CD1-CD1 4.37Å; L412-L416 HydrophobicContact CD2-CD1 4.2Å; L412-L416 HydrophobicContact CD2-CG 4.48Å; L412-L416 HydrophobicContact CG-CD1 4.39Å; L412-L416 WeakPolarHBondContact O-CA 3.43Å; L412-L416 WeakPolarHBondContact O-CB 3.44Å; L412-L416 WeakPolarHBondContact O-CG 3.47Å; L412-L416 PolarHBondContact O-N 3.32Å; L416-Y418 HydrophobicContact CB-CD2 4.25Å; L416-Y418 PolarHBondContact O-N 3.4Å
417	G	88.9	Confident	91.7	Very high	20 Å²	20	46 Å²	46	21%	0.206	25%	0.253	C	S	.	.	S	Bend	trans	78.7	0.6	-169.5	0	0	0	0	0	114.3	K299 K413	K299-G417 WeakPolarHBondContact CD-O 3.41Å; K299-G417 PolarHBondContact NZ-O 2.95Å; K413-G417 WeakPolarHBondContact O-CA 3.25Å; K413-G417 PolarHBondContact O-N 3.39Å
418	Y	88.9	Confident	91.3	Very high	17 Å²	17	48.3 Å²	48.3	7%	0.067	27%	0.27	C	S	.	.			trans	-105.1	141.4	177.9	-71.4	-85.1	0	0	0	111.3	K299 V314 K413 L416 E422 L423 M426	K299-Y418 HydrophobicContact CB-CD2 3.84Å; K299-Y418 HydrophobicContact CB-CE2 3.48Å; K299-Y418 VanDerWaalsContact CB-CE2 3.48Å; K299-Y418 HydrophobicContact CD-CD1 3.85Å; K299-Y418 HydrophobicContact CD-CD2 3.95Å; K299-Y418 HydrophobicContact CD-CE1 3.81Å; K299-Y418 HydrophobicContact CD-CE2 3.92Å; K299-Y418 HydrophobicContact CD-CG 3.92Å; K299-Y418 HydrophobicContact CG-CD1 4.47Å; K299-Y418 HydrophobicContact CG-CD2 4.1Å; K299-Y418 HydrophobicContact CG-CE1 4.01Å; K299-Y418 HydrophobicContact CG-CE2 3.6Å; V314-Y418 HydrophobicContact CG1-CE2 4.45Å; K413-Y418 WeakPolarHBondContact CA-O 3.49Å; L416-Y418 HydrophobicContact CB-CD2 4.25Å; L416-Y418 PolarHBondContact O-N 3.4Å; Y418-E422 VanDerWaalsContact CA-OE2 3.3Å; Y418-E422 WeakPolarHBondContact CA-OE2 3.31Å; Y418-E422 HydrophobicContact CD1-CB 4.32Å; Y418-L423 HydrophobicContact CD1-CD2 4.35Å; Y418-L423 HydrophobicContact CD1-CG 4.13Å; Y418-L423 HydrophobicContact CG-CD1 4.16Å; Y418-L423 HydrophobicContact CG-CD2 4.38Å; Y418-L423 HydrophobicContact CG-CG 4.03Å; Y418-M426 HydrophobicContact CD1-SD 4.33Å; Y418-M426 HydrophobicContact CE1-CE 4.45Å; Y418-M426 HydrophobicContact CE1-SD 3.63Å
419	T	93	Very high	90.8	Very high	33 Å²	33	49.5 Å²	49.5	20%	0.202	28%	0.278	C	S	.	.			trans	-80.7	156.7	160.8	89.1	0	0	0	0	109.9	E421 E422 L423	T419-E421 WeakPolarHBondContact CB-OE2 3.24Å; T419-E421 PolarHBondContact O-N 2.96Å; T419-E421 PolarHBondContact OG1-N 3.31Å; T419-E421 PolarHBondContact OG1-OE2 3.02Å; T419-E422 HydrophobicContact CG2-CG 4.46Å; T419-E422 PolarHBondContact N-OE2 3Å; T419-E422 PolarHBondContact O-N 2.87Å; T419-E422 PolarHBondContact OG1-N 3.17Å; T419-L423 PolarHBondContact O-N 2.81Å
420	P	93.5	Very high	90	Very high	11 Å²	11	55.2 Å²	55.2	7%	0.071	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-34.3	175.6	21.8	-28.2	0	0	0	111.6	G354 W355 L423 H424	G354-P420 WeakPolarHBondContact O-CB 3.29Å; W355-P420 HydrophobicContact CD2-CB 3.9Å; W355-P420 HydrophobicContact CD2-CG 4.33Å; W355-P420 HydrophobicContact CE3-CB 4.04Å; W355-P420 HydrophobicContact CG-CB 4.44Å; W355-P420 HydrophobicContact CH2-CB 4.4Å; W355-P420 HydrophobicContact CZ2-CB 4.26Å; W355-P420 HydrophobicContact CZ2-CG 4.33Å; W355-P420 HydrophobicContact CZ3-CB 4.29Å; P420-L423 PolarHBondContact O-N 3.01Å; P420-H424 WeakPolarHBondContact O-CB 3.35Å; P420-H424 PolarHBondContact O-CD2 3.47Å; P420-H424 PolarHBondContact O-N 2.86Å; P420-H424 PolarHBondContact O-ND1 2.78Å
421	E	92.8	Very high	89.3	Confident	119 Å²	119	57.7 Å²	57.7	56%	0.556	31%	0.313	S	S	*	.	H	α-helix	trans	-64.7	-40.9	177.6	-51.6	75.5	-163.1	0	0	112.2	T419 L423 H424 A425	T419-E421 WeakPolarHBondContact CB-OE2 3.24Å; T419-E421 PolarHBondContact O-N 2.96Å; T419-E421 PolarHBondContact OG1-N 3.31Å; T419-E421 PolarHBondContact OG1-OE2 3.02Å; E421-L423 VanDerWaalsContact C-N 3.35Å; E421-H424 PolarHBondContact O-N 2.83Å; E421-A425 WeakPolarHBondContact O-CB 3.42Å; E421-A425 PolarHBondContact O-N 2.67Å
422	E	91.9	Very high	88.3	Confident	73 Å²	73	56 Å²	56	34%	0.341	30%	0.304	S	S	.	.	H	α-helix	trans	-59.7	-44.9	172.7	-73.1	-177.3	117.6	0	0	111.5	K299 Y418 T419 A425 M426	K299-E422 IonicContact NZ-OE1 3.1Å; K299-E422 PolarHBondContact NZ-OE1 3.1Å; K299-E422 IonicContact NZ-OE2 2.68Å; K299-E422 PolarHBondContact NZ-OE2 3.23Å; Y418-E422 VanDerWaalsContact CA-OE2 3.3Å; Y418-E422 WeakPolarHBondContact CA-OE2 3.31Å; Y418-E422 HydrophobicContact CD1-CB 4.32Å; T419-E422 HydrophobicContact CG2-CG 4.46Å; T419-E422 PolarHBondContact N-OE2 3Å; T419-E422 PolarHBondContact O-N 2.87Å; T419-E422 PolarHBondContact OG1-N 3.17Å; E422-A425 PolarHBondContact O-N 3.16Å; E422-M426 WeakPolarHBondContact O-CB 3.49Å; E422-M426 WeakPolarHBondContact O-CG 3.25Å; E422-M426 PolarHBondContact O-N 2.91Å
423	L	90.9	Very high	86.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-69	-41.5	179.3	-83.5	166.2	0	0	0	111.8	V314 I315 T340 W355 Y418 T419 P420 E421 A425 M426 L427	V314-L423 HydrophobicContact CG1-CD2 4.32Å; I315-L423 HydrophobicContact CD1-CD1 4.41Å; T340-L423 HydrophobicContact CG2-CD2 4.06Å; W355-L423 HydrophobicContact CH2-CD1 3.83Å; W355-L423 HydrophobicContact CZ3-CD1 3.66Å; Y418-L423 HydrophobicContact CD1-CD2 4.35Å; Y418-L423 HydrophobicContact CD1-CG 4.13Å; Y418-L423 HydrophobicContact CG-CD1 4.16Å; Y418-L423 HydrophobicContact CG-CD2 4.38Å; Y418-L423 HydrophobicContact CG-CG 4.03Å; T419-L423 PolarHBondContact O-N 2.81Å; P420-L423 PolarHBondContact O-N 3.01Å; E421-L423 VanDerWaalsContact C-N 3.35Å; L423-A425 VanDerWaalsContact C-N 3.32Å; L423-A425 PolarHBondContact O-N 3.09Å; L423-M426 PolarHBondContact O-N 2.97Å; L423-L427 WeakPolarHBondContact O-CB 3.38Å; L423-L427 WeakPolarHBondContact O-CD1 3.45Å; L423-L427 WeakPolarHBondContact O-CG 3.47Å; L423-L427 PolarHBondContact O-N 3.12Å
424	H	92.8	Very high	84.7	Confident	20 Å²	20	61.9 Å²	61.9	9%	0.093	35%	0.346	C	S	.	.	H	α-helix	trans	-58.5	-44.1	174.4	-67.7	169.5	0	0	0	111.5	W350 G352 G354 P420 E421 L427 D428 V429	W350-H424 WeakPolarHBondContact CB-NE2 3.45Å; W350-H424 AromaticContact CD1-CD2 3.94Å; W350-H424 AromaticContact CD2-NE2 3.83Å; W350-H424 AromaticContact CG-CD2 3.71Å; W350-H424 AromaticContact CG-NE2 3.51Å; G352-H424 PolarHBondContact O-CE1 3.07Å; G352-H424 PolarHBondContact O-ND1 3.4Å; G354-H424 PolarHBondContact O-CE1 3.4Å; G354-H424 PolarHBondContact O-NE2 3.04Å; P420-H424 WeakPolarHBondContact O-CB 3.35Å; P420-H424 PolarHBondContact O-CD2 3.47Å; P420-H424 PolarHBondContact O-N 2.86Å; P420-H424 PolarHBondContact O-ND1 2.78Å; E421-H424 PolarHBondContact O-N 2.83Å; H424-L427 PolarHBondContact O-N 3.07Å; H424-D428 PolarHBondContact O-N 2.88Å; H424-D428 VanDerWaalsContact O-N 3.11Å; H424-V429 HydrophobicContact CB-CB 3.99Å; H424-V429 HydrophobicContact CB-CG2 4.35Å; H424-V429 PolarHBondContact O-N 3.11Å
425	A	91	Very high	82	Confident	73 Å²	73	70.6 Å²	70.6	60%	0.603	38%	0.378	S	S	*	.	H	α-helix	trans	-66.2	-42.9	175.6	0	0	0	0	0	112.7	E421 E422 L423 L427 D428	E421-A425 WeakPolarHBondContact O-CB 3.42Å; E421-A425 PolarHBondContact O-N 2.67Å; E422-A425 PolarHBondContact O-N 3.16Å; L423-A425 VanDerWaalsContact C-N 3.32Å; L423-A425 PolarHBondContact O-N 3.09Å; A425-L427 PolarHBondContact O-N 3.32Å; A425-D428 PolarHBondContact O-N 3.39Å
426	M	88.5	Confident	81.7	Confident	87 Å²	87	72.1 Å²	72.1	43%	0.429	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-30.6	174.4	-76.6	-179.9	63	0	0	112.7	V314 K342 Y418 E422 L423	V314-M426 HydrophobicContact CG1-CE 3.82Å; V314-M426 HydrophobicContact CG2-CE 4Å; K342-M426 WeakPolarHBondContact CE-O 3.45Å; K342-M426 PolarHBondContact NZ-O 3.31Å; Y418-M426 HydrophobicContact CD1-SD 4.33Å; Y418-M426 HydrophobicContact CE1-CE 4.45Å; Y418-M426 HydrophobicContact CE1-SD 3.63Å; E422-M426 WeakPolarHBondContact O-CB 3.49Å; E422-M426 WeakPolarHBondContact O-CG 3.25Å; E422-M426 PolarHBondContact O-N 2.91Å; L423-M426 PolarHBondContact O-N 2.97Å
427	L	88.8	Confident	81.3	Confident	3 Å²	3	75.8 Å²	75.8	2%	0.016	41%	0.406	C	S	.	.	H	α-helix	trans	-95.7	-1.1	-174	-68.1	168.6	0	0	0	114.3	L339 T340 K342 Q345 L423 H424 A425 V429	L339-L427 VanDerWaalsContact O-CD1 3.23Å; L339-L427 WeakPolarHBondContact O-CD1 3.33Å; T340-L427 HydrophobicContact CG2-CD1 4.37Å; K342-L427 VanDerWaalsContact CE-CA 3.42Å; K342-L427 HydrophobicContact CG-CD2 4.1Å; Q345-L427 PolarHBondContact NE2-O 3.45Å; L423-L427 WeakPolarHBondContact O-CB 3.38Å; L423-L427 WeakPolarHBondContact O-CD1 3.45Å; L423-L427 WeakPolarHBondContact O-CG 3.47Å; L423-L427 PolarHBondContact O-N 3.12Å; H424-L427 PolarHBondContact O-N 3.07Å; A425-L427 PolarHBondContact O-N 3.32Å; L427-V429 HydrophobicContact CB-CG2 3.81Å; L427-V429 PolarHBondContact O-N 3.22Å
428	D	90	Very high	80.9	Confident	116 Å²	116	78.9 Å²	78.9	62%	0.62	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	33.2	-172.8	-53.8	-55.9	0	0	0	113.4	K342 H424 A425 K430	K342-D428 IonicContact NZ-OD2 3.93Å; K342-D428 PolarHBondContact NZ-OD2 3.48Å; H424-D428 PolarHBondContact O-N 2.88Å; H424-D428 VanDerWaalsContact O-N 3.11Å; A425-D428 PolarHBondContact O-N 3.39Å; D428-K430 PolarHBondContact O-N 3.16Å
429	V	87.8	Confident	80.4	Confident	28 Å²	28	82.6 Å²	82.6	17%	0.17	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-64.2	120.2	-178.2	173.2	0	0	0	0	110.1	W350 H424 L427	W350-V429 HydrophobicContact CB-CG1 4.05Å; W350-V429 HydrophobicContact CB-CG2 4.13Å; W350-V429 HydrophobicContact CG-CG2 4.46Å; H424-V429 HydrophobicContact CB-CB 3.99Å; H424-V429 HydrophobicContact CB-CG2 4.35Å; H424-V429 PolarHBondContact O-N 3.11Å; L427-V429 HydrophobicContact CB-CG2 3.81Å; L427-V429 PolarHBondContact O-N 3.22Å
430	K	79.6	Confident	79.7	Confident	181 Å²	181	85.7 Å²	85.7	79%	0.787	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-83.5	133.6	163.8	-63.4	-179.3	-178.6	179.4	0	108.5	D428	D428-K430 PolarHBondContact O-N 3.16Å
431	P	78	Confident	78.7	Confident	88 Å²	88	90.7 Å²	90.7	57%	0.571	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-64.4	142.8	173	27.8	-33.6	0	0	0	110.3	T351 T433	T351-P431 CarbonylContact O-C 3.26Å; T351-P431 VanDerWaalsContact O-CA 3.27Å; T351-P431 WeakPolarHBondContact O-CA 3.39Å; P431-T433 VanDerWaalsContact C-N 3.35Å; P431-T433 PolarHBondContact O-N 2.86Å
432	D	70.4	Confident	77.7	Confident	61 Å²	61	88.6 Å²	88.6	33%	0.326	47%	0.472	S	S	.	.			trans	-67.8	93	167.5	-102	-12.7	0	0	0	107.8	T351 K358 D434	T351-D432 PolarHBondContact O-N 3.08Å; K358-D432 WeakPolarHBondContact CD-OD2 3.44Å; K358-D432 WeakPolarHBondContact CE-OD2 3.36Å; K358-D432 IonicContact NZ-OD1 2.72Å; K358-D432 PolarHBondContact NZ-OD1 2.89Å; K358-D432 VanDerWaalsContact NZ-OD1 3.13Å; K358-D432 IonicContact NZ-OD2 2.66Å; K358-D432 PolarHBondContact NZ-OD2 3.49Å; D432-D434 PolarHBondContact O-N 2.81Å; D432-D434 VanDerWaalsContact O-N 3.17Å
433	T	55	Low	76.7	Confident	124 Å²	124	89.8 Å²	89.8	76%	0.761	48%	0.482	S	S	*	.			trans	-69.4	103.4	160.2	34.1	0	0	0	0	108.1	P431 E435	P431-T433 VanDerWaalsContact C-N 3.35Å; P431-T433 PolarHBondContact O-N 2.86Å; T433-E435 PolarHBondContact O-N 3.06Å
434	D	52	Low	75.5	Confident	120 Å²	120	97.3 Å²	97.3	64%	0.642	52%	0.522	S	S	*	.			trans	-63.3	113.8	170.1	-58.6	-62.1	0	0	0	108.9	K402 D432	K402-D434 IonicContact NZ-OD1 2.73Å; K402-D434 PolarHBondContact NZ-OD1 2.8Å; K402-D434 IonicContact NZ-OD2 3.3Å; K402-D434 PolarHBondContact NZ-OD2 3.49Å; D432-D434 PolarHBondContact O-N 2.81Å; D432-D434 VanDerWaalsContact O-N 3.17Å
435	E	31.7	Very low	73.9	Confident	267 Å²	267	104.4 Å²	104.4	100%	1.248	56%	0.561	S	S	*	*			trans	-90	0	163.7	-83	-169.2	134.9	0	0	111.2	T433	T433-E435 PolarHBondContact O-N 3.06Å

Retrieved 435 of 435 residues in 155.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).