A0A077Z226_TRITR Loading...

PAP2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z226, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 267 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	40.5	Very low	238 Å²	238	159.9 Å²	159.9	100%	1.172	79%	0.792	S	S	*	*				0	63.5	0	-163	172.1	169.9	0	0	108.3
2	L	33.7	Very low	41.4	Very low	177 Å²	177	152.4 Å²	152.4	93%	0.927	77%	0.774	S	S	*	*			trans	-105.1	34.4	-175.5	-82.3	170.4	0	0	0	111.2
3	D	37.1	Very low	41.9	Very low	148 Å²	148	149.7 Å²	149.7	79%	0.791	76%	0.762	S	S	*	*			trans	-133.7	94.4	175.7	-76.2	-47.9	0	0	0	107
4	V	40.7	Very low	41.9	Very low	133 Å²	133	144.3 Å²	144.3	81%	0.806	74%	0.736	S	S	*	*			trans	-175.9	79.7	136.2	-174.3	0	0	0	0	106.4
5	L	37.2	Very low	41.9	Very low	163 Å²	163	139.2 Å²	139.2	85%	0.853	71%	0.71	S	S	*	*	S	Bend	trans	-110.9	113.3	149.8	-94.2	163.4	0	0	0	106.4	R7	L5-R7 PolarHBondContact O-N 3.44Å
6	P	37.4	Very low	41.9	Very low	81 Å²	81	142.9 Å²	142.9	53%	0.526	71%	0.713	S	S	.	*			trans	-64.8	131.1	-165.2	7.7	-11	0	0	0	112	K8	P6-K8 PolarHBondContact O-N 3.33Å
7	R	47.3	Very low	42	Very low	241 Å²	241	145.9 Å²	145.9	91%	0.909	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-53.2	1.7	173.8	-120.8	177.3	-121	-116.3	0.3	115.6	L5 L9	L5-R7 PolarHBondContact O-N 3.44Å; R7-L9 VanDerWaalsContact C-N 3.29Å; R7-L9 PolarHBondContact O-N 3.21Å
8	K	39.7	Very low	42.2	Very low	175 Å²	175	145.8 Å²	145.8	76%	0.761	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-75.3	-10.4	178.7	-73.7	-167.6	175.2	-174.7	0	114.3	P6	P6-K8 PolarHBondContact O-N 3.33Å
9	L	40.5	Very low	42.2	Very low	131 Å²	131	149.7 Å²	149.7	69%	0.686	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-80.3	-14.8	177.5	-85.4	157.3	0	0	0	114.3	R7	R7-L9 VanDerWaalsContact C-N 3.29Å; R7-L9 PolarHBondContact O-N 3.21Å
10	F	46.2	Very low	42.3	Very low	186 Å²	186	146.3 Å²	146.3	82%	0.816	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-113.2	26.7	-179.2	-74.9	-79.5	0	0	0	113.4	A12	F10-A12 PolarHBondContact O-N 3.19Å
11	D	48.8	Very low	42.8	Very low	86 Å²	86	144.4 Å²	144.4	46%	0.46	70%	0.7	S	S	.	*			trans	-80.9	113.4	168.5	-165.1	-21.9	0	0	0	109.1	N13 N14 I15	D11-N13 PolarHBondContact O-N 2.96Å; D11-N13 PolarHBondContact OD1-N 3.13Å; D11-N13 VanDerWaalsContact OD1-N 3.16Å; D11-N14 HydrophobicContact CB-CB 4.32Å; D11-N14 WeakPolarHBondContact O-CA 3.01Å; D11-N14 WeakPolarHBondContact O-CB 3.01Å; D11-N14 PolarHBondContact O-N 3.44Å; D11-I15 PolarHBondContact O-N 3.48Å
12	A	50.7	Low	43.6	Very low	70 Å²	70	136.2 Å²	136.2	58%	0.579	67%	0.665	S	S	*	*	H	α-helix	trans	-57.4	-22.2	-179.5	0	0	0	0	0	113.1	F10 R16	F10-A12 PolarHBondContact O-N 3.19Å; A12-R16 PolarHBondContact O-N 3.17Å
13	N	48.2	Very low	44.8	Very low	117 Å²	117	136.8 Å²	136.8	63%	0.626	66%	0.655	S	S	*	*	H	α-helix	trans	-74.9	-27	172.9	-75.4	-31.2	0	0	0	113.2	D11	D11-N13 PolarHBondContact O-N 2.96Å; D11-N13 PolarHBondContact OD1-N 3.13Å; D11-N13 VanDerWaalsContact OD1-N 3.16Å
14	N	41.5	Very low	45.9	Very low	74 Å²	74	135.9 Å²	135.9	40%	0.396	65%	0.645	S	S	.	*	H	α-helix	trans	-79.3	-40.4	176	-147.3	24.1	0	0	0	110.8	D11 R16 R17 E18	D11-N14 HydrophobicContact CB-CB 4.32Å; D11-N14 WeakPolarHBondContact O-CA 3.01Å; D11-N14 WeakPolarHBondContact O-CB 3.01Å; D11-N14 PolarHBondContact O-N 3.44Å; N14-R16 VanDerWaalsContact C-N 3.26Å; N14-R16 PolarHBondContact O-N 2.82Å; N14-R17 PolarHBondContact O-N 3.02Å; N14-E18 PolarHBondContact O-N 3.27Å
15	I	42.6	Very low	46.6	Very low	68 Å²	68	133.6 Å²	133.6	35%	0.349	63%	0.628	S	S	.	*	H	α-helix	trans	-59.4	-36.8	174.5	-60.8	173	0	0	0	111	D11 R17 E18 W19	D11-I15 PolarHBondContact O-N 3.48Å; I15-R17 VanDerWaalsContact C-N 3.26Å; I15-R17 PolarHBondContact O-N 3.03Å; I15-E18 PolarHBondContact O-N 3.49Å; I15-W19 VanDerWaalsContact O-CD1 3.26Å
16	R	42.2	Very low	47.4	Very low	198 Å²	198	130 Å²	130	75%	0.747	61%	0.607	S	S	*	*	H	α-helix	trans	-66.5	-24.1	177.2	-168.7	174.7	-68.5	-114.5	0.3	113.6	A12 N14	A12-R16 PolarHBondContact O-N 3.17Å; N14-R16 VanDerWaalsContact C-N 3.26Å; N14-R16 PolarHBondContact O-N 2.82Å
17	R	43.1	Very low	48.2	Very low	195 Å²	195	133.7 Å²	133.7	74%	0.736	61%	0.611	S	S	*	*	H	α-helix	trans	-85.5	-24.8	179.2	-69.3	-174.2	-172.3	-170.7	2.9	113.5	N14 I15 T20	N14-R17 PolarHBondContact O-N 3.02Å; I15-R17 VanDerWaalsContact C-N 3.26Å; I15-R17 PolarHBondContact O-N 3.03Å; R17-T20 PolarHBondContact O-OG1 3.36Å
18	E	45.6	Very low	48.3	Very low	143 Å²	143	131.5 Å²	131.5	67%	0.668	60%	0.603	S	S	*	*	H	α-helix	trans	-86.7	-22	-177.4	-80.5	167.4	167.8	0	0	114.1	N14 I15 T20	N14-E18 PolarHBondContact O-N 3.27Å; I15-E18 PolarHBondContact O-N 3.49Å; E18-T20 VanDerWaalsContact C-N 3.29Å; E18-T20 PolarHBondContact O-N 2.99Å
19	W	41.6	Very low	48.9	Very low	220 Å²	220	126.1 Å²	126.1	83%	0.833	59%	0.591	S	S	*	*	S	Bend	trans	-84.8	2.6	175.9	-71.1	101.4	0	0	0	114.3	I15 L21	I15-W19 VanDerWaalsContact O-CD1 3.26Å; W19-L21 PolarHBondContact O-N 3.34Å
20	T	44.6	Very low	49.5	Very low	82 Å²	82	125.2 Å²	125.2	50%	0.503	58%	0.584	S	S	.	*	S	Bend	trans	-75.5	112.8	165.2	55.8	0	0	0	0	108.3	R17 E18	R17-T20 PolarHBondContact O-OG1 3.36Å; E18-T20 VanDerWaalsContact C-N 3.29Å; E18-T20 PolarHBondContact O-N 2.99Å
21	L	52	Low	49.8	Very low	106 Å²	106	119.2 Å²	119.2	56%	0.555	57%	0.565	S	S	*	*			trans	-42.6	137.6	167.6	-76.4	165.8	0	0	0	109.2	W19 R23 I25 Q26	W19-L21 PolarHBondContact O-N 3.34Å; L21-R23 PolarHBondContact O-N 3.48Å; L21-I25 HydrophobicContact CB-CB 4.47Å; L21-I25 HydrophobicContact CB-CG2 4.41Å; L21-I25 HydrophobicContact CD1-CG2 4.35Å; L21-I25 HydrophobicContact CD2-CG2 4.35Å; L21-Q26 HydrophobicContact CB-CG 3.99Å; L21-Q26 WeakPolarHBondContact O-CG 3.41Å; L21-Q26 PolarHBondContact O-NE2 2.95Å
22	P	55.1	Low	49.9	Very low	67 Å²	67	116.9 Å²	116.9	44%	0.435	56%	0.555	S	S	.	*			trans	-42.9	138	177.3	-29.3	31.8	0	0	0	111.1	E24 I25 Q26	P22-E24 WeakPolarHBondContact CB-OE2 3.21Å; P22-E24 PolarHBondContact O-N 3.12Å; P22-I25 HydrophobicContact CB-CG1 4.38Å; P22-I25 HydrophobicContact CG-CD1 4.14Å; P22-I25 WeakPolarHBondContact O-CA 3.5Å; P22-I25 PolarHBondContact O-N 3.41Å; P22-Q26 PolarHBondContact O-N 3.1Å
23	R	58.5	Low	50.1	Low	189 Å²	189	122.4 Å²	122.4	71%	0.713	56%	0.561	S	S	*	*	H	α-helix	trans	-52.4	-34.7	-177.4	-93.9	-171.5	-77.4	-136.6	-2.2	110.8	L21 I25 Q26 Y27	L21-R23 PolarHBondContact O-N 3.48Å; R23-I25 PolarHBondContact O-N 2.97Å; R23-Q26 PolarHBondContact O-N 3.18Å; R23-Y27 HydrophobicContact CB-CD2 4.21Å; R23-Y27 HydrophobicContact CB-CE2 4.29Å; R23-Y27 WeakPolarHBondContact O-CB 3.44Å; R23-Y27 WeakPolarHBondContact O-CD2 3.3Å; R23-Y27 PolarHBondContact O-N 2.81Å
24	E	59.3	Low	50	Low	128 Å²	128	121.1 Å²	121.1	60%	0.598	55%	0.553	S	S	*	*	H	α-helix	trans	-59.4	-44.8	175	-55.7	89.1	179.7	0	0	112.2	P22 Y27 W28	P22-E24 WeakPolarHBondContact CB-OE2 3.21Å; P22-E24 PolarHBondContact O-N 3.12Å; E24-Y27 CarbonylContact O-C 2.91Å; E24-Y27 PolarHBondContact O-N 3.06Å; E24-W28 WeakPolarHBondContact O-CB 3.4Å; E24-W28 PolarHBondContact O-N 3.22Å
25	I	55.8	Low	50.4	Low	86 Å²	86	120.8 Å²	120.8	44%	0.441	56%	0.557	S	S	.	*	H	α-helix	trans	-68.7	-38.1	179.2	-61.4	-178.7	0	0	0	111	L21 P22 R23 W28 A29	L21-I25 HydrophobicContact CB-CB 4.47Å; L21-I25 HydrophobicContact CB-CG2 4.41Å; L21-I25 HydrophobicContact CD1-CG2 4.35Å; L21-I25 HydrophobicContact CD2-CG2 4.35Å; P22-I25 HydrophobicContact CB-CG1 4.38Å; P22-I25 HydrophobicContact CG-CD1 4.14Å; P22-I25 WeakPolarHBondContact O-CA 3.5Å; P22-I25 PolarHBondContact O-N 3.41Å; R23-I25 PolarHBondContact O-N 2.97Å; I25-W28 PolarHBondContact O-N 3.05Å; I25-A29 WeakPolarHBondContact O-CB 3.16Å; I25-A29 PolarHBondContact O-N 3.08Å
26	Q	55.2	Low	50.7	Low	87 Å²	87	119.2 Å²	119.2	41%	0.407	55%	0.553	S	S	.	*	H	α-helix	trans	-64.7	-44.3	173.2	-67.2	-177.8	-13	0	0	111.4	L21 P22 R23 W28 A29 H30	L21-Q26 HydrophobicContact CB-CG 3.99Å; L21-Q26 WeakPolarHBondContact O-CG 3.41Å; L21-Q26 PolarHBondContact O-NE2 2.95Å; P22-Q26 PolarHBondContact O-N 3.1Å; R23-Q26 PolarHBondContact O-N 3.18Å; Q26-W28 VanDerWaalsContact C-N 3.33Å; Q26-A29 PolarHBondContact O-N 2.69Å; Q26-H30 WeakPolarHBondContact O-CB 3.39Å; Q26-H30 PolarHBondContact O-N 2.68Å
27	Y	53.3	Low	51.1	Low	158 Å²	158	115.5 Å²	115.5	62%	0.62	55%	0.548	S	S	*	.	H	α-helix	trans	-62.9	-38.9	173.2	-84.9	-68.7	0	0	0	111.3	R23 E24 S31	R23-Y27 HydrophobicContact CB-CD2 4.21Å; R23-Y27 HydrophobicContact CB-CE2 4.29Å; R23-Y27 WeakPolarHBondContact O-CB 3.44Å; R23-Y27 WeakPolarHBondContact O-CD2 3.3Å; R23-Y27 PolarHBondContact O-N 2.81Å; E24-Y27 CarbonylContact O-C 2.91Å; E24-Y27 PolarHBondContact O-N 3.06Å; Y27-S31 WeakPolarHBondContact O-CA 3.39Å; Y27-S31 WeakPolarHBondContact O-CB 3.45Å; Y27-S31 PolarHBondContact O-N 2.93Å; Y27-S31 PolarHBondContact O-OG 3.23Å
28	W	49.4	Very low	51.2	Low	195 Å²	195	109.2 Å²	109.2	74%	0.739	54%	0.538	S	S	*	.	H	α-helix	trans	-67.3	-44.4	175.3	-88.5	105.1	0	0	0	112	E24 I25 Q26 H30 S31 C32	E24-W28 WeakPolarHBondContact O-CB 3.4Å; E24-W28 PolarHBondContact O-N 3.22Å; I25-W28 PolarHBondContact O-N 3.05Å; Q26-W28 VanDerWaalsContact C-N 3.33Å; W28-H30 VanDerWaalsContact C-N 3.35Å; W28-S31 PolarHBondContact O-N 3.17Å; W28-C32 WeakPolarHBondContact O-CA 3.41Å; W28-C32 WeakPolarHBondContact O-CB 3.38Å; W28-C32 PolarHBondContact O-N 3.01Å
29	A	53	Low	51.4	Low	62 Å²	62	107 Å²	107	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-63.8	-41.9	175.6	0	0	0	0	0	111.3	I25 Q26 R33	I25-A29 WeakPolarHBondContact O-CB 3.16Å; I25-A29 PolarHBondContact O-N 3.08Å; Q26-A29 PolarHBondContact O-N 2.69Å; A29-R33 VanDerWaalsContact O-CB 3.24Å; A29-R33 WeakPolarHBondContact O-CB 3.21Å; A29-R33 PolarHBondContact O-N 3.31Å
30	H	52.1	Low	51.9	Low	113 Å²	113	98 Å²	98	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-73.3	-37	178.5	-147	-71.1	0	0	0	112.1	Q26 W28 R33 L34	Q26-H30 WeakPolarHBondContact O-CB 3.39Å; Q26-H30 PolarHBondContact O-N 2.68Å; W28-H30 VanDerWaalsContact C-N 3.35Å; H30-R33 CarbonylContact O-C 3.5Å; H30-R33 PolarHBondContact O-N 3.46Å; H30-L34 WeakPolarHBondContact ND1-CD1 3.35Å; H30-L34 VanDerWaalsContact O-CB 3.23Å; H30-L34 WeakPolarHBondContact O-CB 3.49Å; H30-L34 WeakPolarHBondContact O-CD1 2.95Å; H30-L34 WeakPolarHBondContact O-CG 2.81Å; H30-L34 PolarHBondContact O-N 3.01Å
31	S	53.2	Low	52.3	Low	60 Å²	60	105 Å²	105	42%	0.42	52%	0.518	S	S	.	.	H	α-helix	trans	-70.5	-36.3	173.8	-70.7	0	0	0	0	111.2	Y27 W28 R33 L34 S35	Y27-S31 WeakPolarHBondContact O-CA 3.39Å; Y27-S31 WeakPolarHBondContact O-CB 3.45Å; Y27-S31 PolarHBondContact O-N 2.93Å; Y27-S31 PolarHBondContact O-OG 3.23Å; W28-S31 PolarHBondContact O-N 3.17Å; S31-R33 VanDerWaalsContact C-N 3.33Å; S31-L34 CarbonylContact O-C 3.28Å; S31-L34 PolarHBondContact O-N 2.87Å; S31-S35 VanDerWaalsContact O-CB 3.25Å; S31-S35 WeakPolarHBondContact O-CB 3.38Å; S31-S35 PolarHBondContact O-N 3.41Å; S31-S35 PolarHBondContact O-OG 3.27Å
32	C	51.7	Low	52.9	Low	37 Å²	37	102.5 Å²	102.5	25%	0.25	51%	0.506	C	S	.	.	H	α-helix	trans	-68.1	-36.9	172.6	-157.5	0	0	0	0	110.3	W28 S35 A36	W28-C32 WeakPolarHBondContact O-CA 3.41Å; W28-C32 WeakPolarHBondContact O-CB 3.38Å; W28-C32 PolarHBondContact O-N 3.01Å; C32-S35 VanDerWaalsContact CA-OG 3.29Å; C32-S35 WeakPolarHBondContact CA-OG 3.32Å; C32-S35 PolarHBondContact O-OG 3.44Å; C32-S35 VanDerWaalsContact O-OG 3.06Å; C32-A36 WeakPolarHBondContact O-CB 3.25Å; C32-A36 PolarHBondContact O-N 3Å
33	R	53.3	Low	53.7	Low	186 Å²	186	99.8 Å²	99.8	70%	0.702	49%	0.49	S	S	*	.	H	α-helix	trans	-70.1	-35.1	171.9	-155.6	173.3	-146	-141	3.5	112.8	A29 H30 S31 A36 L37	A29-R33 VanDerWaalsContact O-CB 3.24Å; A29-R33 WeakPolarHBondContact O-CB 3.21Å; A29-R33 PolarHBondContact O-N 3.31Å; H30-R33 CarbonylContact O-C 3.5Å; H30-R33 PolarHBondContact O-N 3.46Å; S31-R33 VanDerWaalsContact C-N 3.33Å; R33-A36 PolarHBondContact O-N 3Å; R33-L37 VanDerWaalsContact O-CG 3.27Å; R33-L37 WeakPolarHBondContact O-CG 3.43Å; R33-L37 PolarHBondContact O-N 3.43Å
34	L	47.8	Very low	54.9	Low	90 Å²	90	92.9 Å²	92.9	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-77.3	-34.6	176.3	-76.6	165.4	0	0	0	111.8	H30 S31 A36 L37 A38	H30-L34 WeakPolarHBondContact ND1-CD1 3.35Å; H30-L34 VanDerWaalsContact O-CB 3.23Å; H30-L34 WeakPolarHBondContact O-CB 3.49Å; H30-L34 WeakPolarHBondContact O-CD1 2.95Å; H30-L34 WeakPolarHBondContact O-CG 2.81Å; H30-L34 PolarHBondContact O-N 3.01Å; S31-L34 CarbonylContact O-C 3.28Å; S31-L34 PolarHBondContact O-N 2.87Å; L34-A36 VanDerWaalsContact C-N 3.31Å; L34-L37 HydrophobicContact CD2-CD1 4.15Å; L34-L37 CarbonylContact O-C 3.57Å; L34-L37 WeakPolarHBondContact O-CB 3.22Å; L34-L37 PolarHBondContact O-N 3.38Å; L34-A38 WeakPolarHBondContact O-CB 3.47Å; L34-A38 PolarHBondContact O-N 3.04Å
35	S	49.4	Very low	56.4	Low	67 Å²	67	87.1 Å²	87.1	47%	0.469	44%	0.444	S	S	.	.	H	α-helix	trans	-73.5	-25.6	169.5	62.7	0	0	0	0	111.6	S31 C32 L37 A38	S31-S35 VanDerWaalsContact O-CB 3.25Å; S31-S35 WeakPolarHBondContact O-CB 3.38Å; S31-S35 PolarHBondContact O-N 3.41Å; S31-S35 PolarHBondContact O-OG 3.27Å; C32-S35 VanDerWaalsContact CA-OG 3.29Å; C32-S35 WeakPolarHBondContact CA-OG 3.32Å; C32-S35 PolarHBondContact O-OG 3.44Å; C32-S35 VanDerWaalsContact O-OG 3.06Å; S35-L37 VanDerWaalsContact C-N 3.33Å; S35-A38 PolarHBondContact O-N 2.91Å
36	A	49.4	Very low	58	Low	34 Å²	34	88.8 Å²	88.8	28%	0.281	45%	0.445	S	S	.	.	H	α-helix	trans	-74.8	-22.3	166.9	0	0	0	0	0	112.9	C32 R33 L34 F138	C32-A36 WeakPolarHBondContact O-CB 3.25Å; C32-A36 PolarHBondContact O-N 3Å; R33-A36 PolarHBondContact O-N 3Å; L34-A36 VanDerWaalsContact C-N 3.31Å; A36-F138 HydrophobicContact CB-CD1 3.74Å; A36-F138 HydrophobicContact CB-CD2 4.13Å; A36-F138 HydrophobicContact CB-CE1 3.5Å; A36-F138 VanDerWaalsContact CB-CE1 3.5Å; A36-F138 HydrophobicContact CB-CE2 3.92Å; A36-F138 HydrophobicContact CB-CG 4.06Å; A36-F138 HydrophobicContact CB-CZ 3.6Å
37	L	49.2	Very low	59.5	Low	120 Å²	120	84.8 Å²	84.8	63%	0.628	43%	0.427	S	S	*	.	H	α-helix	trans	-83	-30.3	167.8	-72.6	165.9	0	0	0	111.8	R33 L34 S35 D39	R33-L37 VanDerWaalsContact O-CG 3.27Å; R33-L37 WeakPolarHBondContact O-CG 3.43Å; R33-L37 PolarHBondContact O-N 3.43Å; L34-L37 HydrophobicContact CD2-CD1 4.15Å; L34-L37 CarbonylContact O-C 3.57Å; L34-L37 WeakPolarHBondContact O-CB 3.22Å; L34-L37 PolarHBondContact O-N 3.38Å; S35-L37 VanDerWaalsContact C-N 3.33Å; L37-D39 VanDerWaalsContact C-N 3.25Å; L37-D39 PolarHBondContact O-N 2.83Å
38	A	46.1	Very low	61.2	Low	64 Å²	64	80 Å²	80	53%	0.529	41%	0.412	S	S	.	.	S	Bend	trans	-71	87.4	171.5	0	0	0	0	0	108.1	L34 S35 S40	L34-A38 WeakPolarHBondContact O-CB 3.47Å; L34-A38 PolarHBondContact O-N 3.04Å; S35-A38 PolarHBondContact O-N 2.91Å; A38-S40 PolarHBondContact O-N 3.23Å
39	D	49.3	Very low	63.2	Low	97 Å²	97	73 Å²	73	52%	0.519	39%	0.389	S	S	.	.			trans	16.5	102.1	161.6	-168.8	39.2	0	0	0	113.1	L37 R41 R183	L37-D39 VanDerWaalsContact C-N 3.25Å; L37-D39 PolarHBondContact O-N 2.83Å; D39-R41 WeakPolarHBondContact O-CA 3.5Å; D39-R41 PolarHBondContact O-N 2.66Å; D39-R183 IonicContact OD1-NH1 3.38Å; D39-R183 PolarHBondContact OD1-NH1 3.47Å
40	S	53	Low	65	Low	31 Å²	31	75.3 Å²	75.3	22%	0.217	40%	0.396	C	S	.	.			trans	-46	101.7	160.5	52.4	0	0	0	0	105.8	A38 N42 R183	A38-S40 PolarHBondContact O-N 3.23Å; S40-N42 PolarHBondContact O-N 2.98Å; S40-N42 VanDerWaalsContact O-N 3.16Å; S40-R183 PolarHBondContact O-NH1 2.92Å; S40-R183 VanDerWaalsContact O-NH1 3.17Å; S40-R183 WeakPolarHBondContact OG-CD 3.37Å
41	R	53	Low	66.9	Low	228 Å²	228	71.7 Å²	71.7	86%	0.86	38%	0.384	S	S	*	.			trans	-31.3	118.1	-169.5	-158.8	-178.6	-160.6	164	2.8	107.7	D39 G43	D39-R41 WeakPolarHBondContact O-CA 3.5Å; D39-R41 PolarHBondContact O-N 2.66Å; R41-G43 VanDerWaalsContact C-N 3.32Å; R41-G43 WeakPolarHBondContact O-CA 3.07Å; R41-G43 PolarHBondContact O-N 2.9Å
42	N	63.4	Low	68.8	Low	54 Å²	54	69 Å²	69	29%	0.289	36%	0.364	S	S	.	.			trans	-30.3	98.5	-177	-106.8	-1.8	0	0	0	109.7	S40 S44 R183	S40-N42 PolarHBondContact O-N 2.98Å; S40-N42 VanDerWaalsContact O-N 3.16Å; N42-S44 PolarHBondContact O-N 3.35Å; N42-S44 PolarHBondContact O-OG 3.01Å; N42-R183 PolarHBondContact OD1-NH1 3.06Å; N42-R183 PolarHBondContact OD1-NH2 2.73Å
43	G	71.8	Confident	70.8	Confident	10 Å²	10	72 Å²	72	10%	0.103	37%	0.371	C	S	.	.			trans	-65.6	103.7	-160.8	0	0	0	0	0	106.8	R41 F169	R41-G43 VanDerWaalsContact C-N 3.32Å; R41-G43 WeakPolarHBondContact O-CA 3.07Å; R41-G43 PolarHBondContact O-N 2.9Å; G43-F169 VanDerWaalsContact O-CE1 3.3Å; G43-F169 WeakPolarHBondContact O-CE1 3.41Å; G43-F169 WeakPolarHBondContact O-CZ 3.24Å
44	S	84.7	Confident	72.7	Confident	44 Å²	44	68.1 Å²	68.1	31%	0.308	36%	0.357	S	S	.	.			trans	-72.4	144.6	-174	-52.2	0	0	0	0	108.2	N42 Y165 I166 S167	N42-S44 PolarHBondContact O-N 3.35Å; N42-S44 PolarHBondContact O-OG 3.01Å; S44-Y165 WeakPolarHBondContact CB-OH 3.16Å; S44-Y165 PolarHBondContact OG-OH 3.44Å; S44-I166 VanDerWaalsContact CA-O 3.22Å; S44-I166 WeakPolarHBondContact CA-O 3.38Å; S44-I166 WeakPolarHBondContact CB-O 3.41Å; S44-S167 WeakPolarHBondContact OG-CA 3.29Å
45	F	89.5	Confident	75	Confident	7 Å²	7	67.6 Å²	67.6	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	157.2	-176.3	62.3	-88.4	0	0	0	110.8	I52 L143 F147 L148 P153 I166 F169	F45-I52 HydrophobicContact CB-CD1 3.63Å; F45-I52 HydrophobicContact CD2-CD1 4.05Å; F45-I52 HydrophobicContact CG-CD1 3.95Å; F45-L143 HydrophobicContact CB-CD1 3.86Å; F45-L143 HydrophobicContact CD1-CD1 4.41Å; F45-F147 AromaticContact CD1-CE1 3.98Å; F45-F147 HydrophobicContact CD1-CE1 3.98Å; F45-F147 HydrophobicContact CE1-CE1 4.07Å; F45-L148 HydrophobicContact CD2-CD2 4.16Å; F45-L148 HydrophobicContact CE1-CD2 4.37Å; F45-L148 HydrophobicContact CE2-CD2 3.72Å; F45-L148 HydrophobicContact CZ-CD2 3.85Å; F45-P153 HydrophobicContact CZ-CB 4.15Å; F45-P153 HydrophobicContact CZ-CG 3.87Å; F45-I166 HydrophobicContact CE2-CB 4.49Å; F45-I166 HydrophobicContact CE2-CD1 4.13Å; F45-I166 HydrophobicContact CZ-CB 4.36Å; F45-I166 HydrophobicContact CZ-CD1 4.35Å; F45-I166 HydrophobicContact CZ-CG2 4.35Å; F45-I166 PolarHBondContact N-O 2.94Å; F45-I166 VanDerWaalsContact N-O 3.1Å; F45-I166 PolarHBondContact O-N 3.37Å; F45-F169 HydrophobicContact CD1-CD1 4.33Å; F45-F169 AromaticContact CD1-CE1 3.86Å; F45-F169 HydrophobicContact CD1-CE1 3.86Å; F45-F169 HydrophobicContact CD1-CZ 4.14Å; F45-F169 AromaticContact CE1-CD1 3.64Å; F45-F169 HydrophobicContact CE1-CD1 3.64Å; F45-F169 HydrophobicContact CE1-CD2 4.22Å; F45-F169 AromaticContact CE1-CE1 3.53Å; F45-F169 HydrophobicContact CE1-CE1 3.53Å; F45-F169 HydrophobicContact CE1-CE2 4.14Å; F45-F169 AromaticContact CE1-CG 3.98Å; F45-F169 HydrophobicContact CE1-CG 3.98Å; F45-F169 AromaticContact CE1-CZ 3.79Å; F45-F169 HydrophobicContact CE1-CZ 3.79Å; F45-F169 HydrophobicContact CZ-CD1 4.49Å
46	Y	90.3	Very high	77.1	Confident	121 Å²	121	67.3 Å²	67.3	48%	0.475	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134.9	168.3	-69.9	-83.9	0	0	0	109.3	D48 D49 L164 Y165	Y46-D48 PolarHBondContact O-N 3.41Å; Y46-D49 VanDerWaalsContact O-CB 3.29Å; Y46-D49 WeakPolarHBondContact O-CB 3.35Å; Y46-D49 PolarHBondContact O-N 2.84Å; Y46-D49 VanDerWaalsContact O-N 3.07Å; Y46-L164 WeakPolarHBondContact CA-O 3.46Å; Y46-Y165 HydrophobicContact CD1-CD2 4.18Å; Y46-Y165 HydrophobicContact CD2-CD2 4.14Å; Y46-Y165 AromaticContact CE1-CD2 3.82Å; Y46-Y165 HydrophobicContact CE1-CD2 3.82Å; Y46-Y165 HydrophobicContact CE1-CG 4.29Å; Y46-Y165 AromaticContact CE2-CD2 3.78Å; Y46-Y165 HydrophobicContact CE2-CD2 3.78Å; Y46-Y165 HydrophobicContact CE2-CE2 4.22Å; Y46-Y165 HydrophobicContact CG-CD2 4.33Å; Y46-Y165 AromaticContact CZ-CD2 3.61Å
47	C	87.2	Confident	79.2	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.014	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-26.8	-174.7	68.9	0	0	0	0	113.4	D49 R53 A156 C160 D162 L164 I166	C47-D49 VanDerWaalsContact C-N 3.33Å; C47-R53 PolarHBondContact O-NE 3.29Å; C47-R53 PolarHBondContact O-NH2 3.44Å; C47-A156 HydrophobicContact CB-CB 3.56Å; C47-C160 HydrophobicContact CB-CB 3.7Å; C47-C160 WeakPolarHBondContact CB-SG 3.35Å; C47-C160 WeakPolarHBondContact SG-CB 3.34Å; C47-C160 CovalentContact SG-SG 2.04Å; C47-C160 PolarHBondContact SG-SG 3.49Å; C47-D162 PolarHBondContact SG-O 3.16Å; C47-L164 PolarHBondContact N-O 2.79Å; C47-I166 HydrophobicContact CB-CD1 3.89Å
48	D	88.2	Confident	81.3	Confident	57 Å²	57	70 Å²	70	31%	0.305	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	3.3	178.2	66.7	-60.5	0	0	0	113.5	Y46 V50 C160 H163	Y46-D48 PolarHBondContact O-N 3.41Å; D48-V50 PolarHBondContact O-N 2.86Å; D48-C160 PolarHBondContact N-SG 3.42Å; D48-H163 IonicContact OD1-ND1 3.88Å; D48-H163 PolarHBondContact OD1-ND1 3.19Å; D48-H163 IonicContact OD2-CE1 3.81Å; D48-H163 PolarHBondContact OD2-CE1 2.73Å; D48-H163 IonicContact OD2-CG 3.77Å; D48-H163 IonicContact OD2-ND1 3.39Å; D48-H163 PolarHBondContact OD2-ND1 3.21Å
49	D	90.6	Very high	83.5	Confident	49 Å²	49	68.6 Å²	68.6	26%	0.262	34%	0.336	S	S	.	.			trans	-66.9	98.6	179.7	-172.1	-9.3	0	0	0	111.2	Y46 C47 S51 I52 R53	Y46-D49 VanDerWaalsContact O-CB 3.29Å; Y46-D49 WeakPolarHBondContact O-CB 3.35Å; Y46-D49 PolarHBondContact O-N 2.84Å; Y46-D49 VanDerWaalsContact O-N 3.07Å; C47-D49 VanDerWaalsContact C-N 3.33Å; D49-S51 PolarHBondContact O-N 2.91Å; D49-S51 WeakPolarHBondContact OD1-CA 3.43Å; D49-S51 WeakPolarHBondContact OD1-CB 3.28Å; D49-S51 PolarHBondContact OD1-N 2.88Å; D49-S51 PolarHBondContact OD1-OG 2.86Å; D49-S51 PolarHBondContact OD2-OG 3.44Å; D49-I52 HydrophobicContact CB-CD1 4.15Å; D49-I52 HydrophobicContact CB-CG1 3.95Å; D49-I52 VanDerWaalsContact O-CG1 3.3Å; D49-I52 WeakPolarHBondContact O-CG1 3.5Å; D49-R53 WeakPolarHBondContact O-CG 3.44Å
50	V	90.9	Very high	85.7	Confident	111 Å²	111	68.3 Å²	68.3	67%	0.673	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-67	-19.9	177.4	-63.2	0	0	0	0	112.7	D48 I52 R53	D48-V50 PolarHBondContact O-N 2.86Å; V50-I52 PolarHBondContact O-N 2.88Å; V50-R53 PolarHBondContact O-N 3.33Å
51	S	93	Very high	87.7	Confident	36 Å²	36	67.7 Å²	67.7	25%	0.252	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-71.6	-19.1	-175.1	81.3	0	0	0	0	113	D49 P145 H244	D49-S51 PolarHBondContact O-N 2.91Å; D49-S51 WeakPolarHBondContact OD1-CA 3.43Å; D49-S51 WeakPolarHBondContact OD1-CB 3.28Å; D49-S51 PolarHBondContact OD1-N 2.88Å; D49-S51 PolarHBondContact OD1-OG 2.86Å; D49-S51 PolarHBondContact OD2-OG 3.44Å; S51-P145 VanDerWaalsContact O-CA 3.22Å; S51-P145 WeakPolarHBondContact O-CA 3.36Å; S51-H244 PolarHBondContact O-CE1 2.79Å
52	I	92.8	Very high	89.6	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.015	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-110.9	12	-179.6	60.6	167.3	0	0	0	113.9	F45 D49 V50 L143 P145 F147 L148	F45-I52 HydrophobicContact CB-CD1 3.63Å; F45-I52 HydrophobicContact CD2-CD1 4.05Å; F45-I52 HydrophobicContact CG-CD1 3.95Å; D49-I52 HydrophobicContact CB-CD1 4.15Å; D49-I52 HydrophobicContact CB-CG1 3.95Å; D49-I52 VanDerWaalsContact O-CG1 3.3Å; D49-I52 WeakPolarHBondContact O-CG1 3.5Å; V50-I52 PolarHBondContact O-N 2.88Å; I52-L143 HydrophobicContact CD1-CD1 4.23Å; I52-L143 HydrophobicContact CG2-CB 4.12Å; I52-P145 CarbonylContact C-O 3.51Å; I52-P145 WeakPolarHBondContact CA-O 3.44Å; I52-P145 VanDerWaalsContact O-O 3.13Å; I52-F147 HydrophobicContact CB-CB 4.42Å; I52-F147 HydrophobicContact CD1-CD1 4.45Å; I52-L148 HydrophobicContact CD1-CD1 3.93Å; I52-L148 HydrophobicContact CD1-CD2 4.36Å; I52-L148 HydrophobicContact CD1-CG 3.97Å; I52-L148 HydrophobicContact CG1-CD1 3.78Å; I52-L148 HydrophobicContact CG1-CG 4.07Å; I52-L148 WeakPolarHBondContact O-CB 3.22Å; I52-L148 WeakPolarHBondContact O-CG 3.49Å; I52-L148 PolarHBondContact O-N 3.18Å; I52-L148 VanDerWaalsContact O-N 3.15Å
53	R	93	Very high	91	Very high	101 Å²	101	58.1 Å²	58.1	38%	0.381	31%	0.311	S	S	.	.			trans	-101	9.2	-178.5	-73.9	-179.1	170	-123.9	-4.8	114.5	C47 D49 V50 P145 L148	C47-R53 PolarHBondContact O-NE 3.29Å; C47-R53 PolarHBondContact O-NH2 3.44Å; D49-R53 WeakPolarHBondContact O-CG 3.44Å; V50-R53 PolarHBondContact O-N 3.33Å; R53-P145 PolarHBondContact N-O 3.4Å; R53-L148 HydrophobicContact CB-CD1 4.49Å; R53-L148 HydrophobicContact CG-CD1 3.38Å
54	Y	94.5	Very high	92	Very high	105 Å²	105	60.6 Å²	60.6	41%	0.412	33%	0.331	S	S	.	.			trans	-70	149.2	179.4	-72	-91.9	0	0	0	111.6	P145 S146 F241	Y54-P145 WeakPolarHBondContact CB-O 3.47Å; Y54-P145 HydrophobicContact CD2-CB 3.85Å; Y54-P145 HydrophobicContact CG-CB 4.36Å; Y54-P145 PolarHBondContact N-O 3.38Å; Y54-S146 VanDerWaalsContact O-CA 3.31Å; Y54-S146 WeakPolarHBondContact O-CA 3.3Å; Y54-F241 AromaticContact CD1-CD1 3.37Å; Y54-F241 HydrophobicContact CD1-CD1 3.37Å; Y54-F241 HydrophobicContact CD1-CD2 4.2Å; Y54-F241 AromaticContact CD1-CE1 3.34Å; Y54-F241 HydrophobicContact CD1-CE1 3.34Å; Y54-F241 HydrophobicContact CD1-CE2 4.16Å; Y54-F241 AromaticContact CD1-CG 3.83Å; Y54-F241 HydrophobicContact CD1-CG 3.83Å; Y54-F241 AromaticContact CD1-CZ 3.75Å; Y54-F241 HydrophobicContact CD1-CZ 3.75Å; Y54-F241 AromaticContact CE1-CD1 3.89Å; Y54-F241 HydrophobicContact CE1-CD1 3.89Å; Y54-F241 AromaticContact CE1-CE1 3.54Å; Y54-F241 HydrophobicContact CE1-CE1 3.54Å; Y54-F241 HydrophobicContact CE1-CZ 4.14Å; Y54-F241 HydrophobicContact CG-CB 4.35Å; Y54-F241 AromaticContact CG-CD1 3.8Å; Y54-F241 HydrophobicContact CG-CD1 3.8Å; Y54-F241 HydrophobicContact CG-CE1 4.23Å; Y54-F241 HydrophobicContact CG-CG 4Å
55	P	95.1	Very high	92.4	Very high	78 Å²	78	63.2 Å²	63.2	51%	0.506	34%	0.338	S	S	.	.			trans	-67.1	143.4	176	28.6	-34.8	0	0	0	110.8	K57 F241	P55-K57 PolarHBondContact O-N 3.1Å; P55-F241 HydrophobicContact CG-CD2 4.45Å; P55-F241 HydrophobicContact CG-CE2 4.42Å
56	Y	94.2	Very high	92.7	Very high	61 Å²	61	63.5 Å²	63.5	24%	0.239	34%	0.34	C	S	.	.			trans	-67.8	115.8	172.6	-179.3	-89.3	0	0	0	110.1	E58 D149 V150 K242	Y56-E58 WeakPolarHBondContact CE1-OE1 3.42Å; Y56-E58 PolarHBondContact OH-OE2 3.34Å; Y56-D149 VanDerWaalsContact CB-OD2 3.23Å; Y56-D149 WeakPolarHBondContact CB-OD2 3.48Å; Y56-D149 PolarHBondContact N-OD2 2.93Å; Y56-V150 HydrophobicContact CD2-CG2 3.39Å; Y56-V150 HydrophobicContact CE2-CG2 4.14Å; Y56-V150 HydrophobicContact CG-CG2 3.99Å; Y56-K242 PolarHBondContact OH-NZ 3.41Å
57	K	93.2	Very high	92.9	Very high	94 Å²	94	61.6 Å²	61.6	41%	0.409	34%	0.341	S	S	.	.			trans	-108.7	147	174.5	-174.1	174.4	163.2	-162.6	0	110.1	P55 S239 D240 K242	P55-K57 PolarHBondContact O-N 3.1Å; K57-S239 PolarHBondContact NZ-O 2.75Å; K57-D240 IonicContact NZ-OD1 2.69Å; K57-D240 PolarHBondContact NZ-OD1 3.06Å; K57-K242 WeakPolarHBondContact O-CE 3.27Å; K57-K242 PolarHBondContact O-NZ 2.81Å
58	E	93.7	Very high	93.2	Very high	116 Å²	116	67.1 Å²	67.1	54%	0.542	37%	0.37	S	S	.	.			trans	-69.9	153.7	172.9	-68.3	-61.5	169.8	0	0	111.7	Y56 T60 R178	Y56-E58 WeakPolarHBondContact CE1-OE1 3.42Å; Y56-E58 PolarHBondContact OH-OE2 3.34Å; E58-T60 PolarHBondContact O-N 3.44Å; E58-R178 IonicContact OE1-NH2 3.44Å
59	S	92.7	Very high	93.4	Very high	36 Å²	36	66.3 Å²	66.3	25%	0.252	37%	0.365	S	S	.	.			trans	-76.9	123.8	-176.6	-59	0	0	0	0	111.1	V61 R237 K242	S59-V61 VanDerWaalsContact C-N 3.33Å; S59-V61 WeakPolarHBondContact CB-O 3.33Å; S59-R237 PolarHBondContact OG-NH1 3.28Å; S59-K242 WeakPolarHBondContact OG-CE 3.24Å
60	T	94.6	Very high	93.6	Very high	90 Å²	90	64 Å²	64	55%	0.552	35%	0.353	S	S	*	.	S	Bend	trans	-58.2	-47.2	169.5	-58.3	0	0	0	0	110.2	E58 D240	E58-T60 PolarHBondContact O-N 3.44Å; T60-D240 VanDerWaalsContact CB-OD2 3.29Å; T60-D240 WeakPolarHBondContact CB-OD2 3.3Å; T60-D240 PolarHBondContact N-OD2 2.9Å; T60-D240 PolarHBondContact OG1-OD1 3.48Å; T60-D240 PolarHBondContact OG1-OD2 3.06Å
61	V	94.1	Very high	93.8	Very high	19 Å²	19	61.4 Å²	61.4	12%	0.115	33%	0.332	C	S	.	.	S	Bend	trans	-106.1	101	169.8	-176.5	0	0	0	0	108.1	S59 H65 H190 V233	S59-V61 VanDerWaalsContact C-N 3.33Å; S59-V61 WeakPolarHBondContact CB-O 3.33Å; V61-H65 HydrophobicContact CG1-CB 3.83Å; V61-H190 PolarHBondContact O-NE2 3.02Å; V61-V233 HydrophobicContact CG1-CG1 4.28Å; V61-V233 HydrophobicContact CG1-CG2 4.31Å; V61-V233 HydrophobicContact CG2-CG2 4.45Å
62	S	94.7	Very high	94	Very high	39 Å²	39	62 Å²	62	27%	0.273	34%	0.335	S	S	.	.			trans	-76.2	167.4	174.4	82.3	0	0	0	0	111.6	A64 H65 L66	S62-A64 PolarHBondContact O-N 3.26Å; S62-A64 PolarHBondContact OG-N 2.93Å; S62-H65 PolarHBondContact N-ND1 3.35Å; S62-H65 WeakPolarHBondContact O-CB 3.32Å; S62-H65 PolarHBondContact O-N 3.49Å; S62-H65 PolarHBondContact OG-ND1 3.5Å; S62-L66 PolarHBondContact O-N 2.75Å
63	G	91.3	Very high	94.2	Very high	41 Å²	41	64 Å²	64	42%	0.423	35%	0.346	S	S	.	.	H	α-helix	trans	-56.5	-32.4	176.1	0	0	0	0	0	113.5	L66 V67	G63-L66 PolarHBondContact O-N 2.86Å; G63-V67 WeakPolarHBondContact O-CG2 3.36Å; G63-V67 PolarHBondContact O-N 2.86Å
64	A	93.4	Very high	94.3	Very high	63 Å²	63	59.2 Å²	59.2	52%	0.521	33%	0.328	S	S	.	.	H	α-helix	trans	-67.2	-44.5	174.6	0	0	0	0	0	111.9	S62 L66 V67 L68	S62-A64 PolarHBondContact O-N 3.26Å; S62-A64 PolarHBondContact OG-N 2.93Å; A64-L66 VanDerWaalsContact C-N 3.29Å; A64-L66 PolarHBondContact O-N 3.41Å; A64-V67 PolarHBondContact O-N 3.48Å; A64-L68 WeakPolarHBondContact O-CG 3.49Å; A64-L68 PolarHBondContact O-N 3.49Å
65	H	94.3	Very high	94.4	Very high	98 Å²	98	56.4 Å²	56.4	45%	0.454	32%	0.319	S	S	.	.	H	α-helix	trans	-60.6	-41.6	174.8	-63.3	93.2	0	0	0	111	V61 S62 V67 L68 I69	V61-H65 HydrophobicContact CG1-CB 3.83Å; S62-H65 PolarHBondContact N-ND1 3.35Å; S62-H65 WeakPolarHBondContact O-CB 3.32Å; S62-H65 PolarHBondContact O-N 3.49Å; S62-H65 PolarHBondContact OG-ND1 3.5Å; H65-V67 PolarHBondContact O-N 3.45Å; H65-L68 PolarHBondContact O-N 2.97Å; H65-I69 WeakPolarHBondContact O-CB 3.34Å; H65-I69 VanDerWaalsContact O-CG1 3.25Å; H65-I69 WeakPolarHBondContact O-CG1 3.22Å; H65-I69 PolarHBondContact O-N 3.49Å
66	L	94.5	Very high	94.6	Very high	14 Å²	14	58.1 Å²	58.1	7%	0.073	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-46.6	176.2	179	66.5	0	0	0	111.7	S62 G63 A64 L68 I69 A70 H190 W193 V233	S62-L66 PolarHBondContact O-N 2.75Å; G63-L66 PolarHBondContact O-N 2.86Å; A64-L66 VanDerWaalsContact C-N 3.29Å; A64-L66 PolarHBondContact O-N 3.41Å; L66-L68 VanDerWaalsContact C-N 3.34Å; L66-L68 PolarHBondContact O-N 2.91Å; L66-I69 PolarHBondContact O-N 3.42Å; L66-A70 HydrophobicContact CD1-CB 4.5Å; L66-A70 WeakPolarHBondContact O-CB 3.4Å; L66-A70 PolarHBondContact O-N 2.88Å; L66-H190 HydrophobicContact CD2-CB 4.25Å; L66-W193 HydrophobicContact CD1-CB 4.17Å; L66-W193 HydrophobicContact CD2-CB 4Å; L66-W193 HydrophobicContact CD2-CG 4.38Å; L66-W193 HydrophobicContact CG-CB 4.4Å; L66-V233 HydrophobicContact CD1-CG1 4.12Å
67	V	94.2	Very high	94.7	Very high	80 Å²	80	56.8 Å²	56.8	49%	0.485	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-42.1	177.6	170.9	0	0	0	0	111.2	G63 A64 H65 I69 A70 F71 P72	G63-V67 WeakPolarHBondContact O-CG2 3.36Å; G63-V67 PolarHBondContact O-N 2.86Å; A64-V67 PolarHBondContact O-N 3.48Å; H65-V67 PolarHBondContact O-N 3.45Å; V67-I69 PolarHBondContact O-N 3.32Å; V67-A70 PolarHBondContact O-N 2.87Å; V67-F71 HydrophobicContact CG1-CD2 3.97Å; V67-F71 HydrophobicContact CG1-CE2 4.46Å; V67-F71 PolarHBondContact O-N 3.27Å; V67-F71 VanDerWaalsContact O-N 3.12Å; V67-P72 WeakPolarHBondContact O-CD 3.12Å
68	L	93.3	Very high	94.8	Very high	118 Å²	118	52.3 Å²	52.3	62%	0.618	30%	0.3	S	S	*	.	H	α-helix	trans	-66.8	-22.9	177.6	-70.1	175.8	0	0	0	113.8	A64 H65 L66 P72	A64-L68 WeakPolarHBondContact O-CG 3.49Å; A64-L68 PolarHBondContact O-N 3.49Å; H65-L68 PolarHBondContact O-N 2.97Å; L66-L68 VanDerWaalsContact C-N 3.34Å; L66-L68 PolarHBondContact O-N 2.91Å; L68-P72 WeakPolarHBondContact O-CD 3.37Å; L68-P72 VanDerWaalsContact O-CG 3.23Å; L68-P72 WeakPolarHBondContact O-CG 3.33Å
69	I	93.5	Very high	94.9	Very high	40 Å²	40	49.3 Å²	49.3	21%	0.205	29%	0.29	C	S	.	.	H	α-helix	trans	-89.2	-49.4	174.5	-68.8	167.4	0	0	0	110	H65 L66 V67 I73 M198 I229 V233	H65-I69 WeakPolarHBondContact O-CB 3.34Å; H65-I69 VanDerWaalsContact O-CG1 3.25Å; H65-I69 WeakPolarHBondContact O-CG1 3.22Å; H65-I69 PolarHBondContact O-N 3.49Å; L66-I69 PolarHBondContact O-N 3.42Å; V67-I69 PolarHBondContact O-N 3.32Å; I69-I73 HydrophobicContact CG2-CD1 4.01Å; I69-I73 WeakPolarHBondContact O-CB 3.35Å; I69-M198 HydrophobicContact CG2-CE 4.5Å; I69-I229 HydrophobicContact CG2-CG2 3.46Å; I69-I229 VanDerWaalsContact CG2-CG2 3.46Å; I69-V233 HydrophobicContact CD1-CG2 4.28Å
70	A	94.3	Very high	95	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-75.7	-27.2	-167.4	0	0	0	0	0	114.1	L66 V67 P74 F122 W193 A197	L66-A70 HydrophobicContact CD1-CB 4.5Å; L66-A70 WeakPolarHBondContact O-CB 3.4Å; L66-A70 PolarHBondContact O-N 2.88Å; V67-A70 PolarHBondContact O-N 2.87Å; A70-P74 VanDerWaalsContact O-CD 3.26Å; A70-P74 WeakPolarHBondContact O-CD 3.21Å; A70-P74 VanDerWaalsContact O-CG 3.24Å; A70-P74 WeakPolarHBondContact O-CG 3.48Å; A70-F122 WeakPolarHBondContact O-CZ 3.16Å; A70-W193 HydrophobicContact CB-CE3 4.38Å; A70-A197 HydrophobicContact CB-CB 4.01Å
71	F	95.6	Very high	94.9	Very high	56 Å²	56	46.5 Å²	46.5	25%	0.246	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-55.7	177.8	-72	-89.8	0	0	0	113.5	V67 I73 P74 L75 F122 L123 W193	V67-F71 HydrophobicContact CG1-CD2 3.97Å; V67-F71 HydrophobicContact CG1-CE2 4.46Å; V67-F71 PolarHBondContact O-N 3.27Å; V67-F71 VanDerWaalsContact O-N 3.12Å; F71-I73 PolarHBondContact O-N 3.23Å; F71-P74 WeakPolarHBondContact O-CD 3.28Å; F71-L75 HydrophobicContact CB-CD1 4.37Å; F71-L75 WeakPolarHBondContact O-CB 3.38Å; F71-L75 WeakPolarHBondContact O-CD1 3.34Å; F71-L75 WeakPolarHBondContact O-CG 3.24Å; F71-L75 PolarHBondContact O-N 3.02Å; F71-F122 AromaticContact CD1-CE1 3.93Å; F71-F122 HydrophobicContact CD1-CE1 3.93Å; F71-F122 HydrophobicContact CE1-CE1 4.2Å; F71-L123 HydrophobicContact CD1-CD2 4.32Å; F71-L123 HydrophobicContact CE1-CD2 3.73Å; F71-W193 HydrophobicContact CE2-CH2 4.01Å; F71-W193 AromaticContact CE2-CZ3 3.8Å; F71-W193 HydrophobicContact CE2-CZ3 3.8Å; F71-W193 AromaticContact CZ-CH2 3.65Å; F71-W193 HydrophobicContact CZ-CH2 3.65Å; F71-W193 AromaticContact CZ-CZ3 3.67Å; F71-W193 HydrophobicContact CZ-CZ3 3.67Å
72	P	97	Very high	94.9	Very high	48 Å²	48	45.6 Å²	45.6	31%	0.312	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-42.6	-175.5	-26.3	36.5	0	0	0	113.7	V67 L68 L75 I76	V67-P72 WeakPolarHBondContact O-CD 3.12Å; L68-P72 WeakPolarHBondContact O-CD 3.37Å; L68-P72 VanDerWaalsContact O-CG 3.23Å; L68-P72 WeakPolarHBondContact O-CG 3.33Å; P72-L75 PolarHBondContact O-N 2.95Å; P72-I76 HydrophobicContact CB-CD1 4.31Å; P72-I76 VanDerWaalsContact O-CB 3.28Å; P72-I76 WeakPolarHBondContact O-CB 3.44Å; P72-I76 WeakPolarHBondContact O-CD1 3.3Å; P72-I76 WeakPolarHBondContact O-CG1 3.36Å; P72-I76 PolarHBondContact O-N 3.41Å
73	I	96.4	Very high	94.8	Very high	46 Å²	46	49.8 Å²	49.8	24%	0.236	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-54.5	-175.9	-66	173.3	0	0	0	111.2	I69 F71 L75 I77 M198 L226 I229	I69-I73 HydrophobicContact CG2-CD1 4.01Å; I69-I73 WeakPolarHBondContact O-CB 3.35Å; F71-I73 PolarHBondContact O-N 3.23Å; I73-L75 PolarHBondContact O-N 3.16Å; I73-I77 HydrophobicContact CG2-CD1 3.79Å; I73-I77 WeakPolarHBondContact O-CB 3.23Å; I73-I77 VanDerWaalsContact O-CG1 3.3Å; I73-I77 WeakPolarHBondContact O-CG1 3.43Å; I73-I77 PolarHBondContact O-N 3.32Å; I73-I77 VanDerWaalsContact O-N 3.09Å; I73-M198 HydrophobicContact CB-CE 4.28Å; I73-M198 HydrophobicContact CG2-CE 4.14Å; I73-M198 HydrophobicContact CG2-SD 4.36Å; I73-L226 HydrophobicContact CG2-CD2 3.55Å; I73-I229 HydrophobicContact CD1-CD1 4.12Å
74	P	96.6	Very high	94.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-45	175.9	-28.5	38.6	0	0	0	113.2	A70 F71 I76 I77 I78 F122 A197 M198 T201	A70-P74 VanDerWaalsContact O-CD 3.26Å; A70-P74 WeakPolarHBondContact O-CD 3.21Å; A70-P74 VanDerWaalsContact O-CG 3.24Å; A70-P74 WeakPolarHBondContact O-CG 3.48Å; F71-P74 WeakPolarHBondContact O-CD 3.28Å; P74-I76 PolarHBondContact O-N 3.49Å; P74-I77 PolarHBondContact O-N 3.3Å; P74-I78 WeakPolarHBondContact O-CB 3.25Å; P74-I78 WeakPolarHBondContact O-CD1 3.34Å; P74-I78 WeakPolarHBondContact O-CG1 3.5Å; P74-I78 PolarHBondContact O-N 3.49Å; P74-F122 HydrophobicContact CB-CD2 4.34Å; P74-F122 HydrophobicContact CB-CE2 3.83Å; P74-F122 HydrophobicContact CB-CZ 4Å; P74-F122 HydrophobicContact CG-CE2 3.93Å; P74-F122 HydrophobicContact CG-CZ 3.95Å; P74-A197 HydrophobicContact CG-CB 4.2Å; P74-M198 HydrophobicContact CG-CE 3.97Å; P74-T201 VanDerWaalsContact CB-OG1 3.26Å; P74-T201 WeakPolarHBondContact CB-OG1 3.22Å; P74-T201 WeakPolarHBondContact CG-OG1 3.23Å
75	L	96.7	Very high	94.5	Very high	46 Å²	46	49.3 Å²	49.3	24%	0.241	26%	0.255	C	S	.	.	H	α-helix	trans	-65.8	-41.1	-175.6	-64.3	175.5	0	0	0	112.3	F71 P72 I73 T79 F119 F122	F71-L75 HydrophobicContact CB-CD1 4.37Å; F71-L75 WeakPolarHBondContact O-CB 3.38Å; F71-L75 WeakPolarHBondContact O-CD1 3.34Å; F71-L75 WeakPolarHBondContact O-CG 3.24Å; F71-L75 PolarHBondContact O-N 3.02Å; P72-L75 PolarHBondContact O-N 2.95Å; I73-L75 PolarHBondContact O-N 3.16Å; L75-T79 WeakPolarHBondContact O-CB 3.11Å; L75-T79 PolarHBondContact O-N 2.84Å; L75-T79 PolarHBondContact O-OG1 3.49Å; L75-F119 HydrophobicContact CB-CE1 4.18Å; L75-F119 HydrophobicContact CB-CZ 4.11Å; L75-F119 HydrophobicContact CD2-CB 4.47Å; L75-F119 HydrophobicContact CD2-CD1 3.37Å; L75-F119 HydrophobicContact CD2-CD2 4.05Å; L75-F119 HydrophobicContact CD2-CE1 3.39Å; L75-F119 HydrophobicContact CD2-CE2 4.06Å; L75-F119 HydrophobicContact CD2-CG 3.72Å; L75-F119 HydrophobicContact CD2-CZ 3.74Å; L75-F119 HydrophobicContact CG-CE1 4.38Å; L75-F119 HydrophobicContact CG-CZ 4.48Å; L75-F122 HydrophobicContact CD2-CD1 4.43Å
76	I	97.4	Very high	94.1	Very high	115 Å²	115	44.8 Å²	44.8	59%	0.59	23%	0.234	S	C	*	.	H	α-helix	trans	-65.1	-44.8	175.9	-69.9	167.4	0	0	0	110.1	P72 P74 T79 A80	P72-I76 HydrophobicContact CB-CD1 4.31Å; P72-I76 VanDerWaalsContact O-CB 3.28Å; P72-I76 WeakPolarHBondContact O-CB 3.44Å; P72-I76 WeakPolarHBondContact O-CD1 3.3Å; P72-I76 WeakPolarHBondContact O-CG1 3.36Å; P72-I76 PolarHBondContact O-N 3.41Å; P74-I76 PolarHBondContact O-N 3.49Å; I76-T79 PolarHBondContact O-N 3.24Å; I76-A80 WeakPolarHBondContact O-CB 3.32Å; I76-A80 PolarHBondContact O-N 2.88Å
77	I	96.3	Very high	93.6	Very high	32 Å²	32	46.1 Å²	46.1	16%	0.164	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-47.9	179.7	-71.9	171.6	0	0	0	111	I73 P74 T79 A80 V81 T201 L205 L226	I73-I77 HydrophobicContact CG2-CD1 3.79Å; I73-I77 WeakPolarHBondContact O-CB 3.23Å; I73-I77 VanDerWaalsContact O-CG1 3.3Å; I73-I77 WeakPolarHBondContact O-CG1 3.43Å; I73-I77 PolarHBondContact O-N 3.32Å; I73-I77 VanDerWaalsContact O-N 3.09Å; P74-I77 PolarHBondContact O-N 3.3Å; I77-T79 VanDerWaalsContact C-N 3.31Å; I77-T79 PolarHBondContact O-N 3.44Å; I77-A80 PolarHBondContact O-N 2.94Å; I77-V81 HydrophobicContact CG2-CG2 4.29Å; I77-V81 WeakPolarHBondContact O-CB 3.26Å; I77-V81 VanDerWaalsContact O-CG2 3.22Å; I77-V81 WeakPolarHBondContact O-CG2 3.49Å; I77-V81 PolarHBondContact O-N 3.21Å; I77-T201 HydrophobicContact CB-CG2 4.07Å; I77-T201 HydrophobicContact CD1-CG2 3.8Å; I77-T201 HydrophobicContact CG2-CG2 3.77Å; I77-L205 HydrophobicContact CG2-CD1 4.08Å; I77-L205 HydrophobicContact CG2-CD2 3.76Å; I77-L205 HydrophobicContact CG2-CG 3.93Å; I77-L226 HydrophobicContact CD1-CD1 4.14Å; I77-L226 HydrophobicContact CD1-CD2 3.86Å
78	I	95.6	Very high	93	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59	-45.3	177.1	-68.9	163.8	0	0	0	110.3	P74 V81 E82 L115 F118 F119 F200 Y204	P74-I78 WeakPolarHBondContact O-CB 3.25Å; P74-I78 WeakPolarHBondContact O-CD1 3.34Å; P74-I78 WeakPolarHBondContact O-CG1 3.5Å; P74-I78 PolarHBondContact O-N 3.49Å; I78-V81 PolarHBondContact O-N 2.91Å; I78-E82 PolarHBondContact O-N 3.27Å; I78-L115 HydrophobicContact CG2-CD2 4.14Å; I78-F118 HydrophobicContact CG2-CB 3.78Å; I78-F118 HydrophobicContact CG2-CG 4.39Å; I78-F119 HydrophobicContact CB-CE1 4.02Å; I78-F119 HydrophobicContact CD1-CD1 4.45Å; I78-F119 HydrophobicContact CD1-CE1 4.5Å; I78-F119 HydrophobicContact CG2-CD1 4.1Å; I78-F119 HydrophobicContact CG2-CE1 3.73Å; I78-F200 HydrophobicContact CD1-CE1 4.12Å; I78-Y204 HydrophobicContact CB-CE1 4.23Å; I78-Y204 HydrophobicContact CG1-CD1 3.93Å; I78-Y204 HydrophobicContact CG1-CD2 4.3Å; I78-Y204 HydrophobicContact CG1-CE1 3.75Å; I78-Y204 HydrophobicContact CG1-CE2 4.1Å; I78-Y204 HydrophobicContact CG1-CG 4.24Å; I78-Y204 HydrophobicContact CG2-CE2 4.27Å; I78-Y204 PolarHBondContact O-OH 2.84Å
79	T	96.1	Very high	92.5	Very high	53 Å²	53	46 Å²	46	33%	0.325	23%	0.227	S	C	.	.	H	α-helix	trans	-61.4	-48	178.6	-55.7	0	0	0	0	111.7	L75 I76 I77 V81 W83 L115 F119	L75-T79 WeakPolarHBondContact O-CB 3.11Å; L75-T79 PolarHBondContact O-N 2.84Å; L75-T79 PolarHBondContact O-OG1 3.49Å; I76-T79 PolarHBondContact O-N 3.24Å; I77-T79 VanDerWaalsContact C-N 3.31Å; I77-T79 PolarHBondContact O-N 3.44Å; T79-V81 PolarHBondContact O-N 2.74Å; T79-W83 WeakPolarHBondContact O-CB 3.44Å; T79-W83 PolarHBondContact O-N 3.42Å; T79-L115 HydrophobicContact CG2-CD1 4.41Å; T79-F119 WeakPolarHBondContact OG1-CZ 3.34Å
80	A	94.8	Very high	91.7	Very high	53 Å²	53	46 Å²	46	44%	0.438	23%	0.226	S	C	.	.	H	α-helix	trans	-63.2	-42.6	-179.9	0	0	0	0	0	111.9	I76 I77 F84	I76-A80 WeakPolarHBondContact O-CB 3.32Å; I76-A80 PolarHBondContact O-N 2.88Å; I77-A80 PolarHBondContact O-N 2.94Å; A80-F84 VanDerWaalsContact O-CB 3.24Å; A80-F84 WeakPolarHBondContact O-CB 3.2Å; A80-F84 PolarHBondContact O-N 2.89Å
81	V	93.4	Very high	90.7	Very high	14 Å²	14	51.8 Å²	51.8	9%	0.085	25%	0.251	C	S	.	.	H	α-helix	trans	-66.9	-48.5	179.4	171.1	0	0	0	0	111.2	I77 I78 T79 F84 R85 Y204 L205 R208	I77-V81 HydrophobicContact CG2-CG2 4.29Å; I77-V81 WeakPolarHBondContact O-CB 3.26Å; I77-V81 VanDerWaalsContact O-CG2 3.22Å; I77-V81 WeakPolarHBondContact O-CG2 3.49Å; I77-V81 PolarHBondContact O-N 3.21Å; I78-V81 PolarHBondContact O-N 2.91Å; T79-V81 PolarHBondContact O-N 2.74Å; V81-F84 PolarHBondContact O-N 3.23Å; V81-R85 WeakPolarHBondContact O-CB 3.41Å; V81-R85 VanDerWaalsContact O-CG 3.25Å; V81-R85 WeakPolarHBondContact O-CG 3.3Å; V81-R85 PolarHBondContact O-N 3.38Å; V81-Y204 HydrophobicContact CB-CE1 3.97Å; V81-Y204 HydrophobicContact CG1-CE1 3.97Å; V81-Y204 WeakPolarHBondContact CG1-OH 3.46Å; V81-Y204 HydrophobicContact CG2-CE1 4.26Å; V81-L205 HydrophobicContact CG2-CD2 3.73Å; V81-R208 HydrophobicContact CG1-CB 4.08Å
82	E	93	Very high	89.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.9	-37.7	178.5	-68.4	-50.6	143.3	0	0	112.3	I78 F84 R85 V86 L111 R114 L115 F118 Y204 R208	I78-E82 PolarHBondContact O-N 3.27Å; E82-F84 PolarHBondContact O-N 3.46Å; E82-R85 PolarHBondContact O-N 3.19Å; E82-R85 IonicContact OE2-NH1 2.68Å; E82-R85 PolarHBondContact OE2-NH1 3.48Å; E82-V86 WeakPolarHBondContact O-CG2 3.34Å; E82-V86 PolarHBondContact O-N 2.97Å; E82-L111 HydrophobicContact CB-CD1 3.62Å; E82-R114 HydrophobicContact CG-CB 4.37Å; E82-R114 WeakPolarHBondContact OE2-CD 3.45Å; E82-R114 IonicContact OE2-NH1 3.81Å; E82-L115 HydrophobicContact CB-CD2 4.29Å; E82-L115 HydrophobicContact CG-CD2 4.49Å; E82-F118 HydrophobicContact CG-CD2 4.02Å; E82-F118 HydrophobicContact CG-CE2 4.12Å; E82-F118 VanDerWaalsContact OE1-CE2 3.28Å; E82-F118 WeakPolarHBondContact OE1-CE2 3.3Å; E82-Y204 WeakPolarHBondContact CG-OH 3.31Å; E82-Y204 PolarHBondContact OE1-OH 3.38Å; E82-R208 VanDerWaalsContact CD-NH2 3.27Å; E82-R208 IonicContact OE1-CZ 3.08Å; E82-R208 VanDerWaalsContact OE1-CZ 3.31Å; E82-R208 IonicContact OE1-NE 2.69Å; E82-R208 PolarHBondContact OE1-NE 3.29Å; E82-R208 IonicContact OE1-NH2 3.12Å; E82-R208 PolarHBondContact OE1-NH2 3.3Å; E82-R208 IonicContact OE2-CZ 3.76Å; E82-R208 IonicContact OE2-NH2 3.69Å; E82-R208 PolarHBondContact OE2-NH2 2.93Å
83	W	92.3	Very high	88.4	Confident	127 Å²	127	65.4 Å²	65.4	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-59.9	-46.9	173.4	178.1	81.7	0	0	0	111.2	T79 R85 V86 T87 Y88 L111	T79-W83 WeakPolarHBondContact O-CB 3.44Å; T79-W83 PolarHBondContact O-N 3.42Å; W83-R85 VanDerWaalsContact C-N 3.33Å; W83-R85 PolarHBondContact O-N 3.08Å; W83-V86 PolarHBondContact O-N 3.23Å; W83-T87 HydrophobicContact CD2-CG2 4.37Å; W83-T87 HydrophobicContact CG-CG2 4.49Å; W83-T87 HydrophobicContact CZ2-CG2 4.35Å; W83-T87 WeakPolarHBondContact O-CB 3.28Å; W83-T87 WeakPolarHBondContact O-CG2 3.48Å; W83-T87 PolarHBondContact O-N 3.41Å; W83-T87 PolarHBondContact O-OG1 2.95Å; W83-Y88 AromaticContact CH2-CE2 3.95Å; W83-Y88 HydrophobicContact CH2-CE2 3.95Å; W83-Y88 AromaticContact CZ3-CE2 3.94Å; W83-Y88 HydrophobicContact CZ3-CE2 3.94Å; W83-L111 HydrophobicContact CB-CD2 4.41Å
84	F	90.1	Very high	87	Confident	63 Å²	63	70 Å²	70	28%	0.276	31%	0.313	S	S	.	.	H	α-helix	trans	-62.3	-39.6	176.7	177.8	-101.5	0	0	0	112.1	A80 V81 E82 Y88 Y89 W211 V213	A80-F84 VanDerWaalsContact O-CB 3.24Å; A80-F84 WeakPolarHBondContact O-CB 3.2Å; A80-F84 PolarHBondContact O-N 2.89Å; V81-F84 PolarHBondContact O-N 3.23Å; E82-F84 PolarHBondContact O-N 3.46Å; F84-Y88 AromaticContact CD2-CD2 3.39Å; F84-Y88 HydrophobicContact CD2-CD2 3.39Å; F84-Y88 HydrophobicContact CD2-CE2 4.06Å; F84-Y88 HydrophobicContact CD2-CG 4.02Å; F84-Y88 AromaticContact CE2-CD2 3.72Å; F84-Y88 HydrophobicContact CE2-CD2 3.72Å; F84-Y88 HydrophobicContact CE2-CE2 4.46Å; F84-Y88 AromaticContact CE2-CG 3.89Å; F84-Y88 HydrophobicContact CE2-CG 3.89Å; F84-Y88 HydrophobicContact CG-CD2 4.26Å; F84-Y88 WeakPolarHBondContact O-CB 3.27Å; F84-Y88 PolarHBondContact O-N 3.39Å; F84-Y89 PolarHBondContact O-N 3.35Å; F84-W211 HydrophobicContact CD1-CZ2 4.07Å; F84-W211 AromaticContact CE1-CZ2 3.92Å; F84-W211 HydrophobicContact CE1-CZ2 3.92Å; F84-W211 AromaticContact CE1-NE1 3.9Å; F84-V213 HydrophobicContact CE1-CG1 4.24Å; F84-V213 HydrophobicContact CE1-CG2 4.14Å; F84-V213 HydrophobicContact CZ-CG1 4.08Å
85	R	88.2	Confident	85.4	Confident	32 Å²	32	76.8 Å²	76.8	12%	0.121	35%	0.35	C	S	.	.	I	π-helix	trans	-62.1	-48.2	177.6	-76.9	175.7	95.4	-90.1	-8.2	112.6	V81 E82 W83 Y89 E90 R208 W211	V81-R85 WeakPolarHBondContact O-CB 3.41Å; V81-R85 VanDerWaalsContact O-CG 3.25Å; V81-R85 WeakPolarHBondContact O-CG 3.3Å; V81-R85 PolarHBondContact O-N 3.38Å; E82-R85 PolarHBondContact O-N 3.19Å; E82-R85 IonicContact OE2-NH1 2.68Å; E82-R85 PolarHBondContact OE2-NH1 3.48Å; W83-R85 VanDerWaalsContact C-N 3.33Å; W83-R85 PolarHBondContact O-N 3.08Å; R85-Y89 WeakPolarHBondContact O-CB 3.45Å; R85-Y89 PolarHBondContact O-N 2.83Å; R85-E90 IonicContact NH1-OE1 3.01Å; R85-E90 PolarHBondContact O-N 3.44Å; R85-R208 PolarHBondContact NE-O 3.34Å; R85-W211 HydrophobicContact CG-CH2 3.33Å; R85-W211 HydrophobicContact CG-CZ2 3.9Å; R85-W211 HydrophobicContact CG-CZ3 4.29Å
86	V	86.5	Confident	83.5	Confident	3 Å²	3	81.9 Å²	81.9	2%	0.018	37%	0.372	C	S	.	.	I	π-helix	trans	-68.5	-43.7	-178.8	172.9	0	0	0	0	111	E82 W83 N107 L111	E82-V86 WeakPolarHBondContact O-CG2 3.34Å; E82-V86 PolarHBondContact O-N 2.97Å; W83-V86 PolarHBondContact O-N 3.23Å; V86-N107 HydrophobicContact CG1-CB 3.5Å; V86-N107 VanDerWaalsContact CG1-CB 3.5Å; V86-L111 HydrophobicContact CG2-CB 4.44Å
87	T	84.8	Confident	81.5	Confident	42 Å²	42	82 Å²	82	26%	0.258	38%	0.378	S	S	.	.	I	π-helix	trans	-79.4	-38.4	-173	53.1	0	0	0	0	114.2	W83 K91	W83-T87 HydrophobicContact CD2-CG2 4.37Å; W83-T87 HydrophobicContact CG-CG2 4.49Å; W83-T87 HydrophobicContact CZ2-CG2 4.35Å; W83-T87 WeakPolarHBondContact O-CB 3.28Å; W83-T87 WeakPolarHBondContact O-CG2 3.48Å; W83-T87 PolarHBondContact O-N 3.41Å; W83-T87 PolarHBondContact O-OG1 2.95Å; T87-K91 WeakPolarHBondContact O-CB 3.37Å
88	Y	82.2	Confident	79.6	Confident	130 Å²	130	86.6 Å²	86.6	51%	0.51	41%	0.408	S	S	.	.	I	π-helix	trans	-110.4	-50.7	-174	-64.1	-84	0	0	0	113	W83 F84 R92	W83-Y88 AromaticContact CH2-CE2 3.95Å; W83-Y88 HydrophobicContact CH2-CE2 3.95Å; W83-Y88 AromaticContact CZ3-CE2 3.94Å; W83-Y88 HydrophobicContact CZ3-CE2 3.94Å; F84-Y88 AromaticContact CD2-CD2 3.39Å; F84-Y88 HydrophobicContact CD2-CD2 3.39Å; F84-Y88 HydrophobicContact CD2-CE2 4.06Å; F84-Y88 HydrophobicContact CD2-CG 4.02Å; F84-Y88 AromaticContact CE2-CD2 3.72Å; F84-Y88 HydrophobicContact CE2-CD2 3.72Å; F84-Y88 HydrophobicContact CE2-CE2 4.46Å; F84-Y88 AromaticContact CE2-CG 3.89Å; F84-Y88 HydrophobicContact CE2-CG 3.89Å; F84-Y88 HydrophobicContact CG-CD2 4.26Å; F84-Y88 WeakPolarHBondContact O-CB 3.27Å; F84-Y88 PolarHBondContact O-N 3.39Å; Y88-R92 VanDerWaalsContact O-CB 3.3Å; Y88-R92 WeakPolarHBondContact O-CB 3.32Å; Y88-R92 PolarHBondContact O-N 3.47Å
89	Y	80.9	Confident	77.6	Confident	66 Å²	66	88.3 Å²	88.3	26%	0.259	42%	0.423	S	S	.	.	I	π-helix	trans	-71.2	-51.3	-170.4	177.8	-102	0	0	0	112.5	F84 R85 K91 R92 R93 W211	F84-Y89 PolarHBondContact O-N 3.35Å; R85-Y89 WeakPolarHBondContact O-CB 3.45Å; R85-Y89 PolarHBondContact O-N 2.83Å; Y89-K91 VanDerWaalsContact C-N 3.34Å; Y89-K91 PolarHBondContact O-N 3.14Å; Y89-R92 PolarHBondContact O-N 3.25Å; Y89-R93 PolarHBondContact O-N 2.89Å; Y89-W211 AromaticContact CD2-CD2 3.74Å; Y89-W211 HydrophobicContact CD2-CD2 3.74Å; Y89-W211 AromaticContact CD2-CE2 3.72Å; Y89-W211 HydrophobicContact CD2-CE3 4.17Å; Y89-W211 HydrophobicContact CD2-CG 4.05Å; Y89-W211 HydrophobicContact CD2-CZ2 4.23Å; Y89-W211 AromaticContact CD2-NE1 3.88Å; Y89-W211 HydrophobicContact CE2-CB 4.3Å; Y89-W211 AromaticContact CE2-CD2 3.7Å; Y89-W211 HydrophobicContact CE2-CD2 3.7Å; Y89-W211 AromaticContact CE2-CE3 3.9Å; Y89-W211 HydrophobicContact CE2-CE3 3.9Å; Y89-W211 AromaticContact CE2-CG 3.86Å; Y89-W211 HydrophobicContact CE2-CG 3.86Å; Y89-W211 HydrophobicContact CG-CD2 4.46Å; Y89-W211 HydrophobicContact CG-CZ2 4.25Å
90	E	77	Confident	75.6	Confident	40 Å²	40	95.1 Å²	95.1	19%	0.187	44%	0.442	C	S	.	.	I	π-helix	trans	-66.5	-39.9	-179.8	-76	167.5	-161.4	0	0	111.4	R85 R92 R93 F94 R114	R85-E90 IonicContact NH1-OE1 3.01Å; R85-E90 PolarHBondContact O-N 3.44Å; E90-R92 VanDerWaalsContact C-N 3.3Å; E90-R92 PolarHBondContact O-N 3.09Å; E90-R93 PolarHBondContact O-N 2.7Å; E90-F94 WeakPolarHBondContact O-CD2 3.46Å; E90-F94 PolarHBondContact O-N 2.96Å; E90-R114 IonicContact OE1-CZ 2.66Å; E90-R114 IonicContact OE1-NH1 3.73Å; E90-R114 PolarHBondContact OE1-NH1 2.87Å; E90-R114 IonicContact OE1-NH2 3.35Å; E90-R114 PolarHBondContact OE1-NH2 3.3Å; E90-R114 IonicContact OE2-CZ 3.29Å; E90-R114 IonicContact OE2-NH1 2.68Å; E90-R114 IonicContact OE2-NH2 3.58Å; E90-R114 PolarHBondContact OE2-NH2 3.34Å; E90-R114 VanDerWaalsContact OE2-NH2 3.08Å
91	K	73	Confident	73.6	Confident	122 Å²	122	97.2 Å²	97.2	53%	0.53	46%	0.459	S	S	.	.	H	α-helix	trans	-60.9	-36.5	175	-167.9	176.5	-176.5	177.2	0	113.1	T87 Y89	T87-K91 WeakPolarHBondContact O-CB 3.37Å; Y89-K91 VanDerWaalsContact C-N 3.34Å; Y89-K91 PolarHBondContact O-N 3.14Å
92	R	74.8	Confident	71.7	Confident	210 Å²	210	106.1 Å²	106.1	79%	0.792	49%	0.492	S	S	*	.	H	α-helix	trans	-76.3	-31	176.6	-173.6	177.7	178.1	-180	-0.1	112.3	Y88 Y89 E90	Y88-R92 VanDerWaalsContact O-CB 3.3Å; Y88-R92 WeakPolarHBondContact O-CB 3.32Å; Y88-R92 PolarHBondContact O-N 3.47Å; Y89-R92 PolarHBondContact O-N 3.25Å; E90-R92 VanDerWaalsContact C-N 3.3Å; E90-R92 PolarHBondContact O-N 3.09Å
93	R	71	Confident	70.1	Confident	180 Å²	180	108.1 Å²	108.1	68%	0.679	50%	0.502	S	S	*	.	H	α-helix	trans	-72.1	-42	178.1	-174.3	174.7	178.9	157.7	-0.8	111.9	Y89 E90 N95	Y89-R93 PolarHBondContact O-N 2.89Å; E90-R93 PolarHBondContact O-N 2.7Å; R93-N95 PolarHBondContact O-N 3.4Å
94	F	67.1	Low	68.8	Low	141 Å²	141	106.8 Å²	106.8	62%	0.618	51%	0.512	S	S	*	.			trans	-86.5	80.4	176	-73	-81.2	0	0	0	110.5	E90 E96	E90-F94 WeakPolarHBondContact O-CD2 3.46Å; E90-F94 PolarHBondContact O-N 2.96Å; F94-E96 PolarHBondContact O-N 2.97Å; F94-E96 VanDerWaalsContact O-N 3.13Å
95	N	62.1	Low	67.8	Low	144 Å²	144	108.2 Å²	108.2	77%	0.77	53%	0.53	S	S	*	.			trans	-77.4	23.2	178.5	-101	-10.1	0	0	0	114.5	R93	R93-N95 PolarHBondContact O-N 3.4Å
96	E	56.5	Low	67.1	Low	152 Å²	152	111.8 Å²	111.8	71%	0.71	55%	0.548	S	S	*	.			trans	-102.6	121.2	179.4	-73.2	-179.4	176.9	0	0	111.8	F94 T98 A99	F94-E96 PolarHBondContact O-N 2.97Å; F94-E96 VanDerWaalsContact O-N 3.13Å; E96-T98 PolarHBondContact O-N 3.38Å; E96-A99 PolarHBondContact O-N 3.43Å
97	T	55.9	Low	66.6	Low	118 Å²	118	113.3 Å²	113.3	72%	0.724	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	-18.9	-174.7	37.3	0	0	0	0	115.6
98	T	55.6	Low	66.6	Low	128 Å²	128	113.9 Å²	113.9	79%	0.785	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-20.8	-177.6	-42.7	0	0	0	0	113.7	E96	E96-T98 PolarHBondContact O-N 3.38Å
99	A	55.3	Low	66.9	Low	37 Å²	37	114.5 Å²	114.5	31%	0.306	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	-20.2	-178.2	0	0	0	0	0	113.9	E96 A101 L103	E96-A99 PolarHBondContact O-N 3.43Å; A99-A101 VanDerWaalsContact C-N 3.35Å; A99-A101 PolarHBondContact O-N 3.03Å; A99-L103 HydrophobicContact CB-CD1 4.5Å; A99-L103 WeakPolarHBondContact O-CB 3.31Å
100	R	54.1	Low	67.2	Low	195 Å²	195	112.8 Å²	112.8	74%	0.736	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-28	-167.1	-86.5	-178.3	180	173.8	0.7	116.3
101	A	51.8	Low	67.8	Low	97 Å²	97	112.3 Å²	112.3	80%	0.802	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-28.9	-169.6	0	0	0	0	0	114.8	A99	A99-A101 VanDerWaalsContact C-N 3.35Å; A99-A101 PolarHBondContact O-N 3.03Å
102	R	53.4	Low	68.8	Low	202 Å²	202	112 Å²	112	76%	0.762	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-14.6	177.2	-68.2	-175.8	-173.3	-179.8	2.5	113.5	S104	R102-S104 VanDerWaalsContact C-N 3.35Å; R102-S104 PolarHBondContact O-N 3.43Å
103	L	58.7	Low	69.5	Low	42 Å²	42	104.5 Å²	104.5	22%	0.22	55%	0.549	C	S	.	.	H	α-helix	trans	-67.4	-22.8	-167.2	-141.4	64.4	0	0	0	115.4	A99 N107	A99-L103 HydrophobicContact CB-CD1 4.5Å; A99-L103 WeakPolarHBondContact O-CB 3.31Å; L103-N107 WeakPolarHBondContact CG-ND2 3.28Å; L103-N107 WeakPolarHBondContact O-CB 3.45Å; L103-N107 PolarHBondContact O-N 3.37Å; L103-N107 PolarHBondContact O-ND2 2.89Å; L103-N107 PolarHBondContact O-OD1 3.35Å
104	S	66.5	Low	70.5	Confident	98 Å²	98	98.6 Å²	98.6	69%	0.685	53%	0.527	S	S	*	.	H	α-helix	trans	-69.1	-49.9	-168.7	-167.8	0	0	0	0	113.5	R102 N107 A108	R102-S104 VanDerWaalsContact C-N 3.35Å; R102-S104 PolarHBondContact O-N 3.43Å; S104-N107 PolarHBondContact O-N 3.43Å; S104-A108 PolarHBondContact O-N 3.38Å
105	S	67.7	Low	71.8	Confident	93 Å²	93	92.9 Å²	92.9	65%	0.65	50%	0.503	S	S	*	.	H	α-helix	trans	-73	-35.4	177.6	75.1	0	0	0	0	111.8	N107 A108 F109	S105-N107 VanDerWaalsContact C-N 3.31Å; S105-N107 PolarHBondContact O-N 3.34Å; S105-A108 PolarHBondContact O-N 2.7Å; S105-F109 PolarHBondContact O-N 2.93Å
106	E	73.8	Confident	73.3	Confident	108 Å²	108	94.2 Å²	94.2	51%	0.505	50%	0.498	S	S	.	.	H	α-helix	trans	-61.8	-38.9	174.6	-67.9	-178.7	172.7	0	0	111.5	F109 A110	E106-F109 PolarHBondContact O-N 3Å; E106-A110 VanDerWaalsContact O-CB 3.24Å; E106-A110 WeakPolarHBondContact O-CB 3.31Å; E106-A110 PolarHBondContact O-N 3.3Å
107	N	77.3	Confident	75	Confident	35 Å²	35	91.9 Å²	91.9	19%	0.187	49%	0.486	C	S	.	.	H	α-helix	trans	-64.9	-43.1	175	-78.1	-17.8	0	0	0	112.3	V86 L103 S104 S105 A110 L111	V86-N107 HydrophobicContact CG1-CB 3.5Å; V86-N107 VanDerWaalsContact CG1-CB 3.5Å; L103-N107 WeakPolarHBondContact CG-ND2 3.28Å; L103-N107 WeakPolarHBondContact O-CB 3.45Å; L103-N107 PolarHBondContact O-N 3.37Å; L103-N107 PolarHBondContact O-ND2 2.89Å; L103-N107 PolarHBondContact O-OD1 3.35Å; S104-N107 PolarHBondContact O-N 3.43Å; S105-N107 VanDerWaalsContact C-N 3.31Å; S105-N107 PolarHBondContact O-N 3.34Å; N107-A110 PolarHBondContact O-N 3.18Å; N107-L111 WeakPolarHBondContact O-CB 3.17Å; N107-L111 PolarHBondContact O-N 3.4Å
108	A	85.2	Confident	76.7	Confident	53 Å²	53	87.4 Å²	87.4	44%	0.438	46%	0.456	S	S	.	.	H	α-helix	trans	-63.4	-45.3	178.4	0	0	0	0	0	110.8	S104 S105 L111 L112	S104-A108 PolarHBondContact O-N 3.38Å; S105-A108 PolarHBondContact O-N 2.7Å; A108-L111 PolarHBondContact O-N 2.91Å; A108-L112 VanDerWaalsContact O-CG 3.31Å; A108-L112 WeakPolarHBondContact O-CG 3.41Å; A108-L112 PolarHBondContact O-N 2.86Å
109	F	88.6	Confident	78.6	Confident	144 Å²	144	84 Å²	84	63%	0.632	43%	0.431	S	S	*	.	H	α-helix	trans	-62.1	-46.2	175.3	-178.1	-104.8	0	0	0	111.8	S105 E106 L111 L112 V113	S105-F109 PolarHBondContact O-N 2.93Å; E106-F109 PolarHBondContact O-N 3Å; F109-L111 VanDerWaalsContact C-N 3.32Å; F109-L111 PolarHBondContact O-N 3.45Å; F109-L112 PolarHBondContact O-N 3.17Å; F109-V113 HydrophobicContact CD1-CG2 4.23Å; F109-V113 HydrophobicContact CD2-CG2 4.45Å; F109-V113 HydrophobicContact CE1-CG2 3.83Å; F109-V113 HydrophobicContact CE2-CG2 4.07Å; F109-V113 HydrophobicContact CZ-CG2 3.74Å; F109-V113 WeakPolarHBondContact O-CG2 3.39Å; F109-V113 PolarHBondContact O-N 3.45Å
110	A	86.1	Confident	80.4	Confident	29 Å²	29	84 Å²	84	24%	0.24	43%	0.434	C	S	.	.	H	α-helix	trans	-60.2	-40.5	177	0	0	0	0	0	112.3	E106 N107 R114	E106-A110 VanDerWaalsContact O-CB 3.24Å; E106-A110 WeakPolarHBondContact O-CB 3.31Å; E106-A110 PolarHBondContact O-N 3.3Å; N107-A110 PolarHBondContact O-N 3.18Å; A110-R114 WeakPolarHBondContact O-CD 3.07Å; A110-R114 VanDerWaalsContact O-CG 3.23Å; A110-R114 WeakPolarHBondContact O-CG 3.31Å; A110-R114 PolarHBondContact O-N 3.38Å; A110-R114 VanDerWaalsContact O-N 3.08Å
111	L	90.5	Very high	82.2	Confident	30 Å²	30	78.9 Å²	78.9	16%	0.157	42%	0.415	C	S	.	.	H	α-helix	trans	-62.8	-49.1	174.9	179.4	60.6	0	0	0	110.9	E82 W83 V86 N107 A108 F109 V113 R114 L115	E82-L111 HydrophobicContact CB-CD1 3.62Å; W83-L111 HydrophobicContact CB-CD2 4.41Å; V86-L111 HydrophobicContact CG2-CB 4.44Å; N107-L111 WeakPolarHBondContact O-CB 3.17Å; N107-L111 PolarHBondContact O-N 3.4Å; A108-L111 PolarHBondContact O-N 2.91Å; F109-L111 VanDerWaalsContact C-N 3.32Å; F109-L111 PolarHBondContact O-N 3.45Å; L111-V113 VanDerWaalsContact C-N 3.35Å; L111-V113 PolarHBondContact O-N 2.93Å; L111-R114 PolarHBondContact O-N 3.42Å; L111-L115 HydrophobicContact CD1-CD1 4.13Å; L111-L115 HydrophobicContact CD1-CD2 4.39Å; L111-L115 HydrophobicContact CD1-CG 4.07Å; L111-L115 HydrophobicContact CG-CD1 4Å; L111-L115 HydrophobicContact CG-CG 4.33Å; L111-L115 VanDerWaalsContact O-CG 3.3Å; L111-L115 WeakPolarHBondContact O-CG 3.28Å; L111-L115 PolarHBondContact O-N 3.06Å
112	L	92.4	Very high	84.2	Confident	115 Å²	115	74.2 Å²	74.2	60%	0.602	38%	0.377	S	S	*	.	H	α-helix	trans	-59.6	-43.9	179.7	-71.4	173.9	0	0	0	112.3	A108 F109 R114 L115 Y116	A108-L112 VanDerWaalsContact O-CG 3.31Å; A108-L112 WeakPolarHBondContact O-CG 3.41Å; A108-L112 PolarHBondContact O-N 2.86Å; F109-L112 PolarHBondContact O-N 3.17Å; L112-R114 VanDerWaalsContact C-N 3.35Å; L112-R114 PolarHBondContact O-N 2.95Å; L112-L115 PolarHBondContact O-N 2.94Å; L112-Y116 WeakPolarHBondContact O-CB 2.96Å; L112-Y116 PolarHBondContact O-N 2.85Å
113	V	91	Very high	86.2	Confident	53 Å²	53	68.8 Å²	68.8	32%	0.321	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176.7	172.2	0	0	0	0	110.9	F109 L111 Y116 F117	F109-V113 HydrophobicContact CD1-CG2 4.23Å; F109-V113 HydrophobicContact CD2-CG2 4.45Å; F109-V113 HydrophobicContact CE1-CG2 3.83Å; F109-V113 HydrophobicContact CE2-CG2 4.07Å; F109-V113 HydrophobicContact CZ-CG2 3.74Å; F109-V113 WeakPolarHBondContact O-CG2 3.39Å; F109-V113 PolarHBondContact O-N 3.45Å; L111-V113 VanDerWaalsContact C-N 3.35Å; L111-V113 PolarHBondContact O-N 2.93Å; V113-Y116 WeakPolarHBondContact O-CB 3.17Å; V113-Y116 PolarHBondContact O-N 2.88Å; V113-F117 HydrophobicContact CG1-CD2 3.85Å; V113-F117 HydrophobicContact CG1-CE2 3.64Å; V113-F117 WeakPolarHBondContact O-CD2 3.44Å; V113-F117 PolarHBondContact O-N 3.11Å; V113-F117 VanDerWaalsContact O-N 3.11Å
114	R	91.1	Very high	87.9	Confident	56 Å²	56	70.7 Å²	70.7	21%	0.211	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-45.4	177.4	-71.4	170.1	-173.4	-166.3	6.8	112.2	E82 E90 A110 L111 L112 Y116 F117 F118	E82-R114 HydrophobicContact CG-CB 4.37Å; E82-R114 WeakPolarHBondContact OE2-CD 3.45Å; E82-R114 IonicContact OE2-NH1 3.81Å; E90-R114 IonicContact OE1-CZ 2.66Å; E90-R114 IonicContact OE1-NH1 3.73Å; E90-R114 PolarHBondContact OE1-NH1 2.87Å; E90-R114 IonicContact OE1-NH2 3.35Å; E90-R114 PolarHBondContact OE1-NH2 3.3Å; E90-R114 IonicContact OE2-CZ 3.29Å; E90-R114 IonicContact OE2-NH1 2.68Å; E90-R114 IonicContact OE2-NH2 3.58Å; E90-R114 PolarHBondContact OE2-NH2 3.34Å; E90-R114 VanDerWaalsContact OE2-NH2 3.08Å; A110-R114 WeakPolarHBondContact O-CD 3.07Å; A110-R114 VanDerWaalsContact O-CG 3.23Å; A110-R114 WeakPolarHBondContact O-CG 3.31Å; A110-R114 PolarHBondContact O-N 3.38Å; A110-R114 VanDerWaalsContact O-N 3.08Å; L111-R114 PolarHBondContact O-N 3.42Å; L112-R114 VanDerWaalsContact C-N 3.35Å; L112-R114 PolarHBondContact O-N 2.95Å; R114-Y116 VanDerWaalsContact C-N 3.3Å; R114-Y116 PolarHBondContact O-N 3.47Å; R114-F117 PolarHBondContact O-N 3.44Å; R114-F118 HydrophobicContact CB-CD2 4.33Å; R114-F118 HydrophobicContact CB-CE2 4.31Å; R114-F118 WeakPolarHBondContact O-CD2 3.21Å; R114-F118 PolarHBondContact O-N 3.39Å
115	L	94.4	Very high	89.3	Confident	22 Å²	22	66 Å²	66	12%	0.115	35%	0.346	C	S	.	.	H	α-helix	trans	-61.5	-41.7	177.3	-65.8	177.7	0	0	0	111	I78 T79 E82 L111 L112 F117 F118 F119	I78-L115 HydrophobicContact CG2-CD2 4.14Å; T79-L115 HydrophobicContact CG2-CD1 4.41Å; E82-L115 HydrophobicContact CB-CD2 4.29Å; E82-L115 HydrophobicContact CG-CD2 4.49Å; L111-L115 HydrophobicContact CD1-CD1 4.13Å; L111-L115 HydrophobicContact CD1-CD2 4.39Å; L111-L115 HydrophobicContact CD1-CG 4.07Å; L111-L115 HydrophobicContact CG-CD1 4Å; L111-L115 HydrophobicContact CG-CG 4.33Å; L111-L115 VanDerWaalsContact O-CG 3.3Å; L111-L115 WeakPolarHBondContact O-CG 3.28Å; L111-L115 PolarHBondContact O-N 3.06Å; L112-L115 PolarHBondContact O-N 2.94Å; L115-F117 PolarHBondContact O-N 2.94Å; L115-F118 PolarHBondContact O-N 2.98Å; L115-F119 HydrophobicContact CD2-CE1 4.27Å; L115-F119 HydrophobicContact CD2-CZ 4.25Å; L115-F119 WeakPolarHBondContact O-CB 3.26Å; L115-F119 WeakPolarHBondContact O-CG 3.14Å; L115-F119 PolarHBondContact O-N 3.49Å
116	Y	94.1	Very high	90.6	Very high	172 Å²	172	61.8 Å²	61.8	68%	0.675	32%	0.316	S	S	*	.	H	α-helix	trans	-55.6	-49.3	174.6	171.6	-96.5	0	0	0	111.9	L112 V113 R114 G120	L112-Y116 WeakPolarHBondContact O-CB 2.96Å; L112-Y116 PolarHBondContact O-N 2.85Å; V113-Y116 WeakPolarHBondContact O-CB 3.17Å; V113-Y116 PolarHBondContact O-N 2.88Å; R114-Y116 VanDerWaalsContact C-N 3.3Å; R114-Y116 PolarHBondContact O-N 3.47Å; Y116-G120 WeakPolarHBondContact O-CA 3.49Å; Y116-G120 PolarHBondContact O-N 3.44Å
117	F	91.8	Very high	91.6	Very high	103 Å²	103	59.2 Å²	59.2	45%	0.452	31%	0.314	S	S	.	.	H	α-helix	trans	-65.5	-51.3	178.5	-78.2	-68.1	0	0	0	112.2	V113 R114 L115 F119 G120 Y121	V113-F117 HydrophobicContact CG1-CD2 3.85Å; V113-F117 HydrophobicContact CG1-CE2 3.64Å; V113-F117 WeakPolarHBondContact O-CD2 3.44Å; V113-F117 PolarHBondContact O-N 3.11Å; V113-F117 VanDerWaalsContact O-N 3.11Å; R114-F117 PolarHBondContact O-N 3.44Å; L115-F117 PolarHBondContact O-N 2.94Å; F117-F119 PolarHBondContact O-N 3.36Å; F117-G120 PolarHBondContact O-N 2.89Å; F117-Y121 HydrophobicContact CB-CD2 4.4Å; F117-Y121 HydrophobicContact CB-CE2 4.08Å; F117-Y121 HydrophobicContact CD1-CE2 4.32Å; F117-Y121 WeakPolarHBondContact O-CD2 3.37Å; F117-Y121 PolarHBondContact O-N 3.37Å
118	F	92.3	Very high	92.5	Very high	24 Å²	24	59.2 Å²	59.2	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-38.9	-176.8	-72.4	-60.1	0	0	0	113.2	I78 E82 R114 L115 F122 Y204	I78-F118 HydrophobicContact CG2-CB 3.78Å; I78-F118 HydrophobicContact CG2-CG 4.39Å; E82-F118 HydrophobicContact CG-CD2 4.02Å; E82-F118 HydrophobicContact CG-CE2 4.12Å; E82-F118 VanDerWaalsContact OE1-CE2 3.28Å; E82-F118 WeakPolarHBondContact OE1-CE2 3.3Å; R114-F118 HydrophobicContact CB-CD2 4.33Å; R114-F118 HydrophobicContact CB-CE2 4.31Å; R114-F118 WeakPolarHBondContact O-CD2 3.21Å; R114-F118 PolarHBondContact O-N 3.39Å; L115-F118 PolarHBondContact O-N 2.98Å; F118-F122 WeakPolarHBondContact O-CB 3.35Å; F118-F122 PolarHBondContact O-N 3.06Å; F118-Y204 AromaticContact CD1-CD2 3.99Å; F118-Y204 HydrophobicContact CD1-CD2 3.99Å; F118-Y204 AromaticContact CD1-CE2 3.69Å; F118-Y204 HydrophobicContact CD1-CE2 3.69Å; F118-Y204 HydrophobicContact CD2-CE2 4.14Å; F118-Y204 HydrophobicContact CE1-CD2 4.15Å; F118-Y204 AromaticContact CE1-CE2 3.84Å; F118-Y204 HydrophobicContact CE1-CE2 3.84Å; F118-Y204 HydrophobicContact CE2-CE2 4.28Å; F118-Y204 AromaticContact CG-CE2 3.88Å; F118-Y204 HydrophobicContact CG-CE2 3.88Å; F118-Y204 HydrophobicContact CZ-CE2 4.14Å
119	F	94.9	Very high	93	Very high	56 Å²	56	56.7 Å²	56.7	25%	0.246	30%	0.298	C	S	.	.	H	α-helix	trans	-67.8	-40.8	173	-68.6	-0.3	0	0	0	110.6	L75 I78 T79 L115 F117 Y121 F122 L123	L75-F119 HydrophobicContact CB-CE1 4.18Å; L75-F119 HydrophobicContact CB-CZ 4.11Å; L75-F119 HydrophobicContact CD2-CB 4.47Å; L75-F119 HydrophobicContact CD2-CD1 3.37Å; L75-F119 HydrophobicContact CD2-CD2 4.05Å; L75-F119 HydrophobicContact CD2-CE1 3.39Å; L75-F119 HydrophobicContact CD2-CE2 4.06Å; L75-F119 HydrophobicContact CD2-CG 3.72Å; L75-F119 HydrophobicContact CD2-CZ 3.74Å; L75-F119 HydrophobicContact CG-CE1 4.38Å; L75-F119 HydrophobicContact CG-CZ 4.48Å; I78-F119 HydrophobicContact CB-CE1 4.02Å; I78-F119 HydrophobicContact CD1-CD1 4.45Å; I78-F119 HydrophobicContact CD1-CE1 4.5Å; I78-F119 HydrophobicContact CG2-CD1 4.1Å; I78-F119 HydrophobicContact CG2-CE1 3.73Å; T79-F119 WeakPolarHBondContact OG1-CZ 3.34Å; L115-F119 HydrophobicContact CD2-CE1 4.27Å; L115-F119 HydrophobicContact CD2-CZ 4.25Å; L115-F119 WeakPolarHBondContact O-CB 3.26Å; L115-F119 WeakPolarHBondContact O-CG 3.14Å; L115-F119 PolarHBondContact O-N 3.49Å; F117-F119 PolarHBondContact O-N 3.36Å; F119-Y121 PolarHBondContact O-N 3.02Å; F119-F122 PolarHBondContact O-N 3.35Å; F119-L123 WeakPolarHBondContact O-CB 3.49Å; F119-L123 WeakPolarHBondContact O-CG 3.22Å; F119-L123 PolarHBondContact O-N 2.74Å
120	G	93.2	Very high	93.4	Very high	36 Å²	36	54.2 Å²	54.2	37%	0.371	29%	0.288	S	S	.	.	H	α-helix	trans	-56.2	-48.3	174.3	0	0	0	0	0	112.5	Y116 F117 L123 C124	Y116-G120 WeakPolarHBondContact O-CA 3.49Å; Y116-G120 PolarHBondContact O-N 3.44Å; F117-G120 PolarHBondContact O-N 2.89Å; G120-L123 PolarHBondContact O-N 2.88Å; G120-C124 VanDerWaalsContact O-CB 3.28Å; G120-C124 WeakPolarHBondContact O-CB 3.46Å; G120-C124 PolarHBondContact O-N 3.26Å
121	Y	92	Very high	93.8	Very high	88 Å²	88	57.9 Å²	57.9	35%	0.345	30%	0.303	S	S	.	.	H	α-helix	trans	-62.7	-46.9	176.4	-71.3	-58.7	0	0	0	112.2	F117 F119 L123 C124 G125 H266	F117-Y121 HydrophobicContact CB-CD2 4.4Å; F117-Y121 HydrophobicContact CB-CE2 4.08Å; F117-Y121 HydrophobicContact CD1-CE2 4.32Å; F117-Y121 WeakPolarHBondContact O-CD2 3.37Å; F117-Y121 PolarHBondContact O-N 3.37Å; F119-Y121 PolarHBondContact O-N 3.02Å; Y121-L123 VanDerWaalsContact C-N 3.31Å; Y121-L123 PolarHBondContact O-N 3.48Å; Y121-C124 PolarHBondContact O-N 3.43Å; Y121-G125 PolarHBondContact O-N 3.48Å; Y121-H266 AromaticContact CE2-CE1 3.76Å; Y121-H266 AromaticContact CE2-ND1 3.75Å; Y121-H266 AromaticContact CZ-CE1 3.89Å; Y121-H266 AromaticContact CZ-ND1 3.5Å; Y121-H266 PolarHBondContact OH-ND1 3.32Å
122	F	94.1	Very high	94	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-42.8	177	177	-99.5	0	0	0	112	A70 F71 P74 L75 F118 F119 A126 Y196 A197 F200	A70-F122 WeakPolarHBondContact O-CZ 3.16Å; F71-F122 AromaticContact CD1-CE1 3.93Å; F71-F122 HydrophobicContact CD1-CE1 3.93Å; F71-F122 HydrophobicContact CE1-CE1 4.2Å; P74-F122 HydrophobicContact CB-CD2 4.34Å; P74-F122 HydrophobicContact CB-CE2 3.83Å; P74-F122 HydrophobicContact CB-CZ 4Å; P74-F122 HydrophobicContact CG-CE2 3.93Å; P74-F122 HydrophobicContact CG-CZ 3.95Å; L75-F122 HydrophobicContact CD2-CD1 4.43Å; F118-F122 WeakPolarHBondContact O-CB 3.35Å; F118-F122 PolarHBondContact O-N 3.06Å; F119-F122 PolarHBondContact O-N 3.35Å; F122-A126 VanDerWaalsContact O-CB 3.27Å; F122-A126 WeakPolarHBondContact O-CB 3.39Å; F122-A126 PolarHBondContact O-N 3.22Å; F122-Y196 WeakPolarHBondContact CA-OH 3.36Å; F122-Y196 HydrophobicContact CD2-CE1 4.14Å; F122-Y196 AromaticContact CE2-CE1 3.86Å; F122-Y196 HydrophobicContact CE2-CE1 3.86Å; F122-Y196 HydrophobicContact CZ-CE1 4.35Å; F122-Y196 PolarHBondContact O-OH 2.78Å; F122-A197 HydrophobicContact CE2-CB 4.2Å; F122-A197 HydrophobicContact CZ-CB 4.23Å; F122-F200 HydrophobicContact CB-CE1 3.97Å; F122-F200 HydrophobicContact CB-CZ 4.04Å; F122-F200 AromaticContact CD2-CD1 3.61Å; F122-F200 HydrophobicContact CD2-CD1 3.61Å; F122-F200 AromaticContact CD2-CE1 3.84Å; F122-F200 HydrophobicContact CD2-CE1 3.84Å; F122-F200 HydrophobicContact CD2-CG 4.07Å; F122-F200 HydrophobicContact CD2-CZ 4.46Å; F122-F200 HydrophobicContact CE2-CD1 4.34Å; F122-F200 HydrophobicContact CG-CE1 4.38Å
123	L	95.3	Very high	94.1	Very high	88 Å²	88	53 Å²	53	46%	0.461	28%	0.281	S	S	.	.	H	α-helix	trans	-73.5	-40.3	-179.4	-69.2	175.4	0	0	0	112.6	F71 F119 G120 Y121 G125 A126 A127	F71-L123 HydrophobicContact CD1-CD2 4.32Å; F71-L123 HydrophobicContact CE1-CD2 3.73Å; F119-L123 WeakPolarHBondContact O-CB 3.49Å; F119-L123 WeakPolarHBondContact O-CG 3.22Å; F119-L123 PolarHBondContact O-N 2.74Å; G120-L123 PolarHBondContact O-N 2.88Å; Y121-L123 VanDerWaalsContact C-N 3.31Å; Y121-L123 PolarHBondContact O-N 3.48Å; L123-G125 VanDerWaalsContact C-N 3.26Å; L123-G125 PolarHBondContact O-N 3.35Å; L123-A126 WeakPolarHBondContact O-CB 3.47Å; L123-A126 PolarHBondContact O-N 2.95Å; L123-A127 WeakPolarHBondContact O-CB 3.48Å; L123-A127 PolarHBondContact O-N 3.34Å
124	C	94	Very high	94.2	Very high	82 Å²	82	53.1 Å²	53.1	55%	0.554	28%	0.28	S	S	*	.	H	α-helix	trans	-59	-43.4	174.5	-176.4	0	0	0	0	110.6	G120 Y121 A127 A128	G120-C124 VanDerWaalsContact O-CB 3.28Å; G120-C124 WeakPolarHBondContact O-CB 3.46Å; G120-C124 PolarHBondContact O-N 3.26Å; Y121-C124 PolarHBondContact O-N 3.43Å; C124-A127 PolarHBondContact O-N 2.76Å; C124-A128 PolarHBondContact O-N 2.87Å
125	G	94.7	Very high	94.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-38.1	175.8	0	0	0	0	0	115.5	Y121 L123 A127 A128 N129 Y196	Y121-G125 PolarHBondContact O-N 3.48Å; L123-G125 VanDerWaalsContact C-N 3.26Å; L123-G125 PolarHBondContact O-N 3.35Å; G125-A127 VanDerWaalsContact C-N 3.27Å; G125-A127 PolarHBondContact O-N 3.17Å; G125-A128 PolarHBondContact O-N 3.12Å; G125-N129 VanDerWaalsContact O-CB 3.28Å; G125-N129 WeakPolarHBondContact O-CB 3.4Å; G125-N129 PolarHBondContact O-N 3.4Å; G125-Y196 VanDerWaalsContact C-CZ 3.41Å; G125-Y196 VanDerWaalsContact CA-OH 3.27Å; G125-Y196 WeakPolarHBondContact CA-OH 3.16Å
126	A	95.4	Very high	94	Very high	3 Å²	3	53.3 Å²	53.3	3%	0.025	29%	0.289	C	S	.	.	H	α-helix	trans	-58.4	-44.3	173.7	0	0	0	0	0	110.5	F122 L123 N129 E130 W193 Y196	F122-A126 VanDerWaalsContact O-CB 3.27Å; F122-A126 WeakPolarHBondContact O-CB 3.39Å; F122-A126 PolarHBondContact O-N 3.22Å; L123-A126 WeakPolarHBondContact O-CB 3.47Å; L123-A126 PolarHBondContact O-N 2.95Å; A126-N129 PolarHBondContact O-N 3.48Å; A126-E130 WeakPolarHBondContact O-CB 3.39Å; A126-E130 PolarHBondContact O-N 2.91Å; A126-W193 HydrophobicContact CB-CH2 3.63Å; A126-W193 HydrophobicContact CB-CZ3 3.67Å; A126-Y196 HydrophobicContact CB-CD1 4.48Å; A126-Y196 HydrophobicContact CB-CE1 3.77Å; A126-Y196 VanDerWaalsContact N-CZ 3.34Å; A126-Y196 PolarHBondContact N-OH 3.4Å
127	A	95.9	Very high	93.8	Very high	55 Å²	55	46.8 Å²	46.8	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-43.3	176.1	0	0	0	0	0	112.5	L123 C124 G125 N129 E130 L131	L123-A127 WeakPolarHBondContact O-CB 3.48Å; L123-A127 PolarHBondContact O-N 3.34Å; C124-A127 PolarHBondContact O-N 2.76Å; G125-A127 VanDerWaalsContact C-N 3.27Å; G125-A127 PolarHBondContact O-N 3.17Å; A127-N129 VanDerWaalsContact C-N 3.32Å; A127-N129 PolarHBondContact O-N 3.22Å; A127-E130 PolarHBondContact O-N 3.4Å; A127-L131 WeakPolarHBondContact O-CB 3.38Å; A127-L131 PolarHBondContact O-N 3.3Å
128	A	95.6	Very high	93.7	Very high	35 Å²	35	45.9 Å²	45.9	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-62.5	-40.2	175.9	0	0	0	0	0	112	C124 G125 S132 I258	C124-A128 PolarHBondContact O-N 2.87Å; G125-A128 PolarHBondContact O-N 3.12Å; A128-S132 WeakPolarHBondContact O-CB 3.11Å; A128-S132 PolarHBondContact O-N 3Å; A128-S132 PolarHBondContact O-OG 2.9Å; A128-I258 HydrophobicContact CB-CG2 4.41Å
129	N	96.6	Very high	93.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-45.5	176.7	-175.6	67	0	0	0	112.2	G125 A126 A127 S132 T133 S192 Y196 G255 I258	G125-N129 VanDerWaalsContact O-CB 3.28Å; G125-N129 WeakPolarHBondContact O-CB 3.4Å; G125-N129 PolarHBondContact O-N 3.4Å; A126-N129 PolarHBondContact O-N 3.48Å; A127-N129 VanDerWaalsContact C-N 3.32Å; A127-N129 PolarHBondContact O-N 3.22Å; N129-S132 PolarHBondContact O-N 3.12Å; N129-T133 WeakPolarHBondContact O-CB 3.28Å; N129-T133 PolarHBondContact O-N 3.44Å; N129-T133 PolarHBondContact O-OG1 2.92Å; N129-S192 VanDerWaalsContact CG-OG 3.3Å; N129-S192 PolarHBondContact ND2-OG 2.9Å; N129-S192 PolarHBondContact OD1-OG 3.47Å; N129-Y196 HydrophobicContact CB-CD2 4.46Å; N129-Y196 HydrophobicContact CB-CG 4.23Å; N129-G255 VanDerWaalsContact OD1-CA 3.32Å; N129-G255 WeakPolarHBondContact OD1-CA 3.34Å; N129-I258 HydrophobicContact CB-CB 4.46Å; N129-I258 HydrophobicContact CB-CG2 4.08Å
130	E	95.6	Very high	93.3	Very high	91 Å²	91	52.2 Å²	52.2	43%	0.425	30%	0.298	S	S	.	.	H	α-helix	trans	-61.2	-50.5	176.5	-175.3	169.5	-161.7	0	0	111.1	A126 A127 S132 T133 D134 W193	A126-E130 WeakPolarHBondContact O-CB 3.39Å; A126-E130 PolarHBondContact O-N 2.91Å; A127-E130 PolarHBondContact O-N 3.4Å; E130-S132 VanDerWaalsContact C-N 3.34Å; E130-S132 PolarHBondContact O-N 3.27Å; E130-T133 WeakPolarHBondContact O-CB 3.38Å; E130-T133 PolarHBondContact O-N 2.9Å; E130-D134 WeakPolarHBondContact O-CB 3.48Å; E130-D134 PolarHBondContact O-N 3.43Å; E130-W193 HydrophobicContact CB-CZ2 3.83Å; E130-W193 HydrophobicContact CG-CZ2 4.23Å; E130-W193 WeakPolarHBondContact OE2-CZ2 3.26Å
131	L	95.7	Very high	93.1	Very high	106 Å²	106	51.6 Å²	51.6	56%	0.555	29%	0.292	S	S	*	.	H	α-helix	trans	-57.4	-46.6	178	179.6	62.6	0	0	0	111.6	A127 T133 D134 L135	A127-L131 WeakPolarHBondContact O-CB 3.38Å; A127-L131 PolarHBondContact O-N 3.3Å; L131-T133 VanDerWaalsContact C-N 3.33Å; L131-T133 PolarHBondContact O-N 2.91Å; L131-D134 PolarHBondContact O-N 3.37Å; L131-L135 HydrophobicContact CD1-CD1 4.31Å; L131-L135 HydrophobicContact CD1-CG 4.28Å; L131-L135 HydrophobicContact CG-CD1 4.05Å; L131-L135 HydrophobicContact CG-CG 4.45Å; L131-L135 WeakPolarHBondContact O-CB 3.24Å; L131-L135 WeakPolarHBondContact O-CG 3.45Å; L131-L135 PolarHBondContact O-N 3.04Å
132	S	94.7	Very high	93.1	Very high	41 Å²	41	51.7 Å²	51.7	29%	0.287	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-39.8	179.7	-57.5	0	0	0	0	112.1	A128 N129 E130 G136	A128-S132 WeakPolarHBondContact O-CB 3.11Å; A128-S132 PolarHBondContact O-N 3Å; A128-S132 PolarHBondContact O-OG 2.9Å; N129-S132 PolarHBondContact O-N 3.12Å; E130-S132 VanDerWaalsContact C-N 3.34Å; E130-S132 PolarHBondContact O-N 3.27Å; S132-G136 PolarHBondContact O-N 2.97Å; S132-G136 VanDerWaalsContact O-N 3.09Å
133	T	94.5	Very high	93.1	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-45.9	177.2	-59.5	0	0	0	0	110.8	N129 E130 L131 G136 K137 P187 S192	N129-T133 WeakPolarHBondContact O-CB 3.28Å; N129-T133 PolarHBondContact O-N 3.44Å; N129-T133 PolarHBondContact O-OG1 2.92Å; E130-T133 WeakPolarHBondContact O-CB 3.38Å; E130-T133 PolarHBondContact O-N 2.9Å; L131-T133 VanDerWaalsContact C-N 3.33Å; L131-T133 PolarHBondContact O-N 2.91Å; T133-G136 PolarHBondContact O-N 3.28Å; T133-K137 WeakPolarHBondContact O-CG 3.25Å; T133-K137 PolarHBondContact O-N 2.91Å; T133-P187 HydrophobicContact CG2-CG 4.14Å; T133-S192 PolarHBondContact OG1-OG 2.95Å
134	D	92.3	Very high	93.1	Very high	55 Å²	55	48.9 Å²	48.9	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-69.3	-40.3	-178.8	-78.9	-6.1	0	0	0	111.8	E130 L131 G136 K137 F138	E130-D134 WeakPolarHBondContact O-CB 3.48Å; E130-D134 PolarHBondContact O-N 3.43Å; L131-D134 PolarHBondContact O-N 3.37Å; D134-G136 VanDerWaalsContact C-N 3.29Å; D134-G136 PolarHBondContact O-N 3.05Å; D134-K137 PolarHBondContact O-N 3.21Å; D134-K137 VanDerWaalsContact O-N 3.13Å; D134-K137 IonicContact OD1-NZ 3.81Å; D134-F138 HydrophobicContact CB-CD2 4.38Å; D134-F138 HydrophobicContact CB-CE2 4.1Å; D134-F138 WeakPolarHBondContact O-CD2 3.17Å; D134-F138 PolarHBondContact O-N 2.84Å
135	L	91	Very high	93.2	Very high	67 Å²	67	45.2 Å²	45.2	35%	0.351	25%	0.251	S	S	.	.	H	α-helix	trans	-53.5	-48.1	170.1	-75.9	171.3	0	0	0	111	L131 K137 F138 I139	L131-L135 HydrophobicContact CD1-CD1 4.31Å; L131-L135 HydrophobicContact CD1-CG 4.28Å; L131-L135 HydrophobicContact CG-CD1 4.05Å; L131-L135 HydrophobicContact CG-CG 4.45Å; L131-L135 WeakPolarHBondContact O-CB 3.24Å; L131-L135 WeakPolarHBondContact O-CG 3.45Å; L131-L135 PolarHBondContact O-N 3.04Å; L135-K137 VanDerWaalsContact C-N 3.35Å; L135-K137 PolarHBondContact O-N 2.63Å; L135-F138 PolarHBondContact O-N 3.37Å; L135-I139 HydrophobicContact CB-CD1 4.49Å; L135-I139 WeakPolarHBondContact O-CB 3.21Å; L135-I139 WeakPolarHBondContact O-CD1 3.28Å; L135-I139 WeakPolarHBondContact O-CG1 3.23Å; L135-I139 PolarHBondContact O-N 3.26Å
136	G	90.4	Very high	93.2	Very high	16 Å²	16	45.4 Å²	45.4	17%	0.165	25%	0.252	C	S	.	.	H	α-helix	trans	-57.9	-44.7	176.4	0	0	0	0	0	113	S132 T133 D134 V140 F186	S132-G136 PolarHBondContact O-N 2.97Å; S132-G136 VanDerWaalsContact O-N 3.09Å; T133-G136 PolarHBondContact O-N 3.28Å; D134-G136 VanDerWaalsContact C-N 3.29Å; D134-G136 PolarHBondContact O-N 3.05Å; G136-V140 WeakPolarHBondContact O-CB 3.46Å; G136-V140 WeakPolarHBondContact O-CG2 3.18Å; G136-V140 PolarHBondContact O-N 3.43Å; G136-F186 CarbonylContact C-O 3.39Å; G136-F186 VanDerWaalsContact C-O 3.29Å
137	K	90.6	Very high	93.2	Very high	35 Å²	35	45.2 Å²	45.2	15%	0.152	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-46.5	178.8	-73.6	175.8	-178.1	168	0	113.2	T133 D134 L135 G141 L184 F186 P187	T133-K137 WeakPolarHBondContact O-CG 3.25Å; T133-K137 PolarHBondContact O-N 2.91Å; D134-K137 PolarHBondContact O-N 3.21Å; D134-K137 VanDerWaalsContact O-N 3.13Å; D134-K137 IonicContact OD1-NZ 3.81Å; L135-K137 VanDerWaalsContact C-N 3.35Å; L135-K137 PolarHBondContact O-N 2.63Å; K137-G141 PolarHBondContact O-N 3.42Å; K137-L184 HydrophobicContact CB-CD2 4.32Å; K137-L184 WeakPolarHBondContact O-CD2 3.36Å; K137-F186 WeakPolarHBondContact CA-O 3.48Å; K137-F186 WeakPolarHBondContact CG-O 2.9Å; K137-F186 PolarHBondContact N-O 2.98Å; K137-P187 WeakPolarHBondContact CE-O 3.46Å
138	F	87.9	Confident	93	Very high	84 Å²	84	43 Å²	43	37%	0.368	23%	0.232	S	C	.	.	H	α-helix	trans	-77	-30.8	-176.6	-65.2	-59.4	0	0	0	112.9	A36 D134 L135 L184	A36-F138 HydrophobicContact CB-CD1 3.74Å; A36-F138 HydrophobicContact CB-CD2 4.13Å; A36-F138 HydrophobicContact CB-CE1 3.5Å; A36-F138 VanDerWaalsContact CB-CE1 3.5Å; A36-F138 HydrophobicContact CB-CE2 3.92Å; A36-F138 HydrophobicContact CB-CG 4.06Å; A36-F138 HydrophobicContact CB-CZ 3.6Å; D134-F138 HydrophobicContact CB-CD2 4.38Å; D134-F138 HydrophobicContact CB-CE2 4.1Å; D134-F138 WeakPolarHBondContact O-CD2 3.17Å; D134-F138 PolarHBondContact O-N 2.84Å; L135-F138 PolarHBondContact O-N 3.37Å; F138-L184 HydrophobicContact CD1-CD2 4.1Å; F138-L184 HydrophobicContact CE1-CD1 3.9Å; F138-L184 HydrophobicContact CE1-CD2 4.28Å
139	I	89.6	Confident	92.9	Very high	138 Å²	138	43.5 Å²	43.5	71%	0.708	23%	0.23	S	C	*	.	H	α-helix	trans	-72.3	-44.2	176.3	-68.8	168.1	0	0	0	111	L135	L135-I139 HydrophobicContact CB-CD1 4.49Å; L135-I139 WeakPolarHBondContact O-CB 3.21Å; L135-I139 WeakPolarHBondContact O-CD1 3.28Å; L135-I139 WeakPolarHBondContact O-CG1 3.23Å; L135-I139 PolarHBondContact O-N 3.26Å
140	V	90.5	Very high	92.7	Very high	74 Å²	74	44 Å²	44	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-85.7	-41.4	-172.7	179.6	0	0	0	0	112.2	G136 R142 F186	G136-V140 WeakPolarHBondContact O-CB 3.46Å; G136-V140 WeakPolarHBondContact O-CG2 3.18Å; G136-V140 PolarHBondContact O-N 3.43Å; V140-R142 HydrophobicContact CG1-CB 3.94Å; V140-R142 PolarHBondContact O-N 2.99Å; V140-R142 VanDerWaalsContact O-N 3.14Å; V140-F186 HydrophobicContact CB-CD1 4.08Å; V140-F186 HydrophobicContact CG1-CB 4.12Å; V140-F186 HydrophobicContact CG1-CD1 4.11Å; V140-F186 HydrophobicContact CG1-CG 4.33Å; V140-F186 HydrophobicContact CG2-CD1 3.76Å; V140-F186 HydrophobicContact CG2-CE1 4.21Å
141	G	88.5	Confident	92.6	Very high	23 Å²	23	39.7 Å²	39.7	24%	0.237	21%	0.212	C	C	.	.			trans	59.5	25.7	176.8	0	0	0	0	0	115.1	K137 R183	K137-G141 PolarHBondContact O-N 3.42Å; G141-R183 CarbonylContact C-O 3.57Å; G141-R183 VanDerWaalsContact C-O 3.28Å
142	R	92.5	Very high	92.4	Very high	90 Å²	90	40.4 Å²	40.4	34%	0.34	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-66.5	135.8	-178.4	-179.1	-171	-178.6	167.8	9.4	110.8	V140 R183 S185 F186 H244 S246 D247	V140-R142 HydrophobicContact CG1-CB 3.94Å; V140-R142 PolarHBondContact O-N 2.99Å; V140-R142 VanDerWaalsContact O-N 3.14Å; R142-R183 CarbonylContact O-C 3.29Å; R142-S185 WeakPolarHBondContact CB-OG 3.49Å; R142-S185 WeakPolarHBondContact CD-OG 3.38Å; R142-S185 WeakPolarHBondContact CG-OG 3.41Å; R142-S185 VanDerWaalsContact O-CB 3.26Å; R142-S185 WeakPolarHBondContact O-CB 3.36Å; R142-S185 PolarHBondContact O-N 2.98Å; R142-S185 PolarHBondContact O-OG 3.4Å; R142-F186 HydrophobicContact CB-CB 4.12Å; R142-H244 PolarHBondContact NE-CD2 3.33Å; R142-H244 VanDerWaalsContact NE-CD2 3.26Å; R142-H244 PolarHBondContact NH2-CD2 2.98Å; R142-S246 PolarHBondContact NH1-OG 3.24Å; R142-D247 IonicContact CZ-OD1 3.31Å; R142-D247 IonicContact NE-OD1 3.97Å; R142-D247 IonicContact NH1-OD1 2.88Å; R142-D247 PolarHBondContact NH1-OD1 3.32Å
143	L	94.3	Very high	92.2	Very high	16 Å²	16	38.6 Å²	38.6	8%	0.084	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-65.9	148.3	176.3	-58.8	179.1	0	0	0	112.7	F45 I52 F147 R183 S185 H244	F45-L143 HydrophobicContact CB-CD1 3.86Å; F45-L143 HydrophobicContact CD1-CD1 4.41Å; I52-L143 HydrophobicContact CD1-CD1 4.23Å; I52-L143 HydrophobicContact CG2-CB 4.12Å; L143-F147 HydrophobicContact CB-CB 4.21Å; L143-F147 HydrophobicContact CB-CG 4.23Å; L143-F147 HydrophobicContact CD1-CD1 3.79Å; L143-F147 HydrophobicContact CD1-CE1 3.92Å; L143-F147 HydrophobicContact CD1-CG 4.22Å; L143-F147 HydrophobicContact CD1-CZ 4.47Å; L143-F147 HydrophobicContact CD2-CD1 4.21Å; L143-F147 HydrophobicContact CD2-CD2 3.73Å; L143-F147 HydrophobicContact CD2-CE1 4.2Å; L143-F147 HydrophobicContact CD2-CE2 3.73Å; L143-F147 HydrophobicContact CD2-CG 3.98Å; L143-F147 HydrophobicContact CD2-CZ 3.96Å; L143-F147 HydrophobicContact CG-CD1 4.41Å; L143-F147 HydrophobicContact CG-CG 4.37Å; L143-R183 HydrophobicContact CD2-CB 4.35Å; L143-R183 HydrophobicContact CD2-CG 4.01Å; L143-S185 WeakPolarHBondContact O-CB 3.48Å; L143-S185 PolarHBondContact O-OG 3.15Å; L143-H244 PolarHBondContact O-NE2 3.31Å
144	R	95.4	Very high	91.9	Very high	14 Å²	14	43 Å²	43	5%	0.053	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-82.7	160.2	176.3	-72.7	-171.3	179.9	175.2	14.1	112.4	S146 F147 D181 A182 L184 K242	R144-S146 PolarHBondContact O-N 3.42Å; R144-S146 VanDerWaalsContact O-N 3.1Å; R144-F147 VanDerWaalsContact O-CB 3.23Å; R144-F147 WeakPolarHBondContact O-CB 3.36Å; R144-F147 PolarHBondContact O-N 3.39Å; R144-D181 WeakPolarHBondContact CD-O 3.43Å; R144-D181 IonicContact CZ-OD1 2.86Å; R144-D181 VanDerWaalsContact CZ-OD1 3.29Å; R144-D181 IonicContact CZ-OD2 2.91Å; R144-D181 PolarHBondContact NE-O 3.46Å; R144-D181 IonicContact NH1-OD1 3.98Å; R144-D181 PolarHBondContact NH1-OD1 3.36Å; R144-D181 IonicContact NH1-OD2 2.96Å; R144-D181 PolarHBondContact NH1-OD2 2.8Å; R144-D181 VanDerWaalsContact NH2-CG 3.34Å; R144-D181 PolarHBondContact NH2-O 2.86Å; R144-D181 IonicContact NH2-OD1 3.6Å; R144-D181 PolarHBondContact NH2-OD1 3.37Å; R144-D181 IonicContact NH2-OD2 3.44Å; R144-A182 WeakPolarHBondContact CB-O 3.45Å; R144-A182 PolarHBondContact N-O 2.97Å; R144-L184 PolarHBondContact NE-O 3.37Å; R144-L184 PolarHBondContact NH2-O 2.99Å; R144-K242 WeakPolarHBondContact CD-O 3.16Å; R144-K242 WeakPolarHBondContact CG-O 3.4Å
145	P	96.2	Very high	91.5	Very high	5 Å²	5	43 Å²	43	3%	0.032	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.7	177.6	-23.9	32	0	0	0	115.2	S51 I52 R53 Y54 F241	S51-P145 VanDerWaalsContact O-CA 3.22Å; S51-P145 WeakPolarHBondContact O-CA 3.36Å; I52-P145 CarbonylContact C-O 3.51Å; I52-P145 WeakPolarHBondContact CA-O 3.44Å; I52-P145 VanDerWaalsContact O-O 3.13Å; R53-P145 PolarHBondContact N-O 3.4Å; Y54-P145 WeakPolarHBondContact CB-O 3.47Å; Y54-P145 HydrophobicContact CD2-CB 3.85Å; Y54-P145 HydrophobicContact CG-CB 4.36Å; Y54-P145 PolarHBondContact N-O 3.38Å; P145-F241 HydrophobicContact CB-CB 4.34Å
146	S	94.3	Very high	91	Very high	3 Å²	3	41 Å²	41	2%	0.021	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	19.5	178.5	75.3	0	0	0	0	114	Y54 R144 V150	Y54-S146 VanDerWaalsContact O-CA 3.31Å; Y54-S146 WeakPolarHBondContact O-CA 3.3Å; R144-S146 PolarHBondContact O-N 3.42Å; R144-S146 VanDerWaalsContact O-N 3.1Å; S146-V150 WeakPolarHBondContact O-CG2 3.17Å; S146-V150 PolarHBondContact O-N 3.46Å
147	F	94.5	Very high	90.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-45.5	-172.1	172.4	-102.2	0	0	0	113	F45 I52 L143 R144 D149 V150 C151 F169 A182 R183	F45-F147 AromaticContact CD1-CE1 3.98Å; F45-F147 HydrophobicContact CD1-CE1 3.98Å; F45-F147 HydrophobicContact CE1-CE1 4.07Å; I52-F147 HydrophobicContact CB-CB 4.42Å; I52-F147 HydrophobicContact CD1-CD1 4.45Å; L143-F147 HydrophobicContact CB-CB 4.21Å; L143-F147 HydrophobicContact CB-CG 4.23Å; L143-F147 HydrophobicContact CD1-CD1 3.79Å; L143-F147 HydrophobicContact CD1-CE1 3.92Å; L143-F147 HydrophobicContact CD1-CG 4.22Å; L143-F147 HydrophobicContact CD1-CZ 4.47Å; L143-F147 HydrophobicContact CD2-CD1 4.21Å; L143-F147 HydrophobicContact CD2-CD2 3.73Å; L143-F147 HydrophobicContact CD2-CE1 4.2Å; L143-F147 HydrophobicContact CD2-CE2 3.73Å; L143-F147 HydrophobicContact CD2-CG 3.98Å; L143-F147 HydrophobicContact CD2-CZ 3.96Å; L143-F147 HydrophobicContact CG-CD1 4.41Å; L143-F147 HydrophobicContact CG-CG 4.37Å; R144-F147 VanDerWaalsContact O-CB 3.23Å; R144-F147 WeakPolarHBondContact O-CB 3.36Å; R144-F147 PolarHBondContact O-N 3.39Å; F147-D149 PolarHBondContact O-N 3.46Å; F147-V150 PolarHBondContact O-N 2.94Å; F147-C151 HydrophobicContact CD2-CB 4.47Å; F147-C151 HydrophobicContact CE1-CB 4.3Å; F147-C151 HydrophobicContact CE2-CB 4.01Å; F147-C151 HydrophobicContact CZ-CB 3.93Å; F147-C151 WeakPolarHBondContact O-CB 3.41Å; F147-C151 PolarHBondContact O-N 2.87Å; F147-F169 HydrophobicContact CE1-CE2 4.26Å; F147-F169 HydrophobicContact CE1-CZ 4.17Å; F147-F169 AromaticContact CZ-CE2 3.77Å; F147-F169 HydrophobicContact CZ-CE2 3.77Å; F147-F169 AromaticContact CZ-CZ 3.75Å; F147-F169 HydrophobicContact CZ-CZ 3.75Å; F147-A182 HydrophobicContact CD2-CB 3.83Å; F147-R183 HydrophobicContact CD2-CG 4.36Å; F147-R183 HydrophobicContact CE2-CG 3.78Å
148	L	92.8	Very high	90.1	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-67.7	-36.5	-175.1	-69.8	173.4	0	0	0	112.8	F45 I52 R53 V150 R152 P153 Y157	F45-L148 HydrophobicContact CD2-CD2 4.16Å; F45-L148 HydrophobicContact CE1-CD2 4.37Å; F45-L148 HydrophobicContact CE2-CD2 3.72Å; F45-L148 HydrophobicContact CZ-CD2 3.85Å; I52-L148 HydrophobicContact CD1-CD1 3.93Å; I52-L148 HydrophobicContact CD1-CD2 4.36Å; I52-L148 HydrophobicContact CD1-CG 3.97Å; I52-L148 HydrophobicContact CG1-CD1 3.78Å; I52-L148 HydrophobicContact CG1-CG 4.07Å; I52-L148 WeakPolarHBondContact O-CB 3.22Å; I52-L148 WeakPolarHBondContact O-CG 3.49Å; I52-L148 PolarHBondContact O-N 3.18Å; I52-L148 VanDerWaalsContact O-N 3.15Å; R53-L148 HydrophobicContact CB-CD1 4.49Å; R53-L148 HydrophobicContact CG-CD1 3.38Å; L148-V150 VanDerWaalsContact C-N 3.33Å; L148-R152 WeakPolarHBondContact O-CA 3.47Å; L148-R152 PolarHBondContact O-N 3.04Å; L148-P153 HydrophobicContact CD2-CG 3.8Å; L148-Y157 WeakPolarHBondContact O-CE2 3.32Å
149	D	93	Very high	89.7	Confident	46 Å²	46	49.3 Å²	49.3	25%	0.246	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-33.5	176.1	-176.3	42.5	0	0	0	112.3	Y56 F147 R152	Y56-D149 VanDerWaalsContact CB-OD2 3.23Å; Y56-D149 WeakPolarHBondContact CB-OD2 3.48Å; Y56-D149 PolarHBondContact N-OD2 2.93Å; F147-D149 PolarHBondContact O-N 3.46Å; D149-R152 WeakPolarHBondContact O-CG 3.27Å; D149-R152 PolarHBondContact O-NE 3.14Å; D149-R152 IonicContact OD1-NH2 2.88Å
150	V	93.4	Very high	89.3	Confident	10 Å²	10	44.6 Å²	44.6	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-76.7	-46.9	177.7	172.1	0	0	0	0	112.3	Y56 S146 F147 L148 S173 R178 I179 A182	Y56-V150 HydrophobicContact CD2-CG2 3.39Å; Y56-V150 HydrophobicContact CE2-CG2 4.14Å; Y56-V150 HydrophobicContact CG-CG2 3.99Å; S146-V150 WeakPolarHBondContact O-CG2 3.17Å; S146-V150 PolarHBondContact O-N 3.46Å; F147-V150 PolarHBondContact O-N 2.94Å; L148-V150 VanDerWaalsContact C-N 3.33Å; V150-S173 WeakPolarHBondContact O-CB 3.38Å; V150-S173 PolarHBondContact O-OG 3.17Å; V150-R178 HydrophobicContact CG1-CB 3.65Å; V150-I179 HydrophobicContact CG1-CG1 4.24Å; V150-A182 HydrophobicContact CB-CB 4.24Å; V150-A182 HydrophobicContact CG1-CB 4.06Å
151	C	92.2	Very high	88.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-79.2	-41.1	-175.8	170	0	0	0	0	112.2	F147 C171 T172 S173	F147-C151 HydrophobicContact CD2-CB 4.47Å; F147-C151 HydrophobicContact CE1-CB 4.3Å; F147-C151 HydrophobicContact CE2-CB 4.01Å; F147-C151 HydrophobicContact CZ-CB 3.93Å; F147-C151 WeakPolarHBondContact O-CB 3.41Å; F147-C151 PolarHBondContact O-N 2.87Å; C151-C171 HydrophobicContact CB-CB 4.02Å; C151-C171 WeakPolarHBondContact CB-SG 3.28Å; C151-C171 CarbonylContact O-C 3.46Å; C151-C171 VanDerWaalsContact O-CA 3.24Å; C151-C171 WeakPolarHBondContact O-CA 3.28Å; C151-C171 WeakPolarHBondContact O-CB 3.5Å; C151-C171 WeakPolarHBondContact SG-CA 3.46Å; C151-C171 WeakPolarHBondContact SG-CB 3.33Å; C151-C171 CovalentContact SG-SG 2.04Å; C151-C171 PolarHBondContact SG-SG 3.29Å; C151-T172 PolarHBondContact O-N 3.16Å; C151-T172 VanDerWaalsContact O-N 3.08Å; C151-S173 PolarHBondContact O-N 3.32Å
152	R	91.9	Very high	88.1	Confident	121 Å²	121	51.3 Å²	51.3	46%	0.457	28%	0.277	S	S	.	.			trans	48.3	70.9	-172.4	-61.1	-179.3	-175.1	175.4	-3	111.1	L148 D149 Y157 T172	L148-R152 WeakPolarHBondContact O-CA 3.47Å; L148-R152 PolarHBondContact O-N 3.04Å; D149-R152 WeakPolarHBondContact O-CG 3.27Å; D149-R152 PolarHBondContact O-NE 3.14Å; D149-R152 IonicContact OD1-NH2 2.88Å; R152-Y157 HydrophobicContact CB-CE2 4.46Å; R152-Y157 HydrophobicContact CG-CE2 4.16Å; R152-T172 WeakPolarHBondContact CB-OG1 3.34Å; R152-T172 WeakPolarHBondContact O-CB 3.5Å; R152-T172 WeakPolarHBondContact O-CG2 3.27Å; R152-T172 PolarHBondContact O-N 2.92Å; R152-T172 PolarHBondContact O-OG1 2.84Å
153	P	90.3	Very high	87.7	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.026	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-59.7	145.7	-177.3	25.3	-33.9	0	0	0	111.2	F45 L148 V155 Y157 F169 T170	F45-P153 HydrophobicContact CZ-CB 4.15Å; F45-P153 HydrophobicContact CZ-CG 3.87Å; L148-P153 HydrophobicContact CD2-CG 3.8Å; P153-V155 PolarHBondContact O-N 3.05Å; P153-Y157 HydrophobicContact CG-CD2 4.4Å; P153-Y157 WeakPolarHBondContact O-CB 3.19Å; P153-F169 HydrophobicContact CB-CB 4.15Å; P153-F169 HydrophobicContact CB-CD2 4Å; P153-F169 HydrophobicContact CB-CG 4.32Å; P153-T170 WeakPolarHBondContact CA-O 3.21Å
154	N	87.7	Confident	87.3	Confident	94 Å²	94	58.3 Å²	58.3	50%	0.503	32%	0.316	S	S	.	.	S	Bend	trans	-66.3	-18.6	175.8	66.3	-41.2	0	0	0	113.6	T170 T172	N154-T170 PolarHBondContact N-O 3.25Å; N154-T170 PolarHBondContact ND2-OG1 3Å; N154-T170 PolarHBondContact OD1-N 3Å; N154-T170 PolarHBondContact OD1-O 3.08Å; N154-T170 PolarHBondContact OD1-OG1 3.48Å; N154-T172 HydrophobicContact CB-CG2 4.41Å
155	V	85.5	Confident	86.9	Confident	55 Å²	55	63.5 Å²	63.5	33%	0.333	34%	0.337	S	S	.	.	S	Bend	trans	-116.9	139.2	-179.5	-77.1	0	0	0	0	111.2	P153 Y157 I166 F169	P153-V155 PolarHBondContact O-N 3.05Å; V155-Y157 PolarHBondContact O-N 3.46Å; V155-I166 HydrophobicContact CG2-CD1 4.47Å; V155-I166 HydrophobicContact CG2-CG2 3.84Å; V155-F169 HydrophobicContact CG2-CB 3.63Å
156	A	79	Confident	86.4	Confident	25 Å²	25	63.9 Å²	63.9	21%	0.207	34%	0.338	C	S	.	.	S	Bend	trans	51.4	24.7	175.1	0	0	0	0	0	117.1	C47 I166	C47-A156 HydrophobicContact CB-CB 3.56Å; A156-I166 HydrophobicContact CB-CD1 3.33Å
157	Y	82	Confident	86.1	Confident	89 Å²	89	66 Å²	66	35%	0.349	35%	0.353	S	S	.	.	S	Bend	trans	-69.3	-48.6	178.1	177.4	-118.7	0	0	0	112.9	L148 R152 P153 V155	L148-Y157 WeakPolarHBondContact O-CE2 3.32Å; R152-Y157 HydrophobicContact CB-CE2 4.46Å; R152-Y157 HydrophobicContact CG-CE2 4.16Å; P153-Y157 HydrophobicContact CG-CD2 4.4Å; P153-Y157 WeakPolarHBondContact O-CB 3.19Å; V155-Y157 PolarHBondContact O-N 3.46Å
158	T	80.4	Confident	85.6	Confident	112 Å²	112	72.2 Å²	72.2	69%	0.687	39%	0.386	S	S	*	.	S	Bend	trans	-95.6	-49.4	-176.9	47.1	0	0	0	0	112.7
159	T	80	Confident	85.3	Confident	109 Å²	109	72.3 Å²	72.3	67%	0.669	39%	0.386	S	S	*	.			trans	-112.4	117.5	-177.4	45.8	0	0	0	0	110.4
160	C	80.6	Confident	85.1	Confident	39 Å²	39	74.4 Å²	74.4	26%	0.264	40%	0.401	S	S	.	.			trans	-126.5	111.7	170.8	170	0	0	0	0	106.2	C47 D48 D162	C47-C160 HydrophobicContact CB-CB 3.7Å; C47-C160 WeakPolarHBondContact CB-SG 3.35Å; C47-C160 WeakPolarHBondContact SG-CB 3.34Å; C47-C160 CovalentContact SG-SG 2.04Å; C47-C160 PolarHBondContact SG-SG 3.49Å; D48-C160 PolarHBondContact N-SG 3.42Å; C160-D162 PolarHBondContact SG-O 3.09Å
161	S	74	Confident	84.9	Confident	114 Å²	114	75.5 Å²	75.5	80%	0.797	41%	0.409	S	S	*	.			trans	-93.7	-26.2	-177.6	-55.3	0	0	0	0	112.5
162	D	79.5	Confident	84.8	Confident	123 Å²	123	80 Å²	80	66%	0.658	44%	0.436	S	S	*	.	S	Bend	trans	-132.6	162.5	-171.3	-62.3	-48.6	0	0	0	111.2	C47 C160 L164	C47-D162 PolarHBondContact SG-O 3.16Å; C160-D162 PolarHBondContact SG-O 3.09Å; D162-L164 PolarHBondContact O-N 3.32Å
163	H	84.3	Confident	84.7	Confident	152 Å²	152	76 Å²	76	70%	0.704	43%	0.426	S	S	*	.			trans	-70	66.2	170.7	-68.6	-66.3	0	0	0	111.8	D48	D48-H163 IonicContact OD1-ND1 3.88Å; D48-H163 PolarHBondContact OD1-ND1 3.19Å; D48-H163 IonicContact OD2-CE1 3.81Å; D48-H163 PolarHBondContact OD2-CE1 2.73Å; D48-H163 IonicContact OD2-CG 3.77Å; D48-H163 IonicContact OD2-ND1 3.39Å; D48-H163 PolarHBondContact OD2-ND1 3.21Å
164	L	86.3	Confident	84.7	Confident	101 Å²	101	81.4 Å²	81.4	53%	0.529	46%	0.464	S	S	.	.			trans	-89.9	129	-176.4	-176.8	65.8	0	0	0	111.4	Y46 C47 D162 I166	Y46-L164 WeakPolarHBondContact CA-O 3.46Å; C47-L164 PolarHBondContact N-O 2.79Å; D162-L164 PolarHBondContact O-N 3.32Å; L164-I166 HydrophobicContact CD2-CG1 4.21Å; L164-I166 HydrophobicContact CG-CG1 4.2Å
165	Y	87.2	Confident	84.8	Confident	124 Å²	124	79.4 Å²	79.4	49%	0.486	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.1	170.2	-173.4	-100.9	0	0	0	110.7	S44 Y46	S44-Y165 WeakPolarHBondContact CB-OH 3.16Å; S44-Y165 PolarHBondContact OG-OH 3.44Å; Y46-Y165 HydrophobicContact CD1-CD2 4.18Å; Y46-Y165 HydrophobicContact CD2-CD2 4.14Å; Y46-Y165 AromaticContact CE1-CD2 3.82Å; Y46-Y165 HydrophobicContact CE1-CD2 3.82Å; Y46-Y165 HydrophobicContact CE1-CG 4.29Å; Y46-Y165 AromaticContact CE2-CD2 3.78Å; Y46-Y165 HydrophobicContact CE2-CD2 3.78Å; Y46-Y165 HydrophobicContact CE2-CE2 4.22Å; Y46-Y165 HydrophobicContact CG-CD2 4.33Å; Y46-Y165 AromaticContact CZ-CD2 3.61Å
166	I	86.2	Confident	85	Confident	12 Å²	12	82.5 Å²	82.5	6%	0.062	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112.2	-177.3	-57.8	177.7	0	0	0	108.9	S44 F45 C47 V155 A156 L164 F169	S44-I166 VanDerWaalsContact CA-O 3.22Å; S44-I166 WeakPolarHBondContact CA-O 3.38Å; S44-I166 WeakPolarHBondContact CB-O 3.41Å; F45-I166 HydrophobicContact CE2-CB 4.49Å; F45-I166 HydrophobicContact CE2-CD1 4.13Å; F45-I166 HydrophobicContact CZ-CB 4.36Å; F45-I166 HydrophobicContact CZ-CD1 4.35Å; F45-I166 HydrophobicContact CZ-CG2 4.35Å; F45-I166 PolarHBondContact N-O 2.94Å; F45-I166 VanDerWaalsContact N-O 3.1Å; F45-I166 PolarHBondContact O-N 3.37Å; C47-I166 HydrophobicContact CB-CD1 3.89Å; V155-I166 HydrophobicContact CG2-CD1 4.47Å; V155-I166 HydrophobicContact CG2-CG2 3.84Å; A156-I166 HydrophobicContact CB-CD1 3.33Å; L164-I166 HydrophobicContact CD2-CG1 4.21Å; L164-I166 HydrophobicContact CG-CG1 4.2Å; I166-F169 HydrophobicContact CG2-CB 4.12Å; I166-F169 HydrophobicContact CG2-CD1 4.04Å; I166-F169 HydrophobicContact CG2-CG 4.49Å
167	S	86.4	Confident	85.5	Confident	48 Å²	48	91.5 Å²	91.5	34%	0.336	50%	0.496	S	S	.	.			trans	-95.7	-37.1	172.8	51.4	0	0	0	0	112.8	S44	S44-S167 WeakPolarHBondContact OG-CA 3.29Å
168	D	84.8	Confident	85.8	Confident	130 Å²	130	92.2 Å²	92.2	70%	0.695	50%	0.499	S	S	*	.			trans	-109.7	106.1	-172.3	-62.2	-54.4	0	0	0	110.6
169	F	86.4	Confident	86.4	Confident	11 Å²	11	87.4 Å²	87.4	5%	0.048	47%	0.468	C	S	.	.			trans	-146.8	155.8	177.5	61.8	-85.4	0	0	0	110.2	G43 F45 F147 P153 V155 I166	G43-F169 VanDerWaalsContact O-CE1 3.3Å; G43-F169 WeakPolarHBondContact O-CE1 3.41Å; G43-F169 WeakPolarHBondContact O-CZ 3.24Å; F45-F169 HydrophobicContact CD1-CD1 4.33Å; F45-F169 AromaticContact CD1-CE1 3.86Å; F45-F169 HydrophobicContact CD1-CE1 3.86Å; F45-F169 HydrophobicContact CD1-CZ 4.14Å; F45-F169 AromaticContact CE1-CD1 3.64Å; F45-F169 HydrophobicContact CE1-CD1 3.64Å; F45-F169 HydrophobicContact CE1-CD2 4.22Å; F45-F169 AromaticContact CE1-CE1 3.53Å; F45-F169 HydrophobicContact CE1-CE1 3.53Å; F45-F169 HydrophobicContact CE1-CE2 4.14Å; F45-F169 AromaticContact CE1-CG 3.98Å; F45-F169 HydrophobicContact CE1-CG 3.98Å; F45-F169 AromaticContact CE1-CZ 3.79Å; F45-F169 HydrophobicContact CE1-CZ 3.79Å; F45-F169 HydrophobicContact CZ-CD1 4.49Å; F147-F169 HydrophobicContact CE1-CE2 4.26Å; F147-F169 HydrophobicContact CE1-CZ 4.17Å; F147-F169 AromaticContact CZ-CE2 3.77Å; F147-F169 HydrophobicContact CZ-CE2 3.77Å; F147-F169 AromaticContact CZ-CZ 3.75Å; F147-F169 HydrophobicContact CZ-CZ 3.75Å; P153-F169 HydrophobicContact CB-CB 4.15Å; P153-F169 HydrophobicContact CB-CD2 4Å; P153-F169 HydrophobicContact CB-CG 4.32Å; V155-F169 HydrophobicContact CG2-CB 3.63Å; I166-F169 HydrophobicContact CG2-CB 4.12Å; I166-F169 HydrophobicContact CG2-CD1 4.04Å; I166-F169 HydrophobicContact CG2-CG 4.49Å
170	T	88.8	Confident	86.9	Confident	90 Å²	90	88.1 Å²	88.1	55%	0.552	46%	0.463	S	S	*	.			trans	-114.3	130.2	171	53.5	0	0	0	0	109.2	P153 N154	P153-T170 WeakPolarHBondContact CA-O 3.21Å; N154-T170 PolarHBondContact N-O 3.25Å; N154-T170 PolarHBondContact ND2-OG1 3Å; N154-T170 PolarHBondContact OD1-N 3Å; N154-T170 PolarHBondContact OD1-O 3.08Å; N154-T170 PolarHBondContact OD1-OG1 3.48Å
171	C	90.1	Very high	87.3	Confident	33 Å²	33	89.6 Å²	89.6	22%	0.223	47%	0.468	C	S	.	.	B	Isolated β-bridge	trans	-71.8	131.5	172.4	-62.5	0	0	0	0	108.9	C151 I179	C151-C171 HydrophobicContact CB-CB 4.02Å; C151-C171 WeakPolarHBondContact CB-SG 3.28Å; C151-C171 CarbonylContact O-C 3.46Å; C151-C171 VanDerWaalsContact O-CA 3.24Å; C151-C171 WeakPolarHBondContact O-CA 3.28Å; C151-C171 WeakPolarHBondContact O-CB 3.5Å; C151-C171 WeakPolarHBondContact SG-CA 3.46Å; C151-C171 WeakPolarHBondContact SG-CB 3.33Å; C151-C171 CovalentContact SG-SG 2.04Å; C151-C171 PolarHBondContact SG-SG 3.29Å; C171-I179 HydrophobicContact CB-CD1 3.68Å; C171-I179 HydrophobicContact CB-CG1 4.36Å
172	T	90.7	Very high	88.2	Confident	94 Å²	94	84.3 Å²	84.3	58%	0.577	43%	0.431	S	S	*	.			trans	-83.8	-18.2	176.8	58.7	0	0	0	0	112.6	C151 R152 N154	C151-T172 PolarHBondContact O-N 3.16Å; C151-T172 VanDerWaalsContact O-N 3.08Å; R152-T172 WeakPolarHBondContact CB-OG1 3.34Å; R152-T172 WeakPolarHBondContact O-CB 3.5Å; R152-T172 WeakPolarHBondContact O-CG2 3.27Å; R152-T172 PolarHBondContact O-N 2.92Å; R152-T172 PolarHBondContact O-OG1 2.84Å; N154-T172 HydrophobicContact CB-CG2 4.41Å
173	S	89.4	Confident	88.8	Confident	36 Å²	36	79.3 Å²	79.3	25%	0.252	40%	0.403	S	S	.	.			trans	-69.4	139.4	176.6	-179.2	0	0	0	0	112.1	V150 C151 I179	V150-S173 WeakPolarHBondContact O-CB 3.38Å; V150-S173 PolarHBondContact O-OG 3.17Å; C151-S173 PolarHBondContact O-N 3.32Å; S173-I179 WeakPolarHBondContact O-CD1 3.34Å
174	S	89.4	Confident	89.2	Confident	118 Å²	118	73.2 Å²	73.2	83%	0.825	38%	0.375	S	S	*	.	S	Bend	trans	-83.4	-14	179.1	55.2	0	0	0	0	113.8	L176	S174-L176 PolarHBondContact O-N 3.03Å
175	D	90.6	Very high	89.5	Confident	53 Å²	53	68.4 Å²	68.4	28%	0.283	35%	0.35	S	S	.	.			trans	-81.3	80.9	-177.8	-166.9	-26	0	0	0	111.4	R177 R178 I179	D175-R177 PolarHBondContact O-N 2.96Å; D175-R177 VanDerWaalsContact O-N 3.16Å; D175-R177 WeakPolarHBondContact OD1-CB 3.44Å; D175-R177 PolarHBondContact OD1-N 3.45Å; D175-R177 VanDerWaalsContact OD1-N 3.16Å; D175-R178 HydrophobicContact CB-CB 4.17Å; D175-R178 HydrophobicContact CB-CG 4.35Å; D175-R178 VanDerWaalsContact CG-CG 3.47Å; D175-R178 PolarHBondContact O-N 3.27Å; D175-R178 PolarHBondContact OD1-N 2.99Å; D175-R178 WeakPolarHBondContact OD2-CD 3.33Å; D175-R178 WeakPolarHBondContact OD2-CG 3.46Å; D175-R178 IonicContact OD2-CZ 3.58Å; D175-R178 IonicContact OD2-NE 2.78Å; D175-R178 PolarHBondContact OD2-NE 3.47Å; D175-I179 WeakPolarHBondContact O-CG1 3.34Å; D175-I179 PolarHBondContact O-N 3.06Å
176	L	88.9	Confident	89.9	Confident	119 Å²	119	65.7 Å²	65.7	62%	0.623	34%	0.341	S	S	*	.	H	α-helix	trans	-57	-29.1	178.4	-63.2	179.5	0	0	0	113	S174 I179 K180	S174-L176 PolarHBondContact O-N 3.03Å; L176-I179 HydrophobicContact CD2-CD1 4.47Å; L176-K180 WeakPolarHBondContact O-CB 3.34Å; L176-K180 VanDerWaalsContact O-CG 3.28Å; L176-K180 WeakPolarHBondContact O-CG 3.33Å; L176-K180 PolarHBondContact O-N 3.26Å
177	R	89.1	Confident	90.4	Very high	214 Å²	214	65.3 Å²	65.3	81%	0.808	34%	0.34	S	S	*	.	H	α-helix	trans	-70.8	-47.3	179.6	-179.1	-178.9	175.3	-178.3	-0.5	110.3	D175 I179 K180 D181	D175-R177 PolarHBondContact O-N 2.96Å; D175-R177 VanDerWaalsContact O-N 3.16Å; D175-R177 WeakPolarHBondContact OD1-CB 3.44Å; D175-R177 PolarHBondContact OD1-N 3.45Å; D175-R177 VanDerWaalsContact OD1-N 3.16Å; R177-I179 VanDerWaalsContact C-N 3.33Å; R177-K180 PolarHBondContact O-N 3.47Å; R177-D181 WeakPolarHBondContact O-CB 3.47Å; R177-D181 PolarHBondContact O-N 3.42Å
178	R	89.9	Confident	90.9	Very high	104 Å²	104	63 Å²	63	39%	0.392	32%	0.324	S	S	.	.	H	α-helix	trans	-64.8	-38.3	175.8	-71.8	-179.9	-169.2	-165.9	-8.8	111.7	E58 V150 D175 D181 A182	E58-R178 IonicContact OE1-NH2 3.44Å; V150-R178 HydrophobicContact CG1-CB 3.65Å; D175-R178 HydrophobicContact CB-CB 4.17Å; D175-R178 HydrophobicContact CB-CG 4.35Å; D175-R178 VanDerWaalsContact CG-CG 3.47Å; D175-R178 PolarHBondContact O-N 3.27Å; D175-R178 PolarHBondContact OD1-N 2.99Å; D175-R178 WeakPolarHBondContact OD2-CD 3.33Å; D175-R178 WeakPolarHBondContact OD2-CG 3.46Å; D175-R178 IonicContact OD2-CZ 3.58Å; D175-R178 IonicContact OD2-NE 2.78Å; D175-R178 PolarHBondContact OD2-NE 3.47Å; R178-D181 PolarHBondContact O-N 3.42Å; R178-A182 VanDerWaalsContact O-CB 3.23Å; R178-A182 WeakPolarHBondContact O-CB 3.42Å; R178-A182 PolarHBondContact O-N 2.97Å
179	I	91.7	Very high	91.5	Very high	11 Å²	11	57.2 Å²	57.2	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-48.7	176.5	-67.8	163.5	0	0	0	110.7	V150 C171 S173 D175 L176 R177 D181 A182 R183	V150-I179 HydrophobicContact CG1-CG1 4.24Å; C171-I179 HydrophobicContact CB-CD1 3.68Å; C171-I179 HydrophobicContact CB-CG1 4.36Å; S173-I179 WeakPolarHBondContact O-CD1 3.34Å; D175-I179 WeakPolarHBondContact O-CG1 3.34Å; D175-I179 PolarHBondContact O-N 3.06Å; L176-I179 HydrophobicContact CD2-CD1 4.47Å; R177-I179 VanDerWaalsContact C-N 3.33Å; I179-D181 VanDerWaalsContact C-N 3.34Å; I179-D181 PolarHBondContact O-N 3.44Å; I179-A182 PolarHBondContact O-N 2.83Å; I179-R183 WeakPolarHBondContact O-CG 3.33Å; I179-R183 PolarHBondContact O-N 3.2Å
180	K	89.8	Confident	92	Very high	125 Å²	125	58.2 Å²	58.2	54%	0.543	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-44.1	176.6	-74.8	176.9	179.3	-171.8	0	111.9	L176 R177 A182 R183	L176-K180 WeakPolarHBondContact O-CB 3.34Å; L176-K180 VanDerWaalsContact O-CG 3.28Å; L176-K180 WeakPolarHBondContact O-CG 3.33Å; L176-K180 PolarHBondContact O-N 3.26Å; R177-K180 PolarHBondContact O-N 3.47Å; K180-A182 VanDerWaalsContact C-N 3.33Å; K180-A182 PolarHBondContact O-N 3.14Å; K180-R183 PolarHBondContact O-N 2.74Å
181	D	90.3	Very high	92.4	Very high	70 Å²	70	54 Å²	54	37%	0.374	27%	0.273	S	S	.	.	H	α-helix	trans	-65.1	-36.5	178.2	-172	51.3	0	0	0	112.3	R144 R177 R178 I179 R183 L184	R144-D181 WeakPolarHBondContact CD-O 3.43Å; R144-D181 IonicContact CZ-OD1 2.86Å; R144-D181 VanDerWaalsContact CZ-OD1 3.29Å; R144-D181 IonicContact CZ-OD2 2.91Å; R144-D181 PolarHBondContact NE-O 3.46Å; R144-D181 IonicContact NH1-OD1 3.98Å; R144-D181 PolarHBondContact NH1-OD1 3.36Å; R144-D181 IonicContact NH1-OD2 2.96Å; R144-D181 PolarHBondContact NH1-OD2 2.8Å; R144-D181 VanDerWaalsContact NH2-CG 3.34Å; R144-D181 PolarHBondContact NH2-O 2.86Å; R144-D181 IonicContact NH2-OD1 3.6Å; R144-D181 PolarHBondContact NH2-OD1 3.37Å; R144-D181 IonicContact NH2-OD2 3.44Å; R177-D181 WeakPolarHBondContact O-CB 3.47Å; R177-D181 PolarHBondContact O-N 3.42Å; R178-D181 PolarHBondContact O-N 3.42Å; I179-D181 VanDerWaalsContact C-N 3.34Å; I179-D181 PolarHBondContact O-N 3.44Å; D181-R183 PolarHBondContact O-N 2.96Å; D181-L184 PolarHBondContact O-N 3.46Å; D181-L184 VanDerWaalsContact O-N 3.1Å
182	A	92.7	Very high	92.8	Very high	3 Å²	3	52.4 Å²	52.4	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-66.7	-17.1	177.2	0	0	0	0	0	113.7	R144 F147 V150 R178 I179 K180	R144-A182 WeakPolarHBondContact CB-O 3.45Å; R144-A182 PolarHBondContact N-O 2.97Å; F147-A182 HydrophobicContact CD2-CB 3.83Å; V150-A182 HydrophobicContact CB-CB 4.24Å; V150-A182 HydrophobicContact CG1-CB 4.06Å; R178-A182 VanDerWaalsContact O-CB 3.23Å; R178-A182 WeakPolarHBondContact O-CB 3.42Å; R178-A182 PolarHBondContact O-N 2.97Å; I179-A182 PolarHBondContact O-N 2.83Å; K180-A182 VanDerWaalsContact C-N 3.33Å; K180-A182 PolarHBondContact O-N 3.14Å
183	R	92.3	Very high	93.2	Very high	17 Å²	17	49.4 Å²	49.4	6%	0.064	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	0.5	174.3	-64.9	178.4	178.1	-170.7	-4.3	113.7	D39 S40 N42 G141 R142 L143 F147 I179 K180 D181	D39-R183 IonicContact OD1-NH1 3.38Å; D39-R183 PolarHBondContact OD1-NH1 3.47Å; S40-R183 PolarHBondContact O-NH1 2.92Å; S40-R183 VanDerWaalsContact O-NH1 3.17Å; S40-R183 WeakPolarHBondContact OG-CD 3.37Å; N42-R183 PolarHBondContact OD1-NH1 3.06Å; N42-R183 PolarHBondContact OD1-NH2 2.73Å; G141-R183 CarbonylContact C-O 3.57Å; G141-R183 VanDerWaalsContact C-O 3.28Å; R142-R183 CarbonylContact O-C 3.29Å; L143-R183 HydrophobicContact CD2-CB 4.35Å; L143-R183 HydrophobicContact CD2-CG 4.01Å; F147-R183 HydrophobicContact CD2-CG 4.36Å; F147-R183 HydrophobicContact CE2-CG 3.78Å; I179-R183 WeakPolarHBondContact O-CG 3.33Å; I179-R183 PolarHBondContact O-N 3.2Å; K180-R183 PolarHBondContact O-N 2.74Å; D181-R183 PolarHBondContact O-N 2.96Å
184	L	91.7	Very high	93.6	Very high	25 Å²	25	47.8 Å²	47.8	13%	0.131	23%	0.229	C	C	.	.			trans	-125.8	82.3	-173.6	-59.9	173.6	0	0	0	111	K137 F138 R144 D181	K137-L184 HydrophobicContact CB-CD2 4.32Å; K137-L184 WeakPolarHBondContact O-CD2 3.36Å; F138-L184 HydrophobicContact CD1-CD2 4.1Å; F138-L184 HydrophobicContact CE1-CD1 3.9Å; F138-L184 HydrophobicContact CE1-CD2 4.28Å; R144-L184 PolarHBondContact NE-O 3.37Å; R144-L184 PolarHBondContact NH2-O 2.99Å; D181-L184 PolarHBondContact O-N 3.46Å; D181-L184 VanDerWaalsContact O-N 3.1Å
185	S	93.1	Very high	94	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	19%	0.192	C	C	.	.			trans	-98	-40.3	179.5	67	0	0	0	0	114.6	R142 L143 P187 H243 D247	R142-S185 WeakPolarHBondContact CB-OG 3.49Å; R142-S185 WeakPolarHBondContact CD-OG 3.38Å; R142-S185 WeakPolarHBondContact CG-OG 3.41Å; R142-S185 VanDerWaalsContact O-CB 3.26Å; R142-S185 WeakPolarHBondContact O-CB 3.36Å; R142-S185 PolarHBondContact O-N 2.98Å; R142-S185 PolarHBondContact O-OG 3.4Å; L143-S185 WeakPolarHBondContact O-CB 3.48Å; L143-S185 PolarHBondContact O-OG 3.15Å; S185-P187 CarbonylContact O-C 3.52Å; S185-H243 PolarHBondContact O-CE1 3.41Å; S185-H243 VanDerWaalsContact O-CE1 3.28Å; S185-H243 PolarHBondContact O-ND1 2.93Å; S185-D247 WeakPolarHBondContact CB-OD2 3.48Å; S185-D247 PolarHBondContact OG-OD2 2.99Å
186	F	94.8	Very high	94.4	Very high	66 Å²	66	39.9 Å²	39.9	29%	0.289	18%	0.178	S	C	.	.	S	Bend	trans	-106.2	130.4	-168	-177.5	-85.2	0	0	0	113.1	G136 K137 V140 R142 D247 A250	G136-F186 CarbonylContact C-O 3.39Å; G136-F186 VanDerWaalsContact C-O 3.29Å; K137-F186 WeakPolarHBondContact CA-O 3.48Å; K137-F186 WeakPolarHBondContact CG-O 2.9Å; K137-F186 PolarHBondContact N-O 2.98Å; V140-F186 HydrophobicContact CB-CD1 4.08Å; V140-F186 HydrophobicContact CG1-CB 4.12Å; V140-F186 HydrophobicContact CG1-CD1 4.11Å; V140-F186 HydrophobicContact CG1-CG 4.33Å; V140-F186 HydrophobicContact CG2-CD1 3.76Å; V140-F186 HydrophobicContact CG2-CE1 4.21Å; R142-F186 HydrophobicContact CB-CB 4.12Å; F186-D247 HydrophobicContact CB-CB 4.5Å; F186-D247 HydrophobicContact CD2-CB 4.13Å; F186-D247 WeakPolarHBondContact CD2-OD1 3.41Å; F186-A250 HydrophobicContact CD2-CB 4.34Å; F186-A250 HydrophobicContact CE2-CB 3.43Å; F186-A250 VanDerWaalsContact CE2-CB 3.43Å; F186-A250 HydrophobicContact CZ-CB 3.68Å
187	P	97.3	Very high	94.8	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.032	15%	0.148	C	C	.	.	S	Bend	cis	-80.6	169.4	-13.7	33.1	-34.7	0	0	0	112.2	T133 K137 S185 G189 A250 L254	T133-P187 HydrophobicContact CG2-CG 4.14Å; K137-P187 WeakPolarHBondContact CE-O 3.46Å; S185-P187 CarbonylContact O-C 3.52Å; P187-G189 PolarHBondContact O-N 3.48Å; P187-A250 HydrophobicContact CB-CB 4.21Å; P187-L254 HydrophobicContact CG-CD2 4.13Å
188	S	97.5	Very high	95.2	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.11	C	C	.	.			trans	-72.6	111	177.7	-177.1	0	0	0	0	111.9	H190 S191 S192 D247	S188-H190 PolarHBondContact O-N 3.39Å; S188-S191 WeakPolarHBondContact CB-OG 3.42Å; S188-S191 PolarHBondContact O-N 2.89Å; S188-S191 PolarHBondContact OG-OG 2.87Å; S188-S192 WeakPolarHBondContact O-CB 3.42Å; S188-S192 PolarHBondContact O-N 2.94Å; S188-D247 WeakPolarHBondContact CB-O 3.07Å; S188-D247 PolarHBondContact N-O 2.79Å
189	G	97	Very high	95.6	Very high	7 Å²	7	20.7 Å²	20.7	7%	0.072	10%	0.1	C	C	.	.	H	α-helix	trans	-65.1	-35.6	179.3	0	0	0	0	0	114.7	P187 S191 S192 W193	P187-G189 PolarHBondContact O-N 3.48Å; G189-S191 VanDerWaalsContact C-N 3.34Å; G189-S192 PolarHBondContact O-N 3.45Å; G189-W193 WeakPolarHBondContact O-CB 3.41Å; G189-W193 PolarHBondContact O-N 3.32Å
190	H	97	Very high	95.8	Very high	33 Å²	33	20.7 Å²	20.7	15%	0.153	10%	0.099	C	C	.	.	H	α-helix	trans	-66	-40.3	176.8	-72.8	54.5	0	0	0	111.4	V61 L66 S188 S194 V233 R237	V61-H190 PolarHBondContact O-NE2 3.02Å; L66-H190 HydrophobicContact CD2-CB 4.25Å; S188-H190 PolarHBondContact O-N 3.39Å; H190-S194 VanDerWaalsContact O-CB 3.28Å; H190-S194 WeakPolarHBondContact O-CB 3.07Å; H190-S194 PolarHBondContact O-N 3.08Å; H190-S194 PolarHBondContact O-OG 3.03Å; H190-V233 HydrophobicContact CB-CG1 4.11Å; H190-R237 HydrophobicContact CB-CG 3.89Å
191	S	98.2	Very high	96.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-68.8	-42.8	178.6	-45.9	0	0	0	0	110.9	S188 G189 S194 A195 V248	S188-S191 WeakPolarHBondContact CB-OG 3.42Å; S188-S191 PolarHBondContact O-N 2.89Å; S188-S191 PolarHBondContact OG-OG 2.87Å; G189-S191 VanDerWaalsContact C-N 3.34Å; S191-S194 PolarHBondContact O-OG 3.21Å; S191-A195 WeakPolarHBondContact O-CB 3.48Å; S191-A195 PolarHBondContact O-N 3.33Å; S191-V248 WeakPolarHBondContact OG-CG1 3.33Å
192	S	98.3	Very high	96.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.8	-53.4	175	175.2	0	0	0	0	112.8	N129 T133 S188 G189 S194 A195 Y196 G251 G255	N129-S192 VanDerWaalsContact CG-OG 3.3Å; N129-S192 PolarHBondContact ND2-OG 2.9Å; N129-S192 PolarHBondContact OD1-OG 3.47Å; T133-S192 PolarHBondContact OG1-OG 2.95Å; S188-S192 WeakPolarHBondContact O-CB 3.42Å; S188-S192 PolarHBondContact O-N 2.94Å; G189-S192 PolarHBondContact O-N 3.45Å; S192-S194 PolarHBondContact O-N 3.24Å; S192-A195 PolarHBondContact O-N 3.42Å; S192-Y196 WeakPolarHBondContact O-CB 3.21Å; S192-Y196 PolarHBondContact O-N 3.36Å; S192-G251 WeakPolarHBondContact CA-O 3.19Å; S192-G255 WeakPolarHBondContact O-CA 3.28Å
193	W	97.6	Very high	96.5	Very high	32 Å²	32	14.2 Å²	14.2	12%	0.121	7%	0.07	C	C	.	.	H	α-helix	trans	-61	-44.5	178.7	-93	96.5	0	0	0	113.5	L66 A70 F71 A126 E130 G189 A197	L66-W193 HydrophobicContact CD1-CB 4.17Å; L66-W193 HydrophobicContact CD2-CB 4Å; L66-W193 HydrophobicContact CD2-CG 4.38Å; L66-W193 HydrophobicContact CG-CB 4.4Å; A70-W193 HydrophobicContact CB-CE3 4.38Å; F71-W193 HydrophobicContact CE2-CH2 4.01Å; F71-W193 AromaticContact CE2-CZ3 3.8Å; F71-W193 HydrophobicContact CE2-CZ3 3.8Å; F71-W193 AromaticContact CZ-CH2 3.65Å; F71-W193 HydrophobicContact CZ-CH2 3.65Å; F71-W193 AromaticContact CZ-CZ3 3.67Å; F71-W193 HydrophobicContact CZ-CZ3 3.67Å; A126-W193 HydrophobicContact CB-CH2 3.63Å; A126-W193 HydrophobicContact CB-CZ3 3.67Å; E130-W193 HydrophobicContact CB-CZ2 3.83Å; E130-W193 HydrophobicContact CG-CZ2 4.23Å; E130-W193 WeakPolarHBondContact OE2-CZ2 3.26Å; G189-W193 WeakPolarHBondContact O-CB 3.41Å; G189-W193 PolarHBondContact O-N 3.32Å; W193-A197 VanDerWaalsContact O-CB 3.3Å; W193-A197 WeakPolarHBondContact O-CB 3.44Å; W193-A197 PolarHBondContact O-N 2.78Å
194	S	98.1	Very high	96.5	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.014	7%	0.069	C	C	.	.	H	α-helix	trans	-69.7	-40.6	-178.9	59.7	0	0	0	0	112.3	H190 S191 S192 M198	H190-S194 VanDerWaalsContact O-CB 3.28Å; H190-S194 WeakPolarHBondContact O-CB 3.07Å; H190-S194 PolarHBondContact O-N 3.08Å; H190-S194 PolarHBondContact O-OG 3.03Å; S191-S194 PolarHBondContact O-OG 3.21Å; S192-S194 PolarHBondContact O-N 3.24Å; S194-M198 WeakPolarHBondContact O-CB 3.2Å; S194-M198 VanDerWaalsContact O-CG 3.26Å; S194-M198 WeakPolarHBondContact O-CG 3.48Å; S194-M198 PolarHBondContact O-N 3.18Å
195	A	98.4	Very high	96.6	Very high	5 Å²	5	13 Å²	13	4%	0.041	7%	0.065	C	C	.	.	H	α-helix	trans	-60.3	-50.6	172.5	0	0	0	0	0	111.5	S191 S192 L199 L252	S191-A195 WeakPolarHBondContact O-CB 3.48Å; S191-A195 PolarHBondContact O-N 3.33Å; S192-A195 PolarHBondContact O-N 3.42Å; A195-L199 WeakPolarHBondContact O-CB 3.26Å; A195-L199 PolarHBondContact O-N 3.29Å; A195-L252 HydrophobicContact CB-CD2 3.83Å
196	Y	98.2	Very high	96.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-55	-56.4	177.5	168.1	-102.7	0	0	0	111.4	F122 G125 A126 N129 S192 M198 F200 G255 I258 A259 L262	F122-Y196 WeakPolarHBondContact CA-OH 3.36Å; F122-Y196 HydrophobicContact CD2-CE1 4.14Å; F122-Y196 AromaticContact CE2-CE1 3.86Å; F122-Y196 HydrophobicContact CE2-CE1 3.86Å; F122-Y196 HydrophobicContact CZ-CE1 4.35Å; F122-Y196 PolarHBondContact O-OH 2.78Å; G125-Y196 VanDerWaalsContact C-CZ 3.41Å; G125-Y196 VanDerWaalsContact CA-OH 3.27Å; G125-Y196 WeakPolarHBondContact CA-OH 3.16Å; A126-Y196 HydrophobicContact CB-CD1 4.48Å; A126-Y196 HydrophobicContact CB-CE1 3.77Å; A126-Y196 VanDerWaalsContact N-CZ 3.34Å; A126-Y196 PolarHBondContact N-OH 3.4Å; N129-Y196 HydrophobicContact CB-CD2 4.46Å; N129-Y196 HydrophobicContact CB-CG 4.23Å; S192-Y196 WeakPolarHBondContact O-CB 3.21Å; S192-Y196 PolarHBondContact O-N 3.36Å; Y196-M198 PolarHBondContact O-N 3.06Å; Y196-F200 HydrophobicContact CE2-CD2 4.47Å; Y196-F200 WeakPolarHBondContact O-CB 3.49Å; Y196-F200 PolarHBondContact O-N 3.45Å; Y196-G255 WeakPolarHBondContact CA-O 3.45Å; Y196-I258 HydrophobicContact CD2-CB 4.43Å; Y196-I258 HydrophobicContact CD2-CG2 4.06Å; Y196-I258 HydrophobicContact CE2-CG2 4.14Å; Y196-A259 HydrophobicContact CD2-CB 3.88Å; Y196-A259 HydrophobicContact CE2-CB 4.31Å; Y196-L262 HydrophobicContact CE2-CD1 3.9Å
197	A	97.9	Very high	96.3	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.5	-44.3	-171.9	0	0	0	0	0	112.6	A70 P74 F122 W193 T201	A70-A197 HydrophobicContact CB-CB 4.01Å; P74-A197 HydrophobicContact CG-CB 4.2Å; F122-A197 HydrophobicContact CE2-CB 4.2Å; F122-A197 HydrophobicContact CZ-CB 4.23Å; W193-A197 VanDerWaalsContact O-CB 3.3Å; W193-A197 WeakPolarHBondContact O-CB 3.44Å; W193-A197 PolarHBondContact O-N 2.78Å; A197-T201 WeakPolarHBondContact O-CB 3.42Å; A197-T201 PolarHBondContact O-N 3.37Å; A197-T201 PolarHBondContact O-OG1 3.35Å
198	M	98.1	Very high	95.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-75	-42.4	-178	-62	-60	102.4	0	0	111.3	I69 I73 P74 S194 Y196 T201 V202 L226 I229 A230	I69-M198 HydrophobicContact CG2-CE 4.5Å; I73-M198 HydrophobicContact CB-CE 4.28Å; I73-M198 HydrophobicContact CG2-CE 4.14Å; I73-M198 HydrophobicContact CG2-SD 4.36Å; P74-M198 HydrophobicContact CG-CE 3.97Å; S194-M198 WeakPolarHBondContact O-CB 3.2Å; S194-M198 VanDerWaalsContact O-CG 3.26Å; S194-M198 WeakPolarHBondContact O-CG 3.48Å; S194-M198 PolarHBondContact O-N 3.18Å; Y196-M198 PolarHBondContact O-N 3.06Å; M198-T201 WeakPolarHBondContact O-CB 3.44Å; M198-T201 PolarHBondContact O-N 3.41Å; M198-V202 VanDerWaalsContact O-CG2 3.25Å; M198-V202 WeakPolarHBondContact O-CG2 3.36Å; M198-V202 PolarHBondContact O-N 3.13Å; M198-L226 HydrophobicContact CB-CB 4.29Å; M198-L226 WeakPolarHBondContact CB-O 3.18Å; M198-L226 VanDerWaalsContact CG-O 3.27Å; M198-L226 WeakPolarHBondContact CG-O 3.48Å; M198-L226 HydrophobicContact SD-CB 4.21Å; M198-L226 HydrophobicContact SD-CD2 3.68Å; M198-I229 HydrophobicContact CG-CB 4.49Å; M198-I229 HydrophobicContact CG-CG2 4.35Å; M198-I229 HydrophobicContact SD-CB 4.22Å; M198-I229 HydrophobicContact SD-CG2 4.01Å; M198-A230 HydrophobicContact CB-CB 3.91Å; M198-A230 HydrophobicContact CG-CB 3.88Å
199	L	97.7	Very high	95.3	Very high	33 Å²	33	21.4 Å²	21.4	17%	0.173	11%	0.113	C	C	.	.	H	α-helix	trans	-67	-42	179.1	-173.7	62.5	0	0	0	111.7	A195 T201 V202 I203 L227 A259 I260	A195-L199 WeakPolarHBondContact O-CB 3.26Å; A195-L199 PolarHBondContact O-N 3.29Å; L199-T201 PolarHBondContact O-N 3.09Å; L199-V202 WeakPolarHBondContact O-CB 3.15Å; L199-V202 PolarHBondContact O-N 3.37Å; L199-V202 VanDerWaalsContact O-N 3.16Å; L199-I203 HydrophobicContact CD1-CD1 4.17Å; L199-I203 HydrophobicContact CD1-CG1 4.25Å; L199-I203 HydrophobicContact CD2-CD1 4.41Å; L199-I203 HydrophobicContact CG-CD1 3.85Å; L199-I203 HydrophobicContact CG-CG1 4.37Å; L199-I203 WeakPolarHBondContact O-CG1 3.47Å; L199-I203 PolarHBondContact O-N 2.88Å; L199-L227 HydrophobicContact CD1-CD2 4.25Å; L199-A259 HydrophobicContact CB-CB 4.31Å; L199-A259 HydrophobicContact CD2-CB 4.28Å; L199-A259 HydrophobicContact CG-CB 4.39Å; L199-I260 HydrophobicContact CD2-CD1 4.43Å; L199-I260 HydrophobicContact CD2-CG1 4.31Å
200	F	96.2	Very high	94.3	Very high	11 Å²	11	25.6 Å²	25.6	5%	0.048	14%	0.141	C	C	.	.	H	α-helix	trans	-53.2	-46.9	171.8	178.6	-84.2	0	0	0	110.7	I78 F122 Y196 V202 I203 Y204 A259 I263	I78-F200 HydrophobicContact CD1-CE1 4.12Å; F122-F200 HydrophobicContact CB-CE1 3.97Å; F122-F200 HydrophobicContact CB-CZ 4.04Å; F122-F200 AromaticContact CD2-CD1 3.61Å; F122-F200 HydrophobicContact CD2-CD1 3.61Å; F122-F200 AromaticContact CD2-CE1 3.84Å; F122-F200 HydrophobicContact CD2-CE1 3.84Å; F122-F200 HydrophobicContact CD2-CG 4.07Å; F122-F200 HydrophobicContact CD2-CZ 4.46Å; F122-F200 HydrophobicContact CE2-CD1 4.34Å; F122-F200 HydrophobicContact CG-CE1 4.38Å; Y196-F200 HydrophobicContact CE2-CD2 4.47Å; Y196-F200 WeakPolarHBondContact O-CB 3.49Å; Y196-F200 PolarHBondContact O-N 3.45Å; F200-V202 PolarHBondContact O-N 3.19Å; F200-I203 PolarHBondContact O-N 3.43Å; F200-Y204 WeakPolarHBondContact O-CB 3.19Å; F200-Y204 PolarHBondContact O-N 2.61Å; F200-A259 HydrophobicContact CB-CB 4.35Å; F200-I263 HydrophobicContact CD2-CD1 4.32Å; F200-I263 HydrophobicContact CD2-CG1 4.43Å; F200-I263 HydrophobicContact CE2-CG1 4.49Å
201	T	96	Very high	93.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.2	-38.8	180	-54.2	0	0	0	0	112.2	P74 I77 A197 M198 L199 Y204 L205 L226	P74-T201 VanDerWaalsContact CB-OG1 3.26Å; P74-T201 WeakPolarHBondContact CB-OG1 3.22Å; P74-T201 WeakPolarHBondContact CG-OG1 3.23Å; I77-T201 HydrophobicContact CB-CG2 4.07Å; I77-T201 HydrophobicContact CD1-CG2 3.8Å; I77-T201 HydrophobicContact CG2-CG2 3.77Å; A197-T201 WeakPolarHBondContact O-CB 3.42Å; A197-T201 PolarHBondContact O-N 3.37Å; A197-T201 PolarHBondContact O-OG1 3.35Å; M198-T201 WeakPolarHBondContact O-CB 3.44Å; M198-T201 PolarHBondContact O-N 3.41Å; L199-T201 PolarHBondContact O-N 3.09Å; T201-Y204 PolarHBondContact O-N 3.39Å; T201-L205 HydrophobicContact CG2-CD1 4.35Å; T201-L205 WeakPolarHBondContact O-CB 3.23Å; T201-L205 VanDerWaalsContact O-CG 3.32Å; T201-L205 WeakPolarHBondContact O-CG 3.45Å; T201-L205 PolarHBondContact O-N 3.38Å; T201-L226 HydrophobicContact CG2-CD1 3.68Å
202	V	96.5	Very high	91.9	Very high	17 Å²	17	36.5 Å²	36.5	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-61.5	-47.1	176.2	165.1	0	0	0	0	111.3	M198 L199 F200 L205 Q206 Q223 L226 L227	M198-V202 VanDerWaalsContact O-CG2 3.25Å; M198-V202 WeakPolarHBondContact O-CG2 3.36Å; M198-V202 PolarHBondContact O-N 3.13Å; L199-V202 WeakPolarHBondContact O-CB 3.15Å; L199-V202 PolarHBondContact O-N 3.37Å; L199-V202 VanDerWaalsContact O-N 3.16Å; F200-V202 PolarHBondContact O-N 3.19Å; V202-L205 PolarHBondContact O-N 3.26Å; V202-Q206 PolarHBondContact O-N 2.68Å; V202-Q223 HydrophobicContact CB-CG 4.43Å; V202-Q223 HydrophobicContact CG1-CB 4.04Å; V202-Q223 HydrophobicContact CG1-CG 3.97Å; V202-Q223 HydrophobicContact CG2-CB 4.16Å; V202-Q223 HydrophobicContact CG2-CG 4.39Å; V202-Q223 PolarHBondContact O-NE2 3.02Å; V202-L226 HydrophobicContact CG2-CB 3.83Å; V202-L226 HydrophobicContact CG2-CD1 4Å; V202-L227 HydrophobicContact CG2-CD2 4.14Å; V202-L227 HydrophobicContact CG2-CG 4.08Å
203	I	94.2	Very high	90.5	Very high	45 Å²	45	39.2 Å²	39.2	23%	0.231	20%	0.197	C	C	.	.	H	α-helix	trans	-70.7	-41.5	-180	-59.2	166.2	0	0	0	110.1	L199 F200 L205 Q206 A207 I260 I263	L199-I203 HydrophobicContact CD1-CD1 4.17Å; L199-I203 HydrophobicContact CD1-CG1 4.25Å; L199-I203 HydrophobicContact CD2-CD1 4.41Å; L199-I203 HydrophobicContact CG-CD1 3.85Å; L199-I203 HydrophobicContact CG-CG1 4.37Å; L199-I203 WeakPolarHBondContact O-CG1 3.47Å; L199-I203 PolarHBondContact O-N 2.88Å; F200-I203 PolarHBondContact O-N 3.43Å; I203-L205 VanDerWaalsContact C-N 3.33Å; I203-L205 PolarHBondContact O-N 3.14Å; I203-Q206 WeakPolarHBondContact O-CA 3.43Å; I203-Q206 WeakPolarHBondContact O-CB 3.19Å; I203-Q206 PolarHBondContact O-N 3.28Å; I203-A207 PolarHBondContact O-N 2.89Å; I203-I260 HydrophobicContact CD1-CG1 4.2Å; I203-I263 HydrophobicContact CB-CD1 3.5Å; I203-I263 HydrophobicContact CD1-CD1 3.71Å; I203-I263 HydrophobicContact CG1-CD1 4.21Å; I203-I263 HydrophobicContact CG2-CD1 3.4Å; I203-I263 HydrophobicContact CG2-CG2 4.01Å
204	Y	93	Very high	89.2	Confident	11 Å²	11	41.5 Å²	41.5	4%	0.043	23%	0.231	C	C	.	.	H	α-helix	trans	-54.3	-49.2	171.9	168.9	-89.6	0	0	0	111.2	I78 V81 E82 F118 F200 T201 Q206 A207 R208	I78-Y204 HydrophobicContact CB-CE1 4.23Å; I78-Y204 HydrophobicContact CG1-CD1 3.93Å; I78-Y204 HydrophobicContact CG1-CD2 4.3Å; I78-Y204 HydrophobicContact CG1-CE1 3.75Å; I78-Y204 HydrophobicContact CG1-CE2 4.1Å; I78-Y204 HydrophobicContact CG1-CG 4.24Å; I78-Y204 HydrophobicContact CG2-CE2 4.27Å; I78-Y204 PolarHBondContact O-OH 2.84Å; V81-Y204 HydrophobicContact CB-CE1 3.97Å; V81-Y204 HydrophobicContact CG1-CE1 3.97Å; V81-Y204 WeakPolarHBondContact CG1-OH 3.46Å; V81-Y204 HydrophobicContact CG2-CE1 4.26Å; E82-Y204 WeakPolarHBondContact CG-OH 3.31Å; E82-Y204 PolarHBondContact OE1-OH 3.38Å; F118-Y204 AromaticContact CD1-CD2 3.99Å; F118-Y204 HydrophobicContact CD1-CD2 3.99Å; F118-Y204 AromaticContact CD1-CE2 3.69Å; F118-Y204 HydrophobicContact CD1-CE2 3.69Å; F118-Y204 HydrophobicContact CD2-CE2 4.14Å; F118-Y204 HydrophobicContact CE1-CD2 4.15Å; F118-Y204 AromaticContact CE1-CE2 3.84Å; F118-Y204 HydrophobicContact CE1-CE2 3.84Å; F118-Y204 HydrophobicContact CE2-CE2 4.28Å; F118-Y204 AromaticContact CG-CE2 3.88Å; F118-Y204 HydrophobicContact CG-CE2 3.88Å; F118-Y204 HydrophobicContact CZ-CE2 4.14Å; F200-Y204 WeakPolarHBondContact O-CB 3.19Å; F200-Y204 PolarHBondContact O-N 2.61Å; T201-Y204 PolarHBondContact O-N 3.39Å; Y204-Q206 VanDerWaalsContact C-N 3.27Å; Y204-Q206 PolarHBondContact O-N 2.72Å; Y204-A207 PolarHBondContact O-N 2.89Å; Y204-R208 HydrophobicContact CD2-CG 3.73Å; Y204-R208 HydrophobicContact CE1-CB 4.37Å; Y204-R208 HydrophobicContact CE1-CG 4.36Å; Y204-R208 HydrophobicContact CE2-CB 4.3Å; Y204-R208 HydrophobicContact CE2-CG 3.48Å; Y204-R208 VanDerWaalsContact CE2-CG 3.48Å; Y204-R208 HydrophobicContact CG-CG 4.27Å; Y204-R208 VanDerWaalsContact O-CB 3.22Å; Y204-R208 WeakPolarHBondContact O-CB 3.37Å; Y204-R208 VanDerWaalsContact O-CG 3.28Å; Y204-R208 WeakPolarHBondContact O-CG 3.38Å; Y204-R208 PolarHBondContact O-N 3.38Å
205	L	93.2	Very high	88.4	Confident	7 Å²	7	44.4 Å²	44.4	4%	0.037	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-39.8	174.7	-79.9	170.7	0	0	0	111.5	I77 V81 T201 V202 I203 L209 K219 I222 Q223 L226	I77-L205 HydrophobicContact CG2-CD1 4.08Å; I77-L205 HydrophobicContact CG2-CD2 3.76Å; I77-L205 HydrophobicContact CG2-CG 3.93Å; V81-L205 HydrophobicContact CG2-CD2 3.73Å; T201-L205 HydrophobicContact CG2-CD1 4.35Å; T201-L205 WeakPolarHBondContact O-CB 3.23Å; T201-L205 VanDerWaalsContact O-CG 3.32Å; T201-L205 WeakPolarHBondContact O-CG 3.45Å; T201-L205 PolarHBondContact O-N 3.38Å; V202-L205 PolarHBondContact O-N 3.26Å; I203-L205 VanDerWaalsContact C-N 3.33Å; I203-L205 PolarHBondContact O-N 3.14Å; L205-L209 WeakPolarHBondContact O-CB 3.47Å; L205-L209 PolarHBondContact O-N 3.02Å; L205-K219 WeakPolarHBondContact O-CE 3.33Å; L205-I222 HydrophobicContact CD1-CG2 3.73Å; L205-Q223 HydrophobicContact CB-CG 4.44Å; L205-Q223 HydrophobicContact CD1-CG 4.41Å; L205-L226 HydrophobicContact CD1-CD1 3.77Å
206	Q	92	Very high	87.7	Confident	104 Å²	104	49.8 Å²	49.8	49%	0.486	28%	0.276	S	S	.	.	H	α-helix	trans	-60.7	-51.6	178.2	-173.7	62.3	5.1	0	0	111.7	V202 I203 Y204 K219	V202-Q206 PolarHBondContact O-N 2.68Å; I203-Q206 WeakPolarHBondContact O-CA 3.43Å; I203-Q206 WeakPolarHBondContact O-CB 3.19Å; I203-Q206 PolarHBondContact O-N 3.28Å; Y204-Q206 VanDerWaalsContact C-N 3.27Å; Y204-Q206 PolarHBondContact O-N 2.72Å; Q206-K219 PolarHBondContact O-NZ 2.82Å
207	A	89.7	Confident	87.2	Confident	60 Å²	60	56.1 Å²	56.1	50%	0.496	31%	0.309	S	S	.	.	H	α-helix	trans	-71.3	-40.8	-176.9	0	0	0	0	0	112.7	I203 Y204	I203-A207 PolarHBondContact O-N 2.89Å; Y204-A207 PolarHBondContact O-N 2.89Å
208	R	88.6	Confident	86.8	Confident	56 Å²	56	59.8 Å²	59.8	21%	0.211	33%	0.331	C	S	.	.	H	α-helix	trans	-90.5	-16.9	-171.2	-60.8	-62.1	-68.1	-176	-12.3	114.6	V81 E82 R85 Y204 W211	V81-R208 HydrophobicContact CG1-CB 4.08Å; E82-R208 VanDerWaalsContact CD-NH2 3.27Å; E82-R208 IonicContact OE1-CZ 3.08Å; E82-R208 VanDerWaalsContact OE1-CZ 3.31Å; E82-R208 IonicContact OE1-NE 2.69Å; E82-R208 PolarHBondContact OE1-NE 3.29Å; E82-R208 IonicContact OE1-NH2 3.12Å; E82-R208 PolarHBondContact OE1-NH2 3.3Å; E82-R208 IonicContact OE2-CZ 3.76Å; E82-R208 IonicContact OE2-NH2 3.69Å; E82-R208 PolarHBondContact OE2-NH2 2.93Å; R85-R208 PolarHBondContact NE-O 3.34Å; Y204-R208 HydrophobicContact CD2-CG 3.73Å; Y204-R208 HydrophobicContact CE1-CB 4.37Å; Y204-R208 HydrophobicContact CE1-CG 4.36Å; Y204-R208 HydrophobicContact CE2-CB 4.3Å; Y204-R208 HydrophobicContact CE2-CG 3.48Å; Y204-R208 VanDerWaalsContact CE2-CG 3.48Å; Y204-R208 HydrophobicContact CG-CG 4.27Å; Y204-R208 VanDerWaalsContact O-CB 3.22Å; Y204-R208 WeakPolarHBondContact O-CB 3.37Å; Y204-R208 VanDerWaalsContact O-CG 3.28Å; Y204-R208 WeakPolarHBondContact O-CG 3.38Å; Y204-R208 PolarHBondContact O-N 3.38Å; R208-W211 WeakPolarHBondContact O-CH2 3.37Å; R208-W211 WeakPolarHBondContact O-CZ3 3.33Å
209	L	86.3	Confident	86.5	Confident	27 Å²	27	61.6 Å²	61.6	14%	0.141	34%	0.339	C	S	.	.			trans	-119.5	50.7	179.3	-153.5	69.6	0	0	0	110.2	L205 W211 V213 K219	L205-L209 WeakPolarHBondContact O-CB 3.47Å; L205-L209 PolarHBondContact O-N 3.02Å; L209-W211 VanDerWaalsContact C-N 3.31Å; L209-W211 HydrophobicContact CD1-CH2 3.62Å; L209-W211 HydrophobicContact CD1-CZ2 3.36Å; L209-W211 HydrophobicContact CG-CZ2 4.47Å; L209-W211 PolarHBondContact O-N 3.1Å; L209-V213 HydrophobicContact CD1-CG2 3.7Å; L209-V213 HydrophobicContact CD2-CG2 4.26Å; L209-V213 HydrophobicContact CG-CG2 3.88Å; L209-K219 WeakPolarHBondContact O-CD 3.41Å; L209-K219 WeakPolarHBondContact O-CE 3.23Å; L209-K219 PolarHBondContact O-NZ 3.44Å
210	S	75.8	Confident	86.2	Confident	95 Å²	95	63 Å²	63	66%	0.664	35%	0.35	S	S	*	.			trans	-78.3	-9.6	-175.4	56.5	0	0	0	0	114.5
211	W	74.9	Confident	86.2	Confident	54 Å²	54	68.4 Å²	68.4	21%	0.205	37%	0.374	C	S	.	.	S	Bend	trans	-94.9	162.1	178.5	65	92.8	0	0	0	112.6	F84 R85 Y89 R208 L209 V213	F84-W211 HydrophobicContact CD1-CZ2 4.07Å; F84-W211 AromaticContact CE1-CZ2 3.92Å; F84-W211 HydrophobicContact CE1-CZ2 3.92Å; F84-W211 AromaticContact CE1-NE1 3.9Å; R85-W211 HydrophobicContact CG-CH2 3.33Å; R85-W211 HydrophobicContact CG-CZ2 3.9Å; R85-W211 HydrophobicContact CG-CZ3 4.29Å; Y89-W211 AromaticContact CD2-CD2 3.74Å; Y89-W211 HydrophobicContact CD2-CD2 3.74Å; Y89-W211 AromaticContact CD2-CE2 3.72Å; Y89-W211 HydrophobicContact CD2-CE3 4.17Å; Y89-W211 HydrophobicContact CD2-CG 4.05Å; Y89-W211 HydrophobicContact CD2-CZ2 4.23Å; Y89-W211 AromaticContact CD2-NE1 3.88Å; Y89-W211 HydrophobicContact CE2-CB 4.3Å; Y89-W211 AromaticContact CE2-CD2 3.7Å; Y89-W211 HydrophobicContact CE2-CD2 3.7Å; Y89-W211 AromaticContact CE2-CE3 3.9Å; Y89-W211 HydrophobicContact CE2-CE3 3.9Å; Y89-W211 AromaticContact CE2-CG 3.86Å; Y89-W211 HydrophobicContact CE2-CG 3.86Å; Y89-W211 HydrophobicContact CG-CD2 4.46Å; Y89-W211 HydrophobicContact CG-CZ2 4.25Å; R208-W211 WeakPolarHBondContact O-CH2 3.37Å; R208-W211 WeakPolarHBondContact O-CZ3 3.33Å; L209-W211 VanDerWaalsContact C-N 3.31Å; L209-W211 HydrophobicContact CD1-CH2 3.62Å; L209-W211 HydrophobicContact CD1-CZ2 3.36Å; L209-W211 HydrophobicContact CG-CZ2 4.47Å; L209-W211 PolarHBondContact O-N 3.1Å; W211-V213 HydrophobicContact CG-CG2 4.43Å; W211-V213 HydrophobicContact CZ2-CG2 4.39Å; W211-V213 PolarHBondContact O-N 2.96Å
212	R	69.1	Low	86.1	Confident	207 Å²	207	71.5 Å²	71.5	78%	0.781	39%	0.389	S	S	*	.			trans	-66.6	100.3	175.1	-57.4	-168.1	170.5	151.2	2.9	110.6	G214 E216	R212-G214 PolarHBondContact O-N 2.91Å; R212-E216 WeakPolarHBondContact CB-OE1 3.03Å; R212-E216 WeakPolarHBondContact CD-OE1 3.48Å; R212-E216 WeakPolarHBondContact CG-OE1 3.48Å; R212-E216 IonicContact NE-OE1 3.33Å; R212-E216 PolarHBondContact NE-OE1 3.28Å
213	V	68.4	Low	86.1	Confident	57 Å²	57	71.9 Å²	71.9	35%	0.345	39%	0.39	S	S	.	.			trans	-93.2	82.3	170.4	-173.5	0	0	0	0	108.5	F84 L209 W211 S215	F84-V213 HydrophobicContact CE1-CG1 4.24Å; F84-V213 HydrophobicContact CE1-CG2 4.14Å; F84-V213 HydrophobicContact CZ-CG1 4.08Å; L209-V213 HydrophobicContact CD1-CG2 3.7Å; L209-V213 HydrophobicContact CD2-CG2 4.26Å; L209-V213 HydrophobicContact CG-CG2 3.88Å; W211-V213 HydrophobicContact CG-CG2 4.43Å; W211-V213 HydrophobicContact CZ2-CG2 4.39Å; W211-V213 PolarHBondContact O-N 2.96Å; V213-S215 PolarHBondContact O-N 2.68Å
214	G	72	Confident	86.3	Confident	80 Å²	80	75.9 Å²	75.9	83%	0.825	41%	0.406	S	S	*	.	S	Bend	trans	65.9	-90.9	177.3	0	0	0	0	0	113.1	R212	R212-G214 PolarHBondContact O-N 2.91Å
215	S	80.5	Confident	86.5	Confident	64 Å²	64	79 Å²	79	45%	0.448	42%	0.423	S	S	.	.			trans	-98.5	125.4	-178	172.7	0	0	0	0	112.1	V213 L217 V218	V213-S215 PolarHBondContact O-N 2.68Å; S215-L217 PolarHBondContact O-N 3.19Å; S215-L217 VanDerWaalsContact O-N 3.12Å; S215-L217 PolarHBondContact OG-N 3.04Å; S215-V218 PolarHBondContact O-N 2.66Å
216	E	83.1	Confident	86.8	Confident	118 Å²	118	79 Å²	79	55%	0.551	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-19	178.5	-58.3	-63.5	143.1	0	0	113.4	R212 P220	R212-E216 WeakPolarHBondContact CB-OE1 3.03Å; R212-E216 WeakPolarHBondContact CD-OE1 3.48Å; R212-E216 WeakPolarHBondContact CG-OE1 3.48Å; R212-E216 IonicContact NE-OE1 3.33Å; R212-E216 PolarHBondContact NE-OE1 3.28Å; E216-P220 WeakPolarHBondContact O-CD 3.46Å; E216-P220 WeakPolarHBondContact O-CG 3.29Å
217	L	88.4	Confident	87.1	Confident	132 Å²	132	77.8 Å²	77.8	69%	0.691	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-18.6	-175.6	-65.6	176.5	0	0	0	114	S215 K219 P220 F221	S215-L217 PolarHBondContact O-N 3.19Å; S215-L217 VanDerWaalsContact O-N 3.12Å; S215-L217 PolarHBondContact OG-N 3.04Å; L217-K219 PolarHBondContact O-N 2.67Å; L217-P220 WeakPolarHBondContact O-CD 3.3Å; L217-P220 WeakPolarHBondContact O-CG 3.35Å; L217-F221 WeakPolarHBondContact O-CB 3.42Å; L217-F221 PolarHBondContact O-N 3.24Å; L217-F221 VanDerWaalsContact O-N 3.1Å
218	V	89.4	Confident	87.5	Confident	78 Å²	78	77.4 Å²	77.4	47%	0.473	41%	0.412	S	S	.	.	H	α-helix	trans	-65.7	-44	-174.1	173	0	0	0	0	111.2	S215 F221 I222	S215-V218 PolarHBondContact O-N 2.66Å; V218-F221 PolarHBondContact O-N 3.14Å; V218-I222 HydrophobicContact CG1-CD1 3.84Å; V218-I222 VanDerWaalsContact O-CG1 3.32Å; V218-I222 WeakPolarHBondContact O-CG1 3.35Å; V218-I222 PolarHBondContact O-N 3.4Å
219	K	90.8	Very high	87.9	Confident	37 Å²	37	77.2 Å²	77.2	16%	0.161	42%	0.415	C	S	.	.	H	α-helix	trans	-62.2	-56.9	179.6	178.3	-176.3	-178	-176.4	0	113.1	L205 Q206 L209 L217 F221 I222 Q223	L205-K219 WeakPolarHBondContact O-CE 3.33Å; Q206-K219 PolarHBondContact O-NZ 2.82Å; L209-K219 WeakPolarHBondContact O-CD 3.41Å; L209-K219 WeakPolarHBondContact O-CE 3.23Å; L209-K219 PolarHBondContact O-NZ 3.44Å; L217-K219 PolarHBondContact O-N 2.67Å; K219-F221 PolarHBondContact O-N 3Å; K219-I222 PolarHBondContact O-N 3.26Å; K219-Q223 WeakPolarHBondContact O-CG 3.45Å; K219-Q223 PolarHBondContact O-N 3.35Å
220	P	93.2	Very high	88.5	Confident	62 Å²	62	76.3 Å²	76.3	40%	0.403	41%	0.411	S	S	.	.	H	α-helix	trans	-62.9	-31	178.7	24.2	-34.1	0	0	0	112.3	E216 L217 Q223 F224	E216-P220 WeakPolarHBondContact O-CD 3.46Å; E216-P220 WeakPolarHBondContact O-CG 3.29Å; L217-P220 WeakPolarHBondContact O-CD 3.3Å; L217-P220 WeakPolarHBondContact O-CG 3.35Å; P220-Q223 PolarHBondContact O-N 3.01Å; P220-F224 WeakPolarHBondContact O-CB 3.4Å; P220-F224 PolarHBondContact O-N 2.98Å
221	F	94.5	Very high	89.5	Confident	126 Å²	126	77.5 Å²	77.5	55%	0.553	41%	0.405	S	S	*	.	H	α-helix	trans	-64.2	-47.2	174.3	-177.2	-106	0	0	0	112.3	L217 V218 K219 Q223 F224 L225	L217-F221 WeakPolarHBondContact O-CB 3.42Å; L217-F221 PolarHBondContact O-N 3.24Å; L217-F221 VanDerWaalsContact O-N 3.1Å; V218-F221 PolarHBondContact O-N 3.14Å; K219-F221 PolarHBondContact O-N 3Å; F221-Q223 VanDerWaalsContact C-N 3.32Å; F221-Q223 PolarHBondContact O-N 3.4Å; F221-F224 PolarHBondContact O-N 3.29Å; F221-L225 HydrophobicContact CD1-CD1 4.05Å; F221-L225 HydrophobicContact CD1-CG 4.5Å; F221-L225 HydrophobicContact CE1-CD1 3.53Å; F221-L225 HydrophobicContact CE1-CG 4.18Å; F221-L225 HydrophobicContact CZ-CD1 3.9Å; F221-L225 HydrophobicContact CZ-CD2 4.27Å; F221-L225 HydrophobicContact CZ-CG 4.2Å; F221-L225 WeakPolarHBondContact O-CG 3.01Å; F221-L225 PolarHBondContact O-N 2.97Å
222	I	95.1	Very high	90.6	Very high	64 Å²	64	77.8 Å²	77.8	33%	0.328	42%	0.419	S	S	.	.	H	α-helix	trans	-60.5	-44.2	174.9	-67.4	166.5	0	0	0	110.5	L205 V218 K219 F224 L225 L226	L205-I222 HydrophobicContact CD1-CG2 3.73Å; V218-I222 HydrophobicContact CG1-CD1 3.84Å; V218-I222 VanDerWaalsContact O-CG1 3.32Å; V218-I222 WeakPolarHBondContact O-CG1 3.35Å; V218-I222 PolarHBondContact O-N 3.4Å; K219-I222 PolarHBondContact O-N 3.26Å; I222-F224 VanDerWaalsContact C-N 3.34Å; I222-F224 PolarHBondContact O-N 2.83Å; I222-L225 PolarHBondContact O-N 3.46Å; I222-L226 HydrophobicContact CG2-CD1 4.16Å; I222-L226 HydrophobicContact CG2-CG 4.47Å; I222-L226 WeakPolarHBondContact O-CG 3.18Å; I222-L226 PolarHBondContact O-N 3.42Å
223	Q	96.6	Very high	92	Very high	26 Å²	26	68.1 Å²	68.1	12%	0.121	38%	0.383	C	S	.	.	H	α-helix	trans	-60.3	-44	178	-70.7	171.5	-38.2	0	0	111.8	V202 L205 K219 P220 F221 L226 L227	V202-Q223 HydrophobicContact CB-CG 4.43Å; V202-Q223 HydrophobicContact CG1-CB 4.04Å; V202-Q223 HydrophobicContact CG1-CG 3.97Å; V202-Q223 HydrophobicContact CG2-CB 4.16Å; V202-Q223 HydrophobicContact CG2-CG 4.39Å; V202-Q223 PolarHBondContact O-NE2 3.02Å; L205-Q223 HydrophobicContact CB-CG 4.44Å; L205-Q223 HydrophobicContact CD1-CG 4.41Å; K219-Q223 WeakPolarHBondContact O-CG 3.45Å; K219-Q223 PolarHBondContact O-N 3.35Å; P220-Q223 PolarHBondContact O-N 3.01Å; F221-Q223 VanDerWaalsContact C-N 3.32Å; F221-Q223 PolarHBondContact O-N 3.4Å; Q223-L226 PolarHBondContact O-N 3.31Å; Q223-L227 WeakPolarHBondContact O-CG 3.45Å; Q223-L227 PolarHBondContact O-N 3.2Å; Q223-L227 VanDerWaalsContact O-N 3.1Å
224	F	97.6	Very high	93.4	Very high	128 Å²	128	65.4 Å²	65.4	56%	0.561	37%	0.366	S	S	*	.	H	α-helix	trans	-60.5	-45.6	175.5	177.8	-105.1	0	0	0	111.9	P220 F221 I222 L226 L227 C228	P220-F224 WeakPolarHBondContact O-CB 3.4Å; P220-F224 PolarHBondContact O-N 2.98Å; F221-F224 PolarHBondContact O-N 3.29Å; I222-F224 VanDerWaalsContact C-N 3.34Å; I222-F224 PolarHBondContact O-N 2.83Å; F224-L226 VanDerWaalsContact C-N 3.33Å; F224-L226 PolarHBondContact O-N 3.07Å; F224-L227 PolarHBondContact O-N 2.69Å; F224-C228 VanDerWaalsContact CE1-SG 3.51Å; F224-C228 VanDerWaalsContact CZ-SG 3.5Å; F224-C228 PolarHBondContact O-N 3.36Å; F224-C228 PolarHBondContact O-SG 3.07Å; F224-C228 VanDerWaalsContact O-SG 3.33Å
225	L	97.9	Very high	94.7	Very high	77 Å²	77	65.6 Å²	65.6	40%	0.403	35%	0.348	S	S	.	.	H	α-helix	trans	-60.4	-41.2	177.2	-69.7	-177.5	0	0	0	112.6	F221 I222 L227 C228 I229	F221-L225 HydrophobicContact CD1-CD1 4.05Å; F221-L225 HydrophobicContact CD1-CG 4.5Å; F221-L225 HydrophobicContact CE1-CD1 3.53Å; F221-L225 HydrophobicContact CE1-CG 4.18Å; F221-L225 HydrophobicContact CZ-CD1 3.9Å; F221-L225 HydrophobicContact CZ-CD2 4.27Å; F221-L225 HydrophobicContact CZ-CG 4.2Å; F221-L225 WeakPolarHBondContact O-CG 3.01Å; F221-L225 PolarHBondContact O-N 2.97Å; I222-L225 PolarHBondContact O-N 3.46Å; L225-L227 VanDerWaalsContact C-N 3.34Å; L225-L227 PolarHBondContact O-N 3.28Å; L225-C228 WeakPolarHBondContact O-CB 3.33Å; L225-C228 PolarHBondContact O-N 3.16Å; L225-I229 WeakPolarHBondContact O-CG1 3.38Å; L225-I229 PolarHBondContact O-N 2.88Å
226	L	98.2	Very high	95.5	Very high	7 Å²	7	63 Å²	63	4%	0.037	33%	0.329	C	S	.	.	H	α-helix	trans	-61.6	-42.9	175.8	-67	170.5	0	0	0	111.5	I73 I77 M198 T201 V202 L205 I222 Q223 F224 I229 A230	I73-L226 HydrophobicContact CG2-CD2 3.55Å; I77-L226 HydrophobicContact CD1-CD1 4.14Å; I77-L226 HydrophobicContact CD1-CD2 3.86Å; M198-L226 HydrophobicContact CB-CB 4.29Å; M198-L226 WeakPolarHBondContact CB-O 3.18Å; M198-L226 VanDerWaalsContact CG-O 3.27Å; M198-L226 WeakPolarHBondContact CG-O 3.48Å; M198-L226 HydrophobicContact SD-CB 4.21Å; M198-L226 HydrophobicContact SD-CD2 3.68Å; T201-L226 HydrophobicContact CG2-CD1 3.68Å; V202-L226 HydrophobicContact CG2-CB 3.83Å; V202-L226 HydrophobicContact CG2-CD1 4Å; L205-L226 HydrophobicContact CD1-CD1 3.77Å; I222-L226 HydrophobicContact CG2-CD1 4.16Å; I222-L226 HydrophobicContact CG2-CG 4.47Å; I222-L226 WeakPolarHBondContact O-CG 3.18Å; I222-L226 PolarHBondContact O-N 3.42Å; Q223-L226 PolarHBondContact O-N 3.31Å; F224-L226 VanDerWaalsContact C-N 3.33Å; F224-L226 PolarHBondContact O-N 3.07Å; L226-I229 WeakPolarHBondContact O-CB 3.04Å; L226-I229 PolarHBondContact O-N 3.37Å; L226-A230 PolarHBondContact O-N 3.15Å; L226-A230 VanDerWaalsContact O-N 3.14Å
227	L	98.2	Very high	96.1	Very high	79 Å²	79	57.6 Å²	57.6	41%	0.414	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-38	175.3	-65.3	176.5	0	0	0	112	L199 V202 Q223 F224 L225 I229 A230 F231	L199-L227 HydrophobicContact CD1-CD2 4.25Å; V202-L227 HydrophobicContact CG2-CD2 4.14Å; V202-L227 HydrophobicContact CG2-CG 4.08Å; Q223-L227 WeakPolarHBondContact O-CG 3.45Å; Q223-L227 PolarHBondContact O-N 3.2Å; Q223-L227 VanDerWaalsContact O-N 3.1Å; F224-L227 PolarHBondContact O-N 2.69Å; L225-L227 VanDerWaalsContact C-N 3.34Å; L225-L227 PolarHBondContact O-N 3.28Å; L227-I229 VanDerWaalsContact C-N 3.31Å; L227-I229 PolarHBondContact O-N 3.21Å; L227-A230 PolarHBondContact O-N 3Å; L227-F231 WeakPolarHBondContact O-CB 3.29Å; L227-F231 PolarHBondContact O-N 3.28Å
228	C	98.3	Very high	96.5	Very high	51 Å²	51	53.8 Å²	53.8	35%	0.345	29%	0.286	S	S	.	.	H	α-helix	trans	-61	-38.8	173	-70.2	0	0	0	0	112.2	F224 L225 F231 A232	F224-C228 VanDerWaalsContact CE1-SG 3.51Å; F224-C228 VanDerWaalsContact CZ-SG 3.5Å; F224-C228 PolarHBondContact O-N 3.36Å; F224-C228 PolarHBondContact O-SG 3.07Å; F224-C228 VanDerWaalsContact O-SG 3.33Å; L225-C228 WeakPolarHBondContact O-CB 3.33Å; L225-C228 PolarHBondContact O-N 3.16Å; C228-F231 PolarHBondContact O-N 3.33Å; C228-A232 VanDerWaalsContact O-CB 3.28Å; C228-A232 WeakPolarHBondContact O-CB 3.08Å; C228-A232 PolarHBondContact O-N 2.71Å
229	I	97.9	Very high	96.9	Very high	53 Å²	53	53 Å²	53	27%	0.272	28%	0.284	S	S	.	.	H	α-helix	trans	-62.5	-47.7	175.6	-69.3	167	0	0	0	110.5	I69 I73 M198 L225 L226 L227 F231 A232 V233	I69-I229 HydrophobicContact CG2-CG2 3.46Å; I69-I229 VanDerWaalsContact CG2-CG2 3.46Å; I73-I229 HydrophobicContact CD1-CD1 4.12Å; M198-I229 HydrophobicContact CG-CB 4.49Å; M198-I229 HydrophobicContact CG-CG2 4.35Å; M198-I229 HydrophobicContact SD-CB 4.22Å; M198-I229 HydrophobicContact SD-CG2 4.01Å; L225-I229 WeakPolarHBondContact O-CG1 3.38Å; L225-I229 PolarHBondContact O-N 2.88Å; L226-I229 WeakPolarHBondContact O-CB 3.04Å; L226-I229 PolarHBondContact O-N 3.37Å; L227-I229 VanDerWaalsContact C-N 3.31Å; L227-I229 PolarHBondContact O-N 3.21Å; I229-F231 VanDerWaalsContact C-N 3.31Å; I229-F231 PolarHBondContact O-N 3.24Å; I229-A232 PolarHBondContact O-N 3.23Å; I229-V233 WeakPolarHBondContact O-CG2 3.19Å; I229-V233 PolarHBondContact O-N 2.86Å
230	A	98.2	Very high	97.1	Very high	7 Å²	7	51.2 Å²	51.2	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-45	176.5	0	0	0	0	0	111.9	M198 L226 L227 V233 A234	M198-A230 HydrophobicContact CB-CB 3.91Å; M198-A230 HydrophobicContact CG-CB 3.88Å; L226-A230 PolarHBondContact O-N 3.15Å; L226-A230 VanDerWaalsContact O-N 3.14Å; L227-A230 PolarHBondContact O-N 3Å; A230-V233 PolarHBondContact O-N 3.1Å; A230-A234 WeakPolarHBondContact O-CB 3.06Å; A230-A234 PolarHBondContact O-N 2.82Å
231	F	97.8	Very high	97.2	Very high	120 Å²	120	51.4 Å²	51.4	53%	0.526	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-41.3	179.6	-168.2	-119.9	0	0	0	112.5	L227 C228 I229 V233 A234 L235	L227-F231 WeakPolarHBondContact O-CB 3.29Å; L227-F231 PolarHBondContact O-N 3.28Å; C228-F231 PolarHBondContact O-N 3.33Å; I229-F231 VanDerWaalsContact C-N 3.31Å; I229-F231 PolarHBondContact O-N 3.24Å; F231-V233 PolarHBondContact O-N 3.46Å; F231-A234 PolarHBondContact O-N 3.24Å; F231-L235 HydrophobicContact CD1-CD1 3.76Å; F231-L235 HydrophobicContact CD1-CG 4.27Å; F231-L235 HydrophobicContact CD2-CG 4.47Å; F231-L235 HydrophobicContact CE1-CD1 3.35Å; F231-L235 HydrophobicContact CE1-CD2 4.49Å; F231-L235 HydrophobicContact CE1-CG 4Å; F231-L235 HydrophobicContact CE2-CD1 4.41Å; F231-L235 HydrophobicContact CE2-CD2 4.23Å; F231-L235 HydrophobicContact CE2-CG 4.18Å; F231-L235 HydrophobicContact CG-CD1 4.46Å; F231-L235 HydrophobicContact CZ-CD1 3.72Å; F231-L235 HydrophobicContact CZ-CD2 4Å; F231-L235 HydrophobicContact CZ-CG 3.94Å; F231-L235 WeakPolarHBondContact O-CB 3.34Å; F231-L235 WeakPolarHBondContact O-CG 3.49Å; F231-L235 PolarHBondContact O-N 3.29Å
232	A	98.2	Very high	97.2	Very high	60 Å²	60	45.6 Å²	45.6	50%	0.496	25%	0.245	S	C	.	.	H	α-helix	trans	-62	-43.1	176.9	0	0	0	0	0	112	C228 I229 L235 S236	C228-A232 VanDerWaalsContact O-CB 3.28Å; C228-A232 WeakPolarHBondContact O-CB 3.08Å; C228-A232 PolarHBondContact O-N 2.71Å; I229-A232 PolarHBondContact O-N 3.23Å; A232-L235 PolarHBondContact O-N 3.46Å; A232-S236 WeakPolarHBondContact O-CB 3.5Å; A232-S236 PolarHBondContact O-N 3.33Å
233	V	97.9	Very high	97.3	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-42.6	175.4	172.5	0	0	0	0	111.2	V61 L66 I69 H190 I229 A230 F231 S236	V61-V233 HydrophobicContact CG1-CG1 4.28Å; V61-V233 HydrophobicContact CG1-CG2 4.31Å; V61-V233 HydrophobicContact CG2-CG2 4.45Å; L66-V233 HydrophobicContact CD1-CG1 4.12Å; I69-V233 HydrophobicContact CD1-CG2 4.28Å; H190-V233 HydrophobicContact CB-CG1 4.11Å; I229-V233 WeakPolarHBondContact O-CG2 3.19Å; I229-V233 PolarHBondContact O-N 2.86Å; A230-V233 PolarHBondContact O-N 3.1Å; F231-V233 PolarHBondContact O-N 3.46Å; V233-S236 WeakPolarHBondContact O-CB 3.35Å; V233-S236 PolarHBondContact O-N 3Å; V233-S236 PolarHBondContact O-OG 3.26Å
234	A	98	Very high	97.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-47.2	177.7	0	0	0	0	0	112.2	A230 F231 S236 R237 V248 L252	A230-A234 WeakPolarHBondContact O-CB 3.06Å; A230-A234 PolarHBondContact O-N 2.82Å; F231-A234 PolarHBondContact O-N 3.24Å; A234-S236 VanDerWaalsContact C-N 3.28Å; A234-S236 PolarHBondContact O-N 3.45Å; A234-R237 WeakPolarHBondContact O-CB 3.37Å; A234-R237 PolarHBondContact O-N 3.43Å; A234-R237 VanDerWaalsContact O-N 3.09Å; A234-V248 HydrophobicContact CB-CG1 3.79Å; A234-V248 WeakPolarHBondContact O-CG1 3.49Å; A234-L252 HydrophobicContact CB-CD1 4.01Å; A234-L252 HydrophobicContact CB-CD2 3.71Å; A234-L252 HydrophobicContact CB-CG 4.03Å
235	L	97.9	Very high	97.3	Very high	85 Å²	85	45.3 Å²	45.3	45%	0.445	24%	0.237	S	C	.	.	H	α-helix	trans	-63.5	-33.4	177.2	-72.3	-176.2	0	0	0	112.6	F231 A232 R237 V238 S239	F231-L235 HydrophobicContact CD1-CD1 3.76Å; F231-L235 HydrophobicContact CD1-CG 4.27Å; F231-L235 HydrophobicContact CD2-CG 4.47Å; F231-L235 HydrophobicContact CE1-CD1 3.35Å; F231-L235 HydrophobicContact CE1-CD2 4.49Å; F231-L235 HydrophobicContact CE1-CG 4Å; F231-L235 HydrophobicContact CE2-CD1 4.41Å; F231-L235 HydrophobicContact CE2-CD2 4.23Å; F231-L235 HydrophobicContact CE2-CG 4.18Å; F231-L235 HydrophobicContact CG-CD1 4.46Å; F231-L235 HydrophobicContact CZ-CD1 3.72Å; F231-L235 HydrophobicContact CZ-CD2 4Å; F231-L235 HydrophobicContact CZ-CG 3.94Å; F231-L235 WeakPolarHBondContact O-CB 3.34Å; F231-L235 WeakPolarHBondContact O-CG 3.49Å; F231-L235 PolarHBondContact O-N 3.29Å; A232-L235 PolarHBondContact O-N 3.46Å; L235-R237 PolarHBondContact O-N 2.87Å; L235-R237 VanDerWaalsContact O-N 3.16Å; L235-V238 PolarHBondContact O-N 2.96Å; L235-S239 PolarHBondContact O-N 2.84Å; L235-S239 PolarHBondContact O-OG 2.88Å
236	S	97.6	Very high	97.3	Very high	8 Å²	8	43 Å²	43	6%	0.056	23%	0.227	C	C	.	.	H	α-helix	trans	-56.1	-33.1	174.8	116.3	0	0	0	0	111.5	A232 V233 A234 V238 S239 D240	A232-S236 WeakPolarHBondContact O-CB 3.5Å; A232-S236 PolarHBondContact O-N 3.33Å; V233-S236 WeakPolarHBondContact O-CB 3.35Å; V233-S236 PolarHBondContact O-N 3Å; V233-S236 PolarHBondContact O-OG 3.26Å; A234-S236 VanDerWaalsContact C-N 3.28Å; A234-S236 PolarHBondContact O-N 3.45Å; S236-V238 VanDerWaalsContact C-N 3.32Å; S236-V238 PolarHBondContact O-N 2.94Å; S236-S239 WeakPolarHBondContact CA-OG 3.41Å; S236-S239 PolarHBondContact O-N 3.34Å; S236-S239 PolarHBondContact O-OG 3.05Å; S236-S239 VanDerWaalsContact O-OG 3.08Å; S236-D240 WeakPolarHBondContact O-CB 3.22Å; S236-D240 PolarHBondContact O-N 3.39Å; S236-D240 VanDerWaalsContact O-OD2 3.05Å
237	R	97	Very high	97.2	Very high	6 Å²	6	42.7 Å²	42.7	2%	0.023	23%	0.225	C	C	.	.	H	α-helix	trans	-70.5	-30	-179.5	-58.3	-42.1	-60.1	166.9	-11.5	113.2	S59 H190 A234 L235 K242 H243 V248	S59-R237 PolarHBondContact OG-NH1 3.28Å; H190-R237 HydrophobicContact CB-CG 3.89Å; A234-R237 WeakPolarHBondContact O-CB 3.37Å; A234-R237 PolarHBondContact O-N 3.43Å; A234-R237 VanDerWaalsContact O-N 3.09Å; L235-R237 PolarHBondContact O-N 2.87Å; L235-R237 VanDerWaalsContact O-N 3.16Å; R237-K242 VanDerWaalsContact CZ-CG 3.43Å; R237-K242 PolarHBondContact O-N 2.74Å; R237-K242 VanDerWaalsContact O-N 3.08Å; R237-H243 HydrophobicContact CB-CB 4.4Å; R237-H243 PolarHBondContact O-N 3.46Å; R237-V248 HydrophobicContact CB-CG2 3.76Å
238	V	96.7	Very high	97.2	Very high	52 Å²	52	39.3 Å²	39.3	32%	0.315	21%	0.208	S	C	.	.	H	α-helix	trans	-77	-48.1	174.5	-174	0	0	0	0	109.7	L235 S236 D240 F241 V248	L235-V238 PolarHBondContact O-N 2.96Å; S236-V238 VanDerWaalsContact C-N 3.32Å; S236-V238 PolarHBondContact O-N 2.94Å; V238-D240 PolarHBondContact O-N 3.19Å; V238-F241 PolarHBondContact O-N 3.45Å; V238-F241 VanDerWaalsContact O-N 3.14Å; V238-V248 HydrophobicContact CG2-CB 4.2Å; V238-V248 HydrophobicContact CG2-CG1 4.28Å; V238-V248 HydrophobicContact CG2-CG2 3.78Å
239	S	96.2	Very high	97.2	Very high	61 Å²	61	41.6 Å²	41.6	43%	0.427	22%	0.217	S	C	.	.	H	α-helix	trans	-66.7	-21.5	-178.9	66.4	0	0	0	0	114.4	K57 L235 S236	K57-S239 PolarHBondContact NZ-O 2.75Å; L235-S239 PolarHBondContact O-N 2.84Å; L235-S239 PolarHBondContact O-OG 2.88Å; S236-S239 WeakPolarHBondContact CA-OG 3.41Å; S236-S239 PolarHBondContact O-N 3.34Å; S236-S239 PolarHBondContact O-OG 3.05Å; S236-S239 VanDerWaalsContact O-OG 3.08Å
240	D	95.8	Very high	97.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	4.8	178.3	-61.4	-20.7	0	0	0	113	K57 T60 S236 V238 K242	K57-D240 IonicContact NZ-OD1 2.69Å; K57-D240 PolarHBondContact NZ-OD1 3.06Å; T60-D240 VanDerWaalsContact CB-OD2 3.29Å; T60-D240 WeakPolarHBondContact CB-OD2 3.3Å; T60-D240 PolarHBondContact N-OD2 2.9Å; T60-D240 PolarHBondContact OG1-OD1 3.48Å; T60-D240 PolarHBondContact OG1-OD2 3.06Å; S236-D240 WeakPolarHBondContact O-CB 3.22Å; S236-D240 PolarHBondContact O-N 3.39Å; S236-D240 VanDerWaalsContact O-OD2 3.05Å; V238-D240 PolarHBondContact O-N 3.19Å; D240-K242 HydrophobicContact CB-CG 3.79Å; D240-K242 WeakPolarHBondContact O-CG 3.12Å; D240-K242 PolarHBondContact O-N 2.83Å
241	F	95.3	Very high	97.3	Very high	65 Å²	65	40 Å²	40	29%	0.285	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	33.7	-177.4	-52.1	-54.9	0	0	0	114.1	Y54 P55 P145 V238	Y54-F241 AromaticContact CD1-CD1 3.37Å; Y54-F241 HydrophobicContact CD1-CD1 3.37Å; Y54-F241 HydrophobicContact CD1-CD2 4.2Å; Y54-F241 AromaticContact CD1-CE1 3.34Å; Y54-F241 HydrophobicContact CD1-CE1 3.34Å; Y54-F241 HydrophobicContact CD1-CE2 4.16Å; Y54-F241 AromaticContact CD1-CG 3.83Å; Y54-F241 HydrophobicContact CD1-CG 3.83Å; Y54-F241 AromaticContact CD1-CZ 3.75Å; Y54-F241 HydrophobicContact CD1-CZ 3.75Å; Y54-F241 AromaticContact CE1-CD1 3.89Å; Y54-F241 HydrophobicContact CE1-CD1 3.89Å; Y54-F241 AromaticContact CE1-CE1 3.54Å; Y54-F241 HydrophobicContact CE1-CE1 3.54Å; Y54-F241 HydrophobicContact CE1-CZ 4.14Å; Y54-F241 HydrophobicContact CG-CB 4.35Å; Y54-F241 AromaticContact CG-CD1 3.8Å; Y54-F241 HydrophobicContact CG-CD1 3.8Å; Y54-F241 HydrophobicContact CG-CE1 4.23Å; Y54-F241 HydrophobicContact CG-CG 4Å; P55-F241 HydrophobicContact CG-CD2 4.45Å; P55-F241 HydrophobicContact CG-CE2 4.42Å; P145-F241 HydrophobicContact CB-CB 4.34Å; V238-F241 PolarHBondContact O-N 3.45Å; V238-F241 VanDerWaalsContact O-N 3.14Å
242	K	94.7	Very high	97.3	Very high	4 Å²	4	36 Å²	36	2%	0.017	20%	0.195	C	C	.	.	S	Bend	trans	-94.4	-27.6	-176.3	-63.9	-73	-179.2	-171.9	0	113	Y56 K57 S59 R144 R237 D240	Y56-K242 PolarHBondContact OH-NZ 3.41Å; K57-K242 WeakPolarHBondContact O-CE 3.27Å; K57-K242 PolarHBondContact O-NZ 2.81Å; S59-K242 WeakPolarHBondContact OG-CE 3.24Å; R144-K242 WeakPolarHBondContact CD-O 3.16Å; R144-K242 WeakPolarHBondContact CG-O 3.4Å; R237-K242 VanDerWaalsContact CZ-CG 3.43Å; R237-K242 PolarHBondContact O-N 2.74Å; R237-K242 VanDerWaalsContact O-N 3.08Å; D240-K242 HydrophobicContact CB-CG 3.79Å; D240-K242 WeakPolarHBondContact O-CG 3.12Å; D240-K242 PolarHBondContact O-N 2.83Å
243	H	96.9	Very high	97.3	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.032	20%	0.2	C	C	.	.	S	Bend	trans	-143.8	150.2	-179.6	-67.6	-82.9	0	0	0	109.3	S185 R237 D247 V248	S185-H243 PolarHBondContact O-CE1 3.41Å; S185-H243 VanDerWaalsContact O-CE1 3.28Å; S185-H243 PolarHBondContact O-ND1 2.93Å; R237-H243 HydrophobicContact CB-CB 4.4Å; R237-H243 PolarHBondContact O-N 3.46Å; H243-D247 HydrophobicContact CB-CB 4.2Å; H243-V248 HydrophobicContact CB-CG2 3.79Å
244	H	97	Very high	97.3	Very high	23 Å²	23	41.2 Å²	41.2	11%	0.106	21%	0.208	C	C	.	.			trans	-68.5	153.8	167.2	-59.1	-80.7	0	0	0	109.2	S51 R142 L143 S246 D247 V248	S51-H244 PolarHBondContact O-CE1 2.79Å; R142-H244 PolarHBondContact NE-CD2 3.33Å; R142-H244 VanDerWaalsContact NE-CD2 3.26Å; R142-H244 PolarHBondContact NH2-CD2 2.98Å; L143-H244 PolarHBondContact O-NE2 3.31Å; H244-S246 PolarHBondContact O-N 3.02Å; H244-S246 VanDerWaalsContact O-N 3.14Å; H244-D247 WeakPolarHBondContact CB-OD2 3.1Å; H244-D247 IonicContact CD2-OD2 3.36Å; H244-D247 PolarHBondContact CD2-OD2 3.1Å; H244-D247 IonicContact CG-OD2 3.93Å; H244-D247 PolarHBondContact N-OD2 2.86Å; H244-D247 PolarHBondContact O-N 3.12Å; H244-V248 PolarHBondContact O-N 2.78Å; H244-V248 VanDerWaalsContact O-N 3.15Å
245	W	97	Very high	97.3	Very high	182 Å²	182	41.2 Å²	41.2	69%	0.689	21%	0.208	S	C	*	.	H	α-helix	trans	-55.1	-33.8	177.6	66.8	-95.8	0	0	0	112.1	V248 L249	W245-V248 PolarHBondContact O-N 3.34Å; W245-L249 HydrophobicContact CZ3-CD2 4.23Å; W245-L249 WeakPolarHBondContact O-CB 3.09Å; W245-L249 PolarHBondContact O-N 2.69Å
246	S	97.7	Very high	97.4	Very high	29 Å²	29	38.9 Å²	38.9	20%	0.203	20%	0.198	C	C	.	.	H	α-helix	trans	-64.9	-38	176.5	57.2	0	0	0	0	112.6	R142 H244 V248 L249 A250	R142-S246 PolarHBondContact NH1-OG 3.24Å; H244-S246 PolarHBondContact O-N 3.02Å; H244-S246 VanDerWaalsContact O-N 3.14Å; S246-V248 VanDerWaalsContact C-N 3.33Å; S246-L249 PolarHBondContact O-N 3.17Å; S246-A250 WeakPolarHBondContact O-CB 3.13Å; S246-A250 PolarHBondContact O-N 3.38Å
247	D	97.7	Very high	97.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-73.2	-34.1	-178.9	-42.2	-24.6	0	0	0	110.1	R142 S185 F186 S188 H243 H244 G251	R142-D247 IonicContact CZ-OD1 3.31Å; R142-D247 IonicContact NE-OD1 3.97Å; R142-D247 IonicContact NH1-OD1 2.88Å; R142-D247 PolarHBondContact NH1-OD1 3.32Å; S185-D247 WeakPolarHBondContact CB-OD2 3.48Å; S185-D247 PolarHBondContact OG-OD2 2.99Å; F186-D247 HydrophobicContact CB-CB 4.5Å; F186-D247 HydrophobicContact CD2-CB 4.13Å; F186-D247 WeakPolarHBondContact CD2-OD1 3.41Å; S188-D247 WeakPolarHBondContact CB-O 3.07Å; S188-D247 PolarHBondContact N-O 2.79Å; H243-D247 HydrophobicContact CB-CB 4.2Å; H244-D247 WeakPolarHBondContact CB-OD2 3.1Å; H244-D247 IonicContact CD2-OD2 3.36Å; H244-D247 PolarHBondContact CD2-OD2 3.1Å; H244-D247 IonicContact CG-OD2 3.93Å; H244-D247 PolarHBondContact N-OD2 2.86Å; H244-D247 PolarHBondContact O-N 3.12Å; D247-G251 PolarHBondContact O-N 2.98Å
248	V	98.3	Very high	97.3	Very high	8 Å²	8	42.5 Å²	42.5	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-64.7	-48.6	172.4	171.6	0	0	0	0	110.6	S191 A234 R237 V238 H243 H244 W245 S246 G251 L252	S191-V248 WeakPolarHBondContact OG-CG1 3.33Å; A234-V248 HydrophobicContact CB-CG1 3.79Å; A234-V248 WeakPolarHBondContact O-CG1 3.49Å; R237-V248 HydrophobicContact CB-CG2 3.76Å; V238-V248 HydrophobicContact CG2-CB 4.2Å; V238-V248 HydrophobicContact CG2-CG1 4.28Å; V238-V248 HydrophobicContact CG2-CG2 3.78Å; H243-V248 HydrophobicContact CB-CG2 3.79Å; H244-V248 PolarHBondContact O-N 2.78Å; H244-V248 VanDerWaalsContact O-N 3.15Å; W245-V248 PolarHBondContact O-N 3.34Å; S246-V248 VanDerWaalsContact C-N 3.33Å; V248-G251 PolarHBondContact O-N 3.2Å; V248-L252 WeakPolarHBondContact O-CG 3.12Å; V248-L252 PolarHBondContact O-N 3.48Å
249	L	98.2	Very high	97.3	Very high	100 Å²	100	40 Å²	40	52%	0.524	20%	0.202	S	C	.	.	H	α-helix	trans	-61.5	-45.1	177.2	-176.8	63.1	0	0	0	112	W245 S246 G251 L252 F253	W245-L249 HydrophobicContact CZ3-CD2 4.23Å; W245-L249 WeakPolarHBondContact O-CB 3.09Å; W245-L249 PolarHBondContact O-N 2.69Å; S246-L249 PolarHBondContact O-N 3.17Å; L249-G251 VanDerWaalsContact C-N 3.3Å; L249-G251 PolarHBondContact O-N 3.16Å; L249-L252 PolarHBondContact O-N 2.84Å; L249-F253 WeakPolarHBondContact O-CB 3.34Å; L249-F253 PolarHBondContact O-N 3.36Å
250	A	98.3	Very high	97.2	Very high	25 Å²	25	40.7 Å²	40.7	21%	0.207	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-38.8	175.3	0	0	0	0	0	112	F186 P187 S246 F253 L254	F186-A250 HydrophobicContact CD2-CB 4.34Å; F186-A250 HydrophobicContact CE2-CB 3.43Å; F186-A250 VanDerWaalsContact CE2-CB 3.43Å; F186-A250 HydrophobicContact CZ-CB 3.68Å; P187-A250 HydrophobicContact CB-CB 4.21Å; S246-A250 WeakPolarHBondContact O-CB 3.13Å; S246-A250 PolarHBondContact O-N 3.38Å; A250-F253 PolarHBondContact O-N 2.9Å; A250-L254 VanDerWaalsContact O-CB 3.3Å; A250-L254 WeakPolarHBondContact O-CB 3.24Å; A250-L254 PolarHBondContact O-N 3.45Å
251	G	98.5	Very high	97.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-50.8	172.7	0	0	0	0	0	112.1	S192 D247 V248 L249 F253 L254 G255	S192-G251 WeakPolarHBondContact CA-O 3.19Å; D247-G251 PolarHBondContact O-N 2.98Å; V248-G251 PolarHBondContact O-N 3.2Å; L249-G251 VanDerWaalsContact C-N 3.3Å; L249-G251 PolarHBondContact O-N 3.16Å; G251-F253 VanDerWaalsContact C-N 3.3Å; G251-F253 PolarHBondContact O-N 2.04Å; G251-L254 PolarHBondContact O-N 3.08Å; G251-G255 PolarHBondContact O-N 3.37Å
252	L	98.6	Very high	96.7	Very high	37 Å²	37	43 Å²	43	19%	0.194	22%	0.215	C	C	.	.	H	α-helix	trans	-56	-45.1	176.5	-73.3	175.5	0	0	0	111.9	A195 A234 V248 L249 S256	A195-L252 HydrophobicContact CB-CD2 3.83Å; A234-L252 HydrophobicContact CB-CD1 4.01Å; A234-L252 HydrophobicContact CB-CD2 3.71Å; A234-L252 HydrophobicContact CB-CG 4.03Å; V248-L252 WeakPolarHBondContact O-CG 3.12Å; V248-L252 PolarHBondContact O-N 3.48Å; L249-L252 PolarHBondContact O-N 2.84Å; L252-S256 VanDerWaalsContact O-CB 3.31Å; L252-S256 WeakPolarHBondContact O-CB 3.37Å; L252-S256 PolarHBondContact O-N 3.04Å; L252-S256 PolarHBondContact O-OG 3.05Å
253	F	98.4	Very high	96	Very high	140 Å²	140	44.4 Å²	44.4	61%	0.614	22%	0.222	S	C	*	.	H	α-helix	trans	-62.8	-48.9	178.2	177.7	-101.4	0	0	0	111.8	L249 A250 G251 S256 L257	L249-F253 WeakPolarHBondContact O-CB 3.34Å; L249-F253 PolarHBondContact O-N 3.36Å; A250-F253 PolarHBondContact O-N 2.9Å; G251-F253 VanDerWaalsContact C-N 3.3Å; G251-F253 PolarHBondContact O-N 2.04Å; F253-S256 PolarHBondContact O-N 3.04Å; F253-L257 HydrophobicContact CE1-CD2 4.33Å; F253-L257 WeakPolarHBondContact O-CB 3.42Å; F253-L257 PolarHBondContact O-N 2.04Å
254	L	98.2	Very high	95.3	Very high	34 Å²	34	49 Å²	49	18%	0.178	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-51.1	179.3	178.7	64.2	0	0	0	111.7	P187 A250 G251 S256 L257 I258	P187-L254 HydrophobicContact CG-CD2 4.13Å; A250-L254 VanDerWaalsContact O-CB 3.3Å; A250-L254 WeakPolarHBondContact O-CB 3.24Å; A250-L254 PolarHBondContact O-N 3.45Å; G251-L254 PolarHBondContact O-N 3.08Å; L254-S256 VanDerWaalsContact C-N 3.29Å; L254-S256 PolarHBondContact O-N 3Å; L254-L257 PolarHBondContact O-N 3.2Å; L254-I258 HydrophobicContact CD1-CG1 4.39Å; L254-I258 WeakPolarHBondContact O-CG1 3.25Å; L254-I258 PolarHBondContact O-N 3.16Å
255	G	98.3	Very high	94.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-39.2	179.4	0	0	0	0	0	112.7	N129 S192 Y196 G251 A259	N129-G255 VanDerWaalsContact OD1-CA 3.32Å; N129-G255 WeakPolarHBondContact OD1-CA 3.34Å; S192-G255 WeakPolarHBondContact O-CA 3.28Å; Y196-G255 WeakPolarHBondContact CA-O 3.45Å; G251-G255 PolarHBondContact O-N 3.37Å; G255-A259 WeakPolarHBondContact O-CB 2.99Å; G255-A259 PolarHBondContact O-N 2.96Å
256	S	98.1	Very high	93.1	Very high	35 Å²	35	50.9 Å²	50.9	25%	0.245	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-43.3	176.2	-57.3	0	0	0	0	112.1	L252 F253 L254 A259 I260	L252-S256 VanDerWaalsContact O-CB 3.31Å; L252-S256 WeakPolarHBondContact O-CB 3.37Å; L252-S256 PolarHBondContact O-N 3.04Å; L252-S256 PolarHBondContact O-OG 3.05Å; F253-S256 PolarHBondContact O-N 3.04Å; L254-S256 VanDerWaalsContact C-N 3.29Å; L254-S256 PolarHBondContact O-N 3Å; S256-A259 PolarHBondContact O-N 2.7Å; S256-I260 VanDerWaalsContact O-CG1 3.31Å; S256-I260 WeakPolarHBondContact O-CG1 3.37Å; S256-I260 PolarHBondContact O-N 2.69Å
257	L	97.7	Very high	91	Very high	69 Å²	69	59.1 Å²	59.1	36%	0.361	30%	0.302	S	S	.	.	H	α-helix	trans	-60.3	-47.7	177.7	179.2	64.9	0	0	0	111.2	F253 L254 A259 I260 L261	F253-L257 HydrophobicContact CE1-CD2 4.33Å; F253-L257 WeakPolarHBondContact O-CB 3.42Å; F253-L257 PolarHBondContact O-N 2.04Å; L254-L257 PolarHBondContact O-N 3.2Å; L257-A259 PolarHBondContact O-N 3.16Å; L257-I260 PolarHBondContact O-N 3.33Å; L257-L261 HydrophobicContact CD1-CD1 4.09Å; L257-L261 HydrophobicContact CD1-CG 4.15Å; L257-L261 HydrophobicContact CG-CD1 3.89Å; L257-L261 HydrophobicContact CG-CG 4.36Å; L257-L261 WeakPolarHBondContact O-CB 3.15Å; L257-L261 VanDerWaalsContact O-CG 3.28Å; L257-L261 WeakPolarHBondContact O-CG 3.43Å; L257-L261 PolarHBondContact O-N 3.25Å
258	I	96.6	Very high	90.7	Very high	21 Å²	21	62.1 Å²	62.1	11%	0.108	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-42.8	178.3	-63.5	-63.7	0	0	0	111.2	A128 N129 Y196 L254 I260 L261 L262	A128-I258 HydrophobicContact CB-CG2 4.41Å; N129-I258 HydrophobicContact CB-CB 4.46Å; N129-I258 HydrophobicContact CB-CG2 4.08Å; Y196-I258 HydrophobicContact CD2-CB 4.43Å; Y196-I258 HydrophobicContact CD2-CG2 4.06Å; Y196-I258 HydrophobicContact CE2-CG2 4.14Å; L254-I258 HydrophobicContact CD1-CG1 4.39Å; L254-I258 WeakPolarHBondContact O-CG1 3.25Å; L254-I258 PolarHBondContact O-N 3.16Å; I258-I260 VanDerWaalsContact C-N 3.33Å; I258-I260 PolarHBondContact O-N 2.85Å; I258-L261 PolarHBondContact O-N 2.66Å; I258-L262 HydrophobicContact CG2-CD1 3.85Å; I258-L262 HydrophobicContact CG2-CG 4.48Å; I258-L262 WeakPolarHBondContact O-CD1 2.99Å; I258-L262 WeakPolarHBondContact O-CG 3.23Å; I258-L262 PolarHBondContact O-N 2.76Å; I258-L262 VanDerWaalsContact O-N 3.12Å
259	A	96.1	Very high	90.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.4	-43.8	176.6	0	0	0	0	0	112	Y196 L199 F200 G255 S256 L257 I263	Y196-A259 HydrophobicContact CD2-CB 3.88Å; Y196-A259 HydrophobicContact CE2-CB 4.31Å; L199-A259 HydrophobicContact CB-CB 4.31Å; L199-A259 HydrophobicContact CD2-CB 4.28Å; L199-A259 HydrophobicContact CG-CB 4.39Å; F200-A259 HydrophobicContact CB-CB 4.35Å; G255-A259 WeakPolarHBondContact O-CB 2.99Å; G255-A259 PolarHBondContact O-N 2.96Å; S256-A259 PolarHBondContact O-N 2.7Å; L257-A259 PolarHBondContact O-N 3.16Å; A259-I263 WeakPolarHBondContact O-CD1 3.49Å; A259-I263 VanDerWaalsContact O-CG1 3.28Å; A259-I263 WeakPolarHBondContact O-CG1 3.4Å
260	I	94.8	Very high	89.8	Confident	76 Å²	76	62.9 Å²	62.9	39%	0.39	32%	0.32	S	S	.	.	H	α-helix	trans	-67.2	-47.9	178.2	-67.8	165.6	0	0	0	110.9	L199 I203 S256 L257 I258 L262 I263 L264	L199-I260 HydrophobicContact CD2-CD1 4.43Å; L199-I260 HydrophobicContact CD2-CG1 4.31Å; I203-I260 HydrophobicContact CD1-CG1 4.2Å; S256-I260 VanDerWaalsContact O-CG1 3.31Å; S256-I260 WeakPolarHBondContact O-CG1 3.37Å; S256-I260 PolarHBondContact O-N 2.69Å; L257-I260 PolarHBondContact O-N 3.33Å; I258-I260 VanDerWaalsContact C-N 3.33Å; I258-I260 PolarHBondContact O-N 2.85Å; I260-L262 VanDerWaalsContact C-N 3.33Å; I260-L262 PolarHBondContact O-N 2.69Å; I260-I263 PolarHBondContact O-N 2.72Å; I260-L264 HydrophobicContact CG2-CD1 3.7Å; I260-L264 HydrophobicContact CG2-CG 4.15Å; I260-L264 WeakPolarHBondContact O-CG 3.15Å; I260-L264 PolarHBondContact O-N 2.84Å
261	L	92.4	Very high	89.3	Confident	79 Å²	79	65.2 Å²	65.2	41%	0.414	33%	0.327	S	S	.	.	H	α-helix	trans	-58.8	-42.5	-177.3	-75	174	0	0	0	112.5	L257 I258 I263 L264 L265	L257-L261 HydrophobicContact CD1-CD1 4.09Å; L257-L261 HydrophobicContact CD1-CG 4.15Å; L257-L261 HydrophobicContact CG-CD1 3.89Å; L257-L261 HydrophobicContact CG-CG 4.36Å; L257-L261 WeakPolarHBondContact O-CB 3.15Å; L257-L261 VanDerWaalsContact O-CG 3.28Å; L257-L261 WeakPolarHBondContact O-CG 3.43Å; L257-L261 PolarHBondContact O-N 3.25Å; I258-L261 PolarHBondContact O-N 2.66Å; L261-I263 VanDerWaalsContact C-N 3.28Å; L261-I263 PolarHBondContact O-N 2.89Å; L261-L264 PolarHBondContact O-N 3.44Å; L261-L265 WeakPolarHBondContact O-CB 3.48Å; L261-L265 WeakPolarHBondContact O-CD1 3.43Å; L261-L265 WeakPolarHBondContact O-CG 3.44Å; L261-L265 PolarHBondContact O-N 2.88Å
262	L	87.2	Confident	88.7	Confident	35 Å²	35	69.3 Å²	69.3	18%	0.183	35%	0.347	C	S	.	.	H	α-helix	trans	-67.3	-31.5	-179.9	-71.1	163.5	0	0	0	113.6	Y196 I258 I260 H266	Y196-L262 HydrophobicContact CE2-CD1 3.9Å; I258-L262 HydrophobicContact CG2-CD1 3.85Å; I258-L262 HydrophobicContact CG2-CG 4.48Å; I258-L262 WeakPolarHBondContact O-CD1 2.99Å; I258-L262 WeakPolarHBondContact O-CG 3.23Å; I258-L262 PolarHBondContact O-N 2.76Å; I258-L262 VanDerWaalsContact O-N 3.12Å; I260-L262 VanDerWaalsContact C-N 3.33Å; I260-L262 PolarHBondContact O-N 2.69Å; L262-H266 PolarHBondContact O-N 3.03Å
263	I	81	Confident	88.1	Confident	32 Å²	32	71.4 Å²	71.4	16%	0.164	36%	0.357	C	S	.	.	H	α-helix	trans	-75.7	-43.1	178.3	-65.1	171.8	0	0	0	109.4	F200 I203 A259 I260 L261 L265 H266 E267	F200-I263 HydrophobicContact CD2-CD1 4.32Å; F200-I263 HydrophobicContact CD2-CG1 4.43Å; F200-I263 HydrophobicContact CE2-CG1 4.49Å; I203-I263 HydrophobicContact CB-CD1 3.5Å; I203-I263 HydrophobicContact CD1-CD1 3.71Å; I203-I263 HydrophobicContact CG1-CD1 4.21Å; I203-I263 HydrophobicContact CG2-CD1 3.4Å; I203-I263 HydrophobicContact CG2-CG2 4.01Å; A259-I263 WeakPolarHBondContact O-CD1 3.49Å; A259-I263 VanDerWaalsContact O-CG1 3.28Å; A259-I263 WeakPolarHBondContact O-CG1 3.4Å; I260-I263 PolarHBondContact O-N 2.72Å; L261-I263 VanDerWaalsContact C-N 3.28Å; L261-I263 PolarHBondContact O-N 2.89Å; I263-L265 VanDerWaalsContact C-N 3.27Å; I263-L265 PolarHBondContact O-N 3.29Å; I263-H266 WeakPolarHBondContact O-CB 3.48Å; I263-H266 PolarHBondContact O-N 3.29Å; I263-E267 PolarHBondContact O-N 3.4Å
264	L	82.1	Confident	87.3	Confident	104 Å²	104	66.5 Å²	66.5	55%	0.545	34%	0.339	S	S	.	.	H	α-helix	trans	-63.1	-32	174.5	-68.2	177.1	0	0	0	112.9	I260 L261 H266	I260-L264 HydrophobicContact CG2-CD1 3.7Å; I260-L264 HydrophobicContact CG2-CG 4.15Å; I260-L264 WeakPolarHBondContact O-CG 3.15Å; I260-L264 PolarHBondContact O-N 2.84Å; L261-L264 PolarHBondContact O-N 3.44Å; L264-H266 PolarHBondContact O-N 2.94Å
265	L	78.1	Confident	86.5	Confident	143 Å²	143	69 Å²	69	75%	0.749	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-11.7	174.9	-73.1	167	0	0	0	113.3	L261 I263	L261-L265 WeakPolarHBondContact O-CB 3.48Å; L261-L265 WeakPolarHBondContact O-CD1 3.43Å; L261-L265 WeakPolarHBondContact O-CG 3.44Å; L261-L265 PolarHBondContact O-N 2.88Å; I263-L265 VanDerWaalsContact C-N 3.27Å; I263-L265 PolarHBondContact O-N 3.29Å
266	H	68.1	Low	85.5	Confident	101 Å²	101	74.8 Å²	74.8	47%	0.468	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-26.6	179.2	-179.8	61.2	0	0	0	113.4	Y121 L262 I263 L264	Y121-H266 AromaticContact CE2-CE1 3.76Å; Y121-H266 AromaticContact CE2-ND1 3.75Å; Y121-H266 AromaticContact CZ-CE1 3.89Å; Y121-H266 AromaticContact CZ-ND1 3.5Å; Y121-H266 PolarHBondContact OH-ND1 3.32Å; L262-H266 PolarHBondContact O-N 3.03Å; I263-H266 WeakPolarHBondContact O-CB 3.48Å; I263-H266 PolarHBondContact O-N 3.29Å; L264-H266 PolarHBondContact O-N 2.94Å
267	E	54.2	Low	84.4	Confident	202 Å²	202	78.4 Å²	78.4	94%	0.944	39%	0.393	S	S	*	.			trans	-75.2	0	175.9	-65.9	-171.1	166	0	0	112.4	I263	I263-E267 PolarHBondContact O-N 3.4Å

Retrieved 267 of 267 residues in 674.2 ms (Link to these results)

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