X6RDF7_HUMAN Loading...

Solute carrier family 22 member 7

AlphaFold DB , UniProt , Accession X6RDF7, Species HUMAN (Homo sapiens, Human), Gene SLC22A7, Length 211 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	53.4	Low	245 Å²	245	146.2 Å²	146.2	100%	1.207	75%	0.748	S	S	*	*				0	95.1	0	-69	-178.1	177.1	0	0	107.8
2	L	42.9	Very low	54.2	Low	174 Å²	174	142 Å²	142	91%	0.911	73%	0.734	S	S	*	*			trans	-110.8	117.5	-173.7	-88.6	129.4	0	0	0	109.5	P4	L2-P4 WeakPolarHBondContact O-CD 3.38Å
3	Q	45.4	Very low	54.6	Low	182 Å²	182	136 Å²	136	85%	0.85	71%	0.712	S	S	*	*			trans	-69.6	118.3	-179.8	-92.2	166.8	-52.1	0	0	111.7
4	P	49.6	Very low	54.8	Low	115 Å²	115	137.6 Å²	137.6	75%	0.747	71%	0.711	S	S	*	*			trans	-90.4	6.8	179.7	16.6	-3.1	0	0	0	115.4	L2	L2-P4 WeakPolarHBondContact O-CD 3.38Å
5	H	56.2	Low	55.2	Low	162 Å²	162	134.7 Å²	134.7	75%	0.75	70%	0.701	S	S	*	*	S	Bend	trans	-92.1	-9.1	-163.9	-153.1	-38.9	0	0	0	116.1	P8	H5-P8 WeakPolarHBondContact O-CD 3.44Å
6	L	55.3	Low	55.5	Low	138 Å²	138	128.8 Å²	128.8	72%	0.723	68%	0.678	S	S	*	*	S	Bend	trans	-97.7	-9.4	-171.2	-71.8	167.6	0	0	0	115.9	P8	L6-P8 VanDerWaalsContact C-CD 3.43Å
7	L	58.8	Low	55.5	Low	135 Å²	135	124.3 Å²	124.3	71%	0.707	66%	0.663	S	S	*	*	H	α-helix	trans	-65.7	-33.8	179.8	-69.2	168.9	0	0	0	116.3	Y9 A11	L7-Y9 PolarHBondContact O-N 3.2Å; L7-A11 WeakPolarHBondContact O-CB 3.48Å; L7-A11 PolarHBondContact O-N 3.46Å
8	P	59.8	Low	55.2	Low	77 Å²	77	119.6 Å²	119.6	50%	0.5	65%	0.65	S	S	.	*	H	α-helix	trans	-70.4	-34.3	-175.5	24.4	-30.4	0	0	0	112.4	H5 L6 A11 V12	H5-P8 WeakPolarHBondContact O-CD 3.44Å; L6-P8 VanDerWaalsContact C-CD 3.43Å; P8-A11 PolarHBondContact O-N 3.3Å; P8-V12 WeakPolarHBondContact O-CB 3.38Å; P8-V12 WeakPolarHBondContact O-CG2 3.45Å; P8-V12 PolarHBondContact O-N 2.84Å
9	Y	60.2	Low	55	Low	188 Å²	188	120.4 Å²	120.4	74%	0.737	65%	0.649	S	S	*	*	H	α-helix	trans	-71.2	-39.1	-178	-169.3	-97.1	0	0	0	112.7	L7 S13	L7-Y9 PolarHBondContact O-N 3.2Å; Y9-S13 WeakPolarHBondContact O-CB 3.26Å; Y9-S13 PolarHBondContact O-N 2.88Å
10	Q	58.2	Low	54.6	Low	137 Å²	137	125.7 Å²	125.7	64%	0.64	66%	0.659	S	S	*	*	H	α-helix	trans	-72	-32.9	175.7	-73.6	-155.9	-11.6	0	0	112.7	K14	Q10-K14 WeakPolarHBondContact O-CB 3.46Å; Q10-K14 WeakPolarHBondContact O-CG 3.13Å; Q10-K14 PolarHBondContact O-N 2.78Å
11	A	61.8	Low	54.2	Low	55 Å²	55	125.4 Å²	125.4	46%	0.455	66%	0.662	S	S	.	*	H	α-helix	trans	-67	-45.9	172.5	0	0	0	0	0	111.3	L7 P8 S13 K14 V15	L7-A11 WeakPolarHBondContact O-CB 3.48Å; L7-A11 PolarHBondContact O-N 3.46Å; P8-A11 PolarHBondContact O-N 3.3Å; A11-S13 VanDerWaalsContact C-N 3.34Å; A11-S13 PolarHBondContact O-N 3.47Å; A11-K14 PolarHBondContact O-N 2.9Å; A11-V15 WeakPolarHBondContact O-CB 3.35Å; A11-V15 VanDerWaalsContact O-CG2 3.26Å; A11-V15 WeakPolarHBondContact O-CG2 3.43Å; A11-V15 PolarHBondContact O-N 3.46Å
12	V	62.5	Low	54.8	Low	96 Å²	96	118.2 Å²	118.2	58%	0.582	63%	0.632	S	S	*	*	H	α-helix	trans	-63.9	-39.2	175.5	173	0	0	0	0	111.3	P8 V15 A16	P8-V12 WeakPolarHBondContact O-CB 3.38Å; P8-V12 WeakPolarHBondContact O-CG2 3.45Å; P8-V12 PolarHBondContact O-N 2.84Å; V12-V15 PolarHBondContact O-N 3.17Å; V12-A16 WeakPolarHBondContact O-CB 3.47Å; V12-A16 PolarHBondContact O-N 2.83Å
13	S	60.2	Low	55.4	Low	64 Å²	64	118.9 Å²	118.9	45%	0.448	62%	0.622	S	S	.	*	H	α-helix	trans	-64.6	-42.7	174.2	166.6	0	0	0	0	112.6	Y9 A11 A16 A17	Y9-S13 WeakPolarHBondContact O-CB 3.26Å; Y9-S13 PolarHBondContact O-N 2.88Å; A11-S13 VanDerWaalsContact C-N 3.34Å; A11-S13 PolarHBondContact O-N 3.47Å; S13-A16 PolarHBondContact O-N 3.46Å; S13-A17 WeakPolarHBondContact O-CB 3.47Å; S13-A17 PolarHBondContact O-N 2.77Å
14	K	57.7	Low	55.9	Low	159 Å²	159	121.3 Å²	121.3	69%	0.691	62%	0.623	S	S	*	*	H	α-helix	trans	-69.5	-34.8	175.8	-81.5	-173.6	177	179	0	112.8	Q10 A11 G18	Q10-K14 WeakPolarHBondContact O-CB 3.46Å; Q10-K14 WeakPolarHBondContact O-CG 3.13Å; Q10-K14 PolarHBondContact O-N 2.78Å; A11-K14 PolarHBondContact O-N 2.9Å; K14-G18 PolarHBondContact O-N 3.43Å
15	V	60.7	Low	56.3	Low	93 Å²	93	117.8 Å²	117.8	56%	0.564	60%	0.601	S	S	*	*	H	α-helix	trans	-68.6	-44.4	172.3	173.3	0	0	0	0	110.3	A11 V12 A17 G18 E19	A11-V15 WeakPolarHBondContact O-CB 3.35Å; A11-V15 VanDerWaalsContact O-CG2 3.26Å; A11-V15 WeakPolarHBondContact O-CG2 3.43Å; A11-V15 PolarHBondContact O-N 3.46Å; V12-V15 PolarHBondContact O-N 3.17Å; V15-A17 PolarHBondContact O-N 3.23Å; V15-G18 CarbonylContact O-C 3.58Å; V15-G18 PolarHBondContact O-N 2.81Å; V15-E19 WeakPolarHBondContact O-CB 3.16Å; V15-E19 PolarHBondContact O-N 2.91Å
16	A	59	Low	56.7	Low	40 Å²	40	112.7 Å²	112.7	33%	0.331	58%	0.583	S	S	.	*	H	α-helix	trans	-66.4	-34.6	175.9	0	0	0	0	0	112.8	V12 S13 R20	V12-A16 WeakPolarHBondContact O-CB 3.47Å; V12-A16 PolarHBondContact O-N 2.83Å; S13-A16 PolarHBondContact O-N 3.46Å; A16-R20 WeakPolarHBondContact O-CG 3.19Å; A16-R20 PolarHBondContact O-N 3.16Å
17	A	55.6	Low	57.1	Low	53 Å²	53	111.8 Å²	111.8	44%	0.438	57%	0.571	S	S	.	*	H	α-helix	trans	-73.6	-34.7	173.4	0	0	0	0	0	111.8	S13 V15 R20 V21	S13-A17 WeakPolarHBondContact O-CB 3.47Å; S13-A17 PolarHBondContact O-N 2.77Å; V15-A17 PolarHBondContact O-N 3.23Å; A17-R20 PolarHBondContact O-N 2.95Å; A17-V21 WeakPolarHBondContact O-CG2 3.15Å; A17-V21 PolarHBondContact O-N 3.1Å
18	G	49.9	Very low	57.3	Low	40 Å²	40	111.7 Å²	111.7	41%	0.412	57%	0.571	S	S	.	*	H	α-helix	trans	-66.5	-39.2	170.5	0	0	0	0	0	112.7	K14 V15 V21 V22	K14-G18 PolarHBondContact O-N 3.43Å; V15-G18 CarbonylContact O-C 3.58Å; V15-G18 PolarHBondContact O-N 2.81Å; G18-V21 PolarHBondContact O-N 3.45Å; G18-V21 VanDerWaalsContact O-N 3.17Å; G18-V22 PolarHBondContact O-N 3.43Å
19	E	52.4	Low	57.6	Low	135 Å²	135	110.1 Å²	110.1	63%	0.631	56%	0.558	S	S	*	*	H	α-helix	trans	-65.6	-34.1	172.2	-83.1	-174.8	129.3	0	0	112.4	V15 V21 V22	V15-E19 WeakPolarHBondContact O-CB 3.16Å; V15-E19 PolarHBondContact O-N 2.91Å; E19-V21 PolarHBondContact O-N 2.84Å; E19-V22 WeakPolarHBondContact O-CB 3.48Å; E19-V22 PolarHBondContact O-N 3.41Å
20	R	46	Very low	57.7	Low	225 Å²	225	101.1 Å²	101.1	85%	0.849	52%	0.523	S	S	*	.	H	α-helix	trans	-65.6	-23.8	173	-76.8	-176.5	-166.9	-156.9	5.2	113.1	A16 A17	A16-R20 WeakPolarHBondContact O-CG 3.19Å; A16-R20 PolarHBondContact O-N 3.16Å; A17-R20 PolarHBondContact O-N 2.95Å
21	V	47.8	Very low	58	Low	120 Å²	120	97.9 Å²	97.9	73%	0.727	51%	0.507	S	S	*	.	H	α-helix	trans	-90	-11.4	176.8	-179	0	0	0	0	112.2	A17 G18 E19 R23	A17-V21 WeakPolarHBondContact O-CG2 3.15Å; A17-V21 PolarHBondContact O-N 3.1Å; G18-V21 PolarHBondContact O-N 3.45Å; G18-V21 VanDerWaalsContact O-N 3.17Å; E19-V21 PolarHBondContact O-N 2.84Å; V21-R23 PolarHBondContact O-N 3.36Å
22	V	51.8	Low	58.2	Low	95 Å²	95	103.3 Å²	103.3	58%	0.576	52%	0.515	S	S	*	.	S	Bend	trans	-67.5	87.1	160.1	-175.2	0	0	0	0	106.5	G18 E19 R24	G18-V22 PolarHBondContact O-N 3.43Å; E19-V22 WeakPolarHBondContact O-CB 3.48Å; E19-V22 PolarHBondContact O-N 3.41Å; V22-R24 PolarHBondContact O-N 2.8Å
23	R	54.6	Low	58.7	Low	187 Å²	187	102.4 Å²	102.4	71%	0.706	51%	0.51	S	S	*	.			trans	-37.6	116.4	175.4	-89.7	-177.4	168.4	-177.7	-0.1	108.3	V21 P25	V21-R23 PolarHBondContact O-N 3.36Å; R23-P25 WeakPolarHBondContact O-CD 3.26Å
24	R	55.8	Low	59.3	Low	233 Å²	233	104.4 Å²	104.4	88%	0.879	52%	0.521	S	S	*	.			trans	-52	112.2	169.8	-71.7	-173.4	177.9	-168.4	-0.9	106.3	V22 S26	V22-R24 PolarHBondContact O-N 2.8Å; R24-S26 PolarHBondContact O-N 3.38Å
25	P	58	Low	60.1	Low	42 Å²	42	106.9 Å²	106.9	27%	0.273	53%	0.526	S	S	.	.			trans	-62.7	109.5	-177.6	20	-26.8	0	0	0	107.3	R23 V153 L154	R23-P25 WeakPolarHBondContact O-CD 3.26Å; P25-V153 HydrophobicContact CB-CG1 4.33Å; P25-V153 HydrophobicContact CG-CG1 4.13Å; P25-V153 VanDerWaalsContact CG-O 3.3Å; P25-V153 WeakPolarHBondContact CG-O 3.37Å; P25-L154 HydrophobicContact CB-CD2 3.55Å; P25-L154 HydrophobicContact CB-CG 4.45Å
26	S	65.7	Low	60.7	Low	54 Å²	54	103.7 Å²	103.7	38%	0.378	51%	0.506	S	S	.	.			trans	-75.6	151.7	-179.4	-177.2	0	0	0	0	109	R24 L28 D29	R24-S26 PolarHBondContact O-N 3.38Å; S26-L28 PolarHBondContact O-N 3.18Å; S26-D29 WeakPolarHBondContact O-CB 3.45Å; S26-D29 PolarHBondContact O-N 3.44Å
27	Y	63.2	Low	61.6	Low	119 Å²	119	108.1 Å²	108.1	47%	0.467	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-53	-27.4	172.7	-66.2	-82.4	0	0	0	112.1	L30 F31 T157 L161	Y27-L30 WeakPolarHBondContact O-CB 3.41Å; Y27-L30 PolarHBondContact O-N 2.83Å; Y27-F31 WeakPolarHBondContact O-CD2 3.5Å; Y27-T157 HydrophobicContact CD1-CG2 3.29Å; Y27-T157 HydrophobicContact CD2-CG2 4.41Å; Y27-T157 HydrophobicContact CE1-CG2 3.46Å; Y27-T157 VanDerWaalsContact CE1-CG2 3.46Å; Y27-T157 HydrophobicContact CG-CG2 3.81Å; Y27-L161 HydrophobicContact CD1-CB 4.44Å; Y27-L161 HydrophobicContact CD1-CD1 4.23Å; Y27-L161 HydrophobicContact CE1-CB 4.41Å
28	L	63.4	Low	62.8	Low	134 Å²	134	109.9 Å²	109.9	70%	0.702	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-69.8	-27.7	176.2	-65.4	170.5	0	0	0	113.6	S26 L30 F31 R32	S26-L28 PolarHBondContact O-N 3.18Å; L28-L30 PolarHBondContact O-N 3.16Å; L28-F31 PolarHBondContact O-N 3.32Å; L28-R32 PolarHBondContact O-N 3.46Å
29	D	64.7	Low	64.3	Low	43 Å²	43	109.1 Å²	109.1	23%	0.23	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-69.6	-21.9	174.9	-76.6	-45.1	0	0	0	111.6	S26 F31 R32 L154	S26-D29 WeakPolarHBondContact O-CB 3.45Å; S26-D29 PolarHBondContact O-N 3.44Å; D29-F31 VanDerWaalsContact C-N 3.27Å; D29-F31 PolarHBondContact O-N 3.2Å; D29-R32 WeakPolarHBondContact O-CB 3.49Å; D29-R32 PolarHBondContact O-N 3.35Å; D29-R32 WeakPolarHBondContact OD1-CD 3.06Å; D29-R32 IonicContact OD1-CZ 2.89Å; D29-R32 IonicContact OD1-NH1 3.75Å; D29-R32 PolarHBondContact OD1-NH1 3.25Å; D29-L154 HydrophobicContact CB-CD2 4.31Å
30	L	62.8	Low	65.6	Low	0 Å²	0	102.7 Å²	102.7	0%	0	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-65.2	-31.2	172.7	-139.4	77.9	0	0	0	112.3	Y27 L28 Y150 L154	Y27-L30 WeakPolarHBondContact O-CB 3.41Å; Y27-L30 PolarHBondContact O-N 2.83Å; L28-L30 PolarHBondContact O-N 3.16Å; L30-Y150 HydrophobicContact CD1-CD1 4.01Å; L30-Y150 HydrophobicContact CD1-CE1 3.78Å; L30-Y150 HydrophobicContact CD2-CE1 3.8Å; L30-Y150 HydrophobicContact CG-CE1 3.9Å; L30-L154 HydrophobicContact CD1-CB 3.74Å; L30-L154 HydrophobicContact CD1-CD1 4.32Å; L30-L154 HydrophobicContact CD1-CD2 3.88Å; L30-L154 HydrophobicContact CD1-CG 4.2Å
31	F	63.6	Low	67.4	Low	69 Å²	69	96.9 Å²	96.9	30%	0.303	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-97.2	1.9	-178.1	-66.5	-78.8	0	0	0	113.5	Y27 L28 D29 R37 L161	Y27-F31 WeakPolarHBondContact O-CD2 3.5Å; L28-F31 PolarHBondContact O-N 3.32Å; D29-F31 VanDerWaalsContact C-N 3.27Å; D29-F31 PolarHBondContact O-N 3.2Å; F31-R37 HydrophobicContact CD1-CB 4.29Å; F31-R37 HydrophobicContact CD1-CG 3.91Å; F31-R37 PolarHBondContact O-NE 3.33Å; F31-R37 PolarHBondContact O-NH2 3.03Å; F31-L161 HydrophobicContact CE2-CD1 4.41Å
32	R	66.2	Low	69.1	Low	169 Å²	169	91.4 Å²	91.4	64%	0.638	42%	0.422	S	S	*	.	S	Bend	trans	-75.9	-32.8	-170.4	-163.8	172.1	-174.2	161.5	4.1	113.1	L28 D29	L28-R32 PolarHBondContact O-N 3.46Å; D29-R32 WeakPolarHBondContact O-CB 3.49Å; D29-R32 PolarHBondContact O-N 3.35Å; D29-R32 WeakPolarHBondContact OD1-CD 3.06Å; D29-R32 IonicContact OD1-CZ 2.89Å; D29-R32 IonicContact OD1-NH1 3.75Å; D29-R32 PolarHBondContact OD1-NH1 3.25Å
33	T	74.5	Confident	70.7	Confident	77 Å²	77	87 Å²	87	47%	0.472	40%	0.395	S	S	.	.	S	Bend	trans	-103.4	135.9	174.1	22.7	0	0	0	0	111	R35 L36 R37	T33-R35 VanDerWaalsContact C-N 3.27Å; T33-R35 PolarHBondContact O-N 3.5Å; T33-L36 PolarHBondContact O-N 3.47Å; T33-L36 VanDerWaalsContact O-N 3.13Å; T33-L36 WeakPolarHBondContact OG1-CB 3.39Å; T33-R37 PolarHBondContact O-N 3.09Å
34	P	72.3	Confident	72.2	Confident	105 Å²	105	79.9 Å²	79.9	68%	0.682	37%	0.372	S	S	*	.	H	α-helix	trans	-62.3	-33.8	-175.6	23.1	-32.9	0	0	0	112.7	H38	P34-H38 PolarHBondContact O-N 3.01Å; P34-H38 VanDerWaalsContact O-N 3.11Å
35	R	75.1	Confident	73.7	Confident	212 Å²	212	71.1 Å²	71.1	80%	0.8	34%	0.344	S	S	*	.	H	α-helix	trans	-65	-45.7	174.6	-67.6	-174.9	178.2	179.2	-1	112.1	T33 H38 I39	T33-R35 VanDerWaalsContact C-N 3.27Å; T33-R35 PolarHBondContact O-N 3.5Å; R35-H38 PolarHBondContact O-N 2.65Å; R35-I39 WeakPolarHBondContact O-CD1 3.41Å; R35-I39 VanDerWaalsContact O-CG1 3.3Å; R35-I39 WeakPolarHBondContact O-CG1 3.46Å; R35-I39 PolarHBondContact O-N 3.14Å; R35-I39 VanDerWaalsContact O-N 3.1Å
36	L	72.4	Confident	75.1	Confident	26 Å²	26	69.3 Å²	69.3	14%	0.136	33%	0.333	C	S	.	.	H	α-helix	trans	-70	-35.6	-178.5	-136.6	81.3	0	0	0	111.9	T33 I39 S40 L154	T33-L36 PolarHBondContact O-N 3.47Å; T33-L36 VanDerWaalsContact O-N 3.13Å; T33-L36 WeakPolarHBondContact OG1-CB 3.39Å; L36-I39 PolarHBondContact O-N 3.27Å; L36-S40 WeakPolarHBondContact O-CB 3.49Å; L36-S40 PolarHBondContact O-N 2.83Å; L36-S40 PolarHBondContact O-OG 2.89Å; L36-L154 HydrophobicContact CD2-CD1 3.63Å
37	R	78.3	Confident	76.2	Confident	133 Å²	133	67 Å²	67	50%	0.502	32%	0.316	S	S	.	.	H	α-helix	trans	-59.4	-48.4	171	174.6	177.1	-51.2	177.6	3.7	111.8	F31 T33 S40 L41	F31-R37 HydrophobicContact CD1-CB 4.29Å; F31-R37 HydrophobicContact CD1-CG 3.91Å; F31-R37 PolarHBondContact O-NE 3.33Å; F31-R37 PolarHBondContact O-NH2 3.03Å; T33-R37 PolarHBondContact O-N 3.09Å; R37-S40 PolarHBondContact O-N 2.93Å; R37-L41 VanDerWaalsContact O-CB 3.31Å; R37-L41 WeakPolarHBondContact O-CB 3.25Å; R37-L41 PolarHBondContact O-N 2.84Å
38	H	79.8	Confident	77.4	Confident	90 Å²	90	64 Å²	64	42%	0.417	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-45.1	179.6	-172.8	-91.6	0	0	0	111.6	P34 R35 L41 C42	P34-H38 PolarHBondContact O-N 3.01Å; P34-H38 VanDerWaalsContact O-N 3.11Å; R35-H38 PolarHBondContact O-N 2.65Å; H38-L41 PolarHBondContact O-N 2.92Å; H38-C42 PolarHBondContact O-N 2.79Å; H38-C42 PolarHBondContact O-SG 3.2Å
39	I	81.5	Confident	78.5	Confident	24 Å²	24	57.6 Å²	57.6	12%	0.123	27%	0.272	C	S	.	.	H	α-helix	trans	-59.3	-48	175.2	-70.1	165.1	0	0	0	111.1	R35 L36 C42 C43 L149	R35-I39 WeakPolarHBondContact O-CD1 3.41Å; R35-I39 VanDerWaalsContact O-CG1 3.3Å; R35-I39 WeakPolarHBondContact O-CG1 3.46Å; R35-I39 PolarHBondContact O-N 3.14Å; R35-I39 VanDerWaalsContact O-N 3.1Å; L36-I39 PolarHBondContact O-N 3.27Å; I39-C42 PolarHBondContact O-N 3.09Å; I39-C43 WeakPolarHBondContact O-CB 3.42Å; I39-C43 PolarHBondContact O-N 2.69Å; I39-C43 PolarHBondContact O-SG 3.4Å; I39-L149 HydrophobicContact CB-CD2 4.23Å; I39-L149 HydrophobicContact CD1-CD2 3.95Å; I39-L149 HydrophobicContact CG1-CD2 3.8Å; I39-L149 HydrophobicContact CG2-CB 3.89Å; I39-L149 HydrophobicContact CG2-CD2 3.44Å; I39-L149 VanDerWaalsContact CG2-CD2 3.44Å; I39-L149 HydrophobicContact CG2-CG 4.3Å
40	S	81.3	Confident	79.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-42.9	-177.5	-55.5	0	0	0	0	111.7	L36 R37 C43 V44 Y150	L36-S40 WeakPolarHBondContact O-CB 3.49Å; L36-S40 PolarHBondContact O-N 2.83Å; L36-S40 PolarHBondContact O-OG 2.89Å; R37-S40 PolarHBondContact O-N 2.93Å; S40-C43 PolarHBondContact O-N 3.33Å; S40-V44 WeakPolarHBondContact O-CB 3.37Å; S40-V44 VanDerWaalsContact O-CG2 3.25Å; S40-V44 WeakPolarHBondContact O-CG2 3.4Å; S40-V44 PolarHBondContact O-N 2.98Å; S40-Y150 VanDerWaalsContact CA-OH 3.3Å; S40-Y150 WeakPolarHBondContact CA-OH 3.39Å; S40-Y150 WeakPolarHBondContact CB-OH 3.35Å; S40-Y150 PolarHBondContact OG-OH 2.73Å
41	L	82.3	Confident	80.8	Confident	102 Å²	102	55.8 Å²	55.8	53%	0.534	26%	0.262	S	S	.	.	H	α-helix	trans	-65.1	-42.3	179.3	-163.5	143.1	0	0	0	111.4	R37 H38 V44 V45	R37-L41 VanDerWaalsContact O-CB 3.31Å; R37-L41 WeakPolarHBondContact O-CB 3.25Å; R37-L41 PolarHBondContact O-N 2.84Å; H38-L41 PolarHBondContact O-N 2.92Å; L41-V44 WeakPolarHBondContact O-CB 3.43Å; L41-V44 PolarHBondContact O-N 2.99Å; L41-V45 WeakPolarHBondContact O-CG2 3.44Å; L41-V45 PolarHBondContact O-N 3.06Å; L41-V45 VanDerWaalsContact O-N 3.15Å
42	C	84.8	Confident	81.9	Confident	6 Å²	6	53 Å²	53	4%	0.041	25%	0.25	C	C	.	.	H	α-helix	trans	-68	-40.2	175.2	-62.9	0	0	0	0	112.2	H38 I39 V44 V45 V46 L205	H38-C42 PolarHBondContact O-N 2.79Å; H38-C42 PolarHBondContact O-SG 3.2Å; I39-C42 PolarHBondContact O-N 3.09Å; C42-V44 VanDerWaalsContact C-N 3.31Å; C42-V44 PolarHBondContact O-N 3.25Å; C42-V45 PolarHBondContact O-N 2.93Å; C42-V46 WeakPolarHBondContact O-CG2 3.29Å; C42-V46 PolarHBondContact O-N 3.43Å; C42-L205 HydrophobicContact CB-CD1 3.05Å
43	C	84.1	Confident	82.8	Confident	3 Å²	3	45 Å²	45	2%	0.02	22%	0.219	C	C	.	.	H	α-helix	trans	-59.2	-42.9	174.4	-72.3	0	0	0	0	111.3	I39 S40 V45 V46 W47 T162	I39-C43 WeakPolarHBondContact O-CB 3.42Å; I39-C43 PolarHBondContact O-N 2.69Å; I39-C43 PolarHBondContact O-SG 3.4Å; S40-C43 PolarHBondContact O-N 3.33Å; C43-V45 PolarHBondContact O-N 2.72Å; C43-V46 PolarHBondContact O-N 3.49Å; C43-W47 VanDerWaalsContact O-CB 3.26Å; C43-W47 WeakPolarHBondContact O-CB 3.23Å; C43-W47 PolarHBondContact O-N 3.21Å; C43-T162 HydrophobicContact CB-CG2 3.96Å
44	V	87.4	Confident	83.3	Confident	36 Å²	36	43.7 Å²	43.7	22%	0.218	21%	0.207	C	C	.	.	H	α-helix	trans	-57.3	-47.9	175.9	161.7	0	0	0	0	111.5	S40 L41 C42 W47 F48 L161 V165	S40-V44 WeakPolarHBondContact O-CB 3.37Å; S40-V44 VanDerWaalsContact O-CG2 3.25Å; S40-V44 WeakPolarHBondContact O-CG2 3.4Å; S40-V44 PolarHBondContact O-N 2.98Å; L41-V44 WeakPolarHBondContact O-CB 3.43Å; L41-V44 PolarHBondContact O-N 2.99Å; C42-V44 VanDerWaalsContact C-N 3.31Å; C42-V44 PolarHBondContact O-N 3.25Å; V44-W47 PolarHBondContact O-N 2.9Å; V44-F48 VanDerWaalsContact O-CB 3.31Å; V44-F48 WeakPolarHBondContact O-CB 3.34Å; V44-F48 PolarHBondContact O-N 3.39Å; V44-L161 HydrophobicContact CG2-CD2 3.27Å; V44-V165 HydrophobicContact CG1-CB 4.4Å; V44-V165 HydrophobicContact CG1-CG1 3.84Å; V44-V165 HydrophobicContact CG1-CG2 3.97Å; V44-V165 HydrophobicContact CG2-CG2 4.29Å
45	V	87.1	Confident	83.9	Confident	49 Å²	49	42 Å²	42	30%	0.297	19%	0.187	S	C	.	.	H	α-helix	trans	-65	-44.3	179.4	177.8	0	0	0	0	111.5	L41 C42 C43 F48 G49 T201	L41-V45 WeakPolarHBondContact O-CG2 3.44Å; L41-V45 PolarHBondContact O-N 3.06Å; L41-V45 VanDerWaalsContact O-N 3.15Å; C42-V45 PolarHBondContact O-N 2.93Å; C43-V45 PolarHBondContact O-N 2.72Å; V45-F48 PolarHBondContact O-N 2.69Å; V45-G49 PolarHBondContact O-N 3.04Å; V45-T201 HydrophobicContact CB-CG2 4.31Å; V45-T201 HydrophobicContact CG1-CG2 3.78Å; V45-T201 WeakPolarHBondContact CG1-OG1 3.44Å
46	V	87.4	Confident	84.2	Confident	5 Å²	5	31.9 Å²	31.9	3%	0.03	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-48.4	177.6	168.4	0	0	0	0	110.6	C42 C43 F48 G49 V50 Q99 L103 A142 A202	C42-V46 WeakPolarHBondContact O-CG2 3.29Å; C42-V46 PolarHBondContact O-N 3.43Å; C43-V46 PolarHBondContact O-N 3.49Å; V46-F48 VanDerWaalsContact C-N 3.33Å; V46-F48 PolarHBondContact O-N 3.03Å; V46-G49 PolarHBondContact O-N 3.44Å; V46-V50 HydrophobicContact CG1-CG2 4.23Å; V46-V50 VanDerWaalsContact O-CG2 3.26Å; V46-V50 WeakPolarHBondContact O-CG2 3.47Å; V46-V50 PolarHBondContact O-N 2.88Å; V46-Q99 HydrophobicContact CG1-CG 4.45Å; V46-Q99 VanDerWaalsContact CG1-NE2 3.27Å; V46-L103 HydrophobicContact CG1-CD1 4.25Å; V46-A142 HydrophobicContact CG1-CB 4.2Å; V46-A202 HydrophobicContact CG2-CB 4.11Å
47	W	88.5	Confident	84.5	Confident	6 Å²	6	30.8 Å²	30.8	2%	0.023	14%	0.143	C	C	.	.	H	α-helix	trans	-63.6	-38.2	179.8	-92.6	87.7	0	0	0	113.7	C43 V44 N51 F139 Y143 T146 T162	C43-W47 VanDerWaalsContact O-CB 3.26Å; C43-W47 WeakPolarHBondContact O-CB 3.23Å; C43-W47 PolarHBondContact O-N 3.21Å; V44-W47 PolarHBondContact O-N 2.9Å; W47-N51 WeakPolarHBondContact O-CB 3.09Å; W47-N51 PolarHBondContact O-N 3.46Å; W47-N51 VanDerWaalsContact O-N 3.1Å; W47-N51 PolarHBondContact O-ND2 2.84Å; W47-F139 HydrophobicContact CZ3-CE2 4.29Å; W47-Y143 HydrophobicContact CH2-CD1 4.26Å; W47-Y143 AromaticContact CH2-CD2 3.6Å; W47-Y143 HydrophobicContact CH2-CD2 3.6Å; W47-Y143 AromaticContact CH2-CE1 3.81Å; W47-Y143 HydrophobicContact CH2-CE1 3.81Å; W47-Y143 AromaticContact CH2-CE2 3.02Å; W47-Y143 HydrophobicContact CH2-CE2 3.02Å; W47-Y143 HydrophobicContact CH2-CG 4.2Å; W47-Y143 AromaticContact CH2-CZ 3.2Å; W47-Y143 WeakPolarHBondContact CH2-OH 3.46Å; W47-Y143 HydrophobicContact CZ2-CD1 4.19Å; W47-Y143 AromaticContact CZ2-CD2 3.72Å; W47-Y143 HydrophobicContact CZ2-CD2 3.72Å; W47-Y143 HydrophobicContact CZ2-CE1 4.17Å; W47-Y143 AromaticContact CZ2-CE2 3.65Å; W47-Y143 HydrophobicContact CZ2-CE2 3.65Å; W47-Y143 HydrophobicContact CZ2-CG 4.01Å; W47-Y143 AromaticContact CZ2-CZ 3.95Å; W47-Y143 HydrophobicContact CZ3-CD2 4.43Å; W47-Y143 AromaticContact CZ3-CE2 3.69Å; W47-Y143 HydrophobicContact CZ3-CE2 3.69Å; W47-T146 PolarHBondContact NE1-OG1 3.09Å; W47-T162 HydrophobicContact CG-CG2 4.2Å
48	F	87.8	Confident	84.7	Confident	54 Å²	54	26.2 Å²	26.2	24%	0.237	13%	0.131	C	C	.	.	H	α-helix	trans	-60.1	-52.4	172.1	-175	-95.4	0	0	0	110.6	V44 V45 V46 V50 N51 F52 V165 L172 I194	V44-F48 VanDerWaalsContact O-CB 3.31Å; V44-F48 WeakPolarHBondContact O-CB 3.34Å; V44-F48 PolarHBondContact O-N 3.39Å; V45-F48 PolarHBondContact O-N 2.69Å; V46-F48 VanDerWaalsContact C-N 3.33Å; V46-F48 PolarHBondContact O-N 3.03Å; F48-V50 PolarHBondContact O-N 3.3Å; F48-N51 PolarHBondContact O-N 3.17Å; F48-F52 HydrophobicContact CZ-CD2 4.47Å; F48-F52 WeakPolarHBondContact O-CB 3.46Å; F48-F52 PolarHBondContact O-N 3.14Å; F48-V165 HydrophobicContact CB-CG1 3.79Å; F48-V165 HydrophobicContact CD2-CG1 3.96Å; F48-V165 HydrophobicContact CG-CG1 4.37Å; F48-L172 HydrophobicContact CE2-CD1 3.78Å; F48-L172 HydrophobicContact CZ-CD1 3.77Å; F48-I194 HydrophobicContact CD1-CG2 4.18Å; F48-I194 HydrophobicContact CE1-CD1 4.49Å; F48-I194 HydrophobicContact CE1-CG2 4.27Å
49	G	86.3	Confident	84.6	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-39.1	-176.7	0	0	0	0	0	113.9	V45 V46 S53	V45-G49 PolarHBondContact O-N 3.04Å; V46-G49 PolarHBondContact O-N 3.44Å; G49-S53 VanDerWaalsContact O-CB 3.27Å; G49-S53 WeakPolarHBondContact O-CB 2.96Å; G49-S53 PolarHBondContact O-N 3.4Å; G49-S53 PolarHBondContact O-OG 3.49Å
50	V	87.6	Confident	84.2	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-63.3	-51.9	175	176.9	0	0	0	0	110.7	V46 F48 F52 S53 Y54 L103 A138 F139	V46-V50 HydrophobicContact CG1-CG2 4.23Å; V46-V50 VanDerWaalsContact O-CG2 3.26Å; V46-V50 WeakPolarHBondContact O-CG2 3.47Å; V46-V50 PolarHBondContact O-N 2.88Å; F48-V50 PolarHBondContact O-N 3.3Å; V50-F52 PolarHBondContact O-N 3.38Å; V50-S53 PolarHBondContact O-N 3.29Å; V50-Y54 WeakPolarHBondContact O-CB 3.28Å; V50-Y54 PolarHBondContact O-N 3.06Å; V50-L103 HydrophobicContact CG2-CD2 3.72Å; V50-A138 HydrophobicContact CG1-CB 4.42Å; V50-A138 HydrophobicContact CG2-CB 3.95Å; V50-F139 HydrophobicContact CG1-CB 3.75Å; V50-F139 HydrophobicContact CG1-CD2 3.73Å; V50-F139 HydrophobicContact CG1-CG 4.24Å
51	N	89.2	Confident	83.5	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-47.1	179.7	-96.3	-84.5	0	0	0	111.4	W47 F48 S53 Y54 Y55 G166	W47-N51 WeakPolarHBondContact O-CB 3.09Å; W47-N51 PolarHBondContact O-N 3.46Å; W47-N51 VanDerWaalsContact O-N 3.1Å; W47-N51 PolarHBondContact O-ND2 2.84Å; F48-N51 PolarHBondContact O-N 3.17Å; N51-S53 VanDerWaalsContact C-N 3.31Å; N51-S53 PolarHBondContact O-N 3.47Å; N51-Y54 PolarHBondContact O-N 3.47Å; N51-Y55 HydrophobicContact CB-CD2 4.36Å; N51-Y55 HydrophobicContact CB-CE2 4.5Å; N51-Y55 WeakPolarHBondContact O-CD2 3.25Å; N51-Y55 PolarHBondContact O-N 2.99Å; N51-Y55 VanDerWaalsContact OD1-CE2 3.25Å; N51-Y55 WeakPolarHBondContact OD1-CE2 3.3Å; N51-G166 WeakPolarHBondContact CB-O 3.49Å; N51-G166 VanDerWaalsContact CG-O 3.26Å; N51-G166 VanDerWaalsContact ND2-CA 3.34Å; N51-G166 WeakPolarHBondContact ND2-CA 3Å; N51-G166 PolarHBondContact OD1-O 3.36Å
52	F	85.4	Confident	82.5	Confident	10 Å²	10	26.6 Å²	26.6	4%	0.044	15%	0.145	C	C	.	.	H	α-helix	trans	-58.2	-44.5	-179.1	-172.1	-97.6	0	0	0	111.5	F48 V50 G56 G169 L172 A173 A176 Y191 I194	F48-F52 HydrophobicContact CZ-CD2 4.47Å; F48-F52 WeakPolarHBondContact O-CB 3.46Å; F48-F52 PolarHBondContact O-N 3.14Å; V50-F52 PolarHBondContact O-N 3.38Å; F52-G56 PolarHBondContact O-N 3.18Å; F52-G169 WeakPolarHBondContact CD2-O 3.23Å; F52-L172 HydrophobicContact CD2-CB 4.18Å; F52-L172 HydrophobicContact CE2-CB 3.98Å; F52-A173 HydrophobicContact CD2-CB 4.3Å; F52-A176 HydrophobicContact CE2-CB 4Å; F52-A176 HydrophobicContact CZ-CB 3.49Å; F52-A176 VanDerWaalsContact CZ-CB 3.49Å; F52-Y191 AromaticContact CD1-CD1 3.49Å; F52-Y191 HydrophobicContact CD1-CD1 3.49Å; F52-Y191 VanDerWaalsContact CD1-CD1 3.49Å; F52-Y191 AromaticContact CD1-CE1 3.98Å; F52-Y191 HydrophobicContact CD1-CE1 3.98Å; F52-Y191 AromaticContact CE1-CD1 3.15Å; F52-Y191 HydrophobicContact CE1-CD1 3.15Å; F52-Y191 AromaticContact CE1-CE1 3.46Å; F52-Y191 HydrophobicContact CE1-CE1 3.46Å; F52-Y191 VanDerWaalsContact CE1-CE1 3.46Å; F52-Y191 HydrophobicContact CE1-CG 4.2Å; F52-Y191 HydrophobicContact CE2-CE1 4.31Å; F52-Y191 HydrophobicContact CG-CD1 4.4Å; F52-Y191 AromaticContact CZ-CD1 3.87Å; F52-Y191 HydrophobicContact CZ-CD1 3.87Å; F52-Y191 AromaticContact CZ-CE1 3.66Å; F52-Y191 HydrophobicContact CZ-CE1 3.66Å; F52-I194 HydrophobicContact CD1-CB 4.15Å; F52-I194 HydrophobicContact CD1-CD1 3.55Å; F52-I194 HydrophobicContact CD1-CG1 4.44Å; F52-I194 HydrophobicContact CD1-CG2 4.09Å; F52-I194 HydrophobicContact CE1-CB 4.49Å; F52-I194 HydrophobicContact CE1-CD1 3.26Å; F52-I194 HydrophobicContact CE1-CG1 4.41Å; F52-I194 HydrophobicContact CE2-CD1 4.44Å; F52-I194 HydrophobicContact CG-CD1 4.27Å; F52-I194 HydrophobicContact CZ-CD1 3.76Å
53	S	85.8	Confident	81.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69.7	-40.3	177.4	-55	0	0	0	0	112.8	G49 V50 N51 G56 L57	G49-S53 VanDerWaalsContact O-CB 3.27Å; G49-S53 WeakPolarHBondContact O-CB 2.96Å; G49-S53 PolarHBondContact O-N 3.4Å; G49-S53 PolarHBondContact O-OG 3.49Å; V50-S53 PolarHBondContact O-N 3.29Å; N51-S53 VanDerWaalsContact C-N 3.31Å; N51-S53 PolarHBondContact O-N 3.47Å; S53-G56 PolarHBondContact O-N 3.32Å; S53-L57 WeakPolarHBondContact O-CB 3.33Å; S53-L57 PolarHBondContact O-N 3.29Å
54	Y	85.8	Confident	80.4	Confident	51 Å²	51	29.7 Å²	29.7	20%	0.2	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-47.3	178.4	179.6	-89.3	0	0	0	111.8	V50 N51 S58 K132 S135 E136	V50-Y54 WeakPolarHBondContact O-CB 3.28Å; V50-Y54 PolarHBondContact O-N 3.06Å; N51-Y54 PolarHBondContact O-N 3.47Å; Y54-S58 WeakPolarHBondContact O-CB 3.12Å; Y54-S58 PolarHBondContact O-N 3.43Å; Y54-S58 VanDerWaalsContact O-N 3.15Å; Y54-S58 PolarHBondContact O-OG 2.91Å; Y54-K132 HydrophobicContact CE2-CD 4.35Å; Y54-K132 PolarHBondContact OH-NZ 2.85Å; Y54-K132 VanDerWaalsContact OH-NZ 3.08Å; Y54-S135 WeakPolarHBondContact CA-OG 3.25Å; Y54-S135 PolarHBondContact N-OG 3.33Å; Y54-E136 WeakPolarHBondContact CE2-OE2 3.29Å
55	Y	84.8	Confident	79.2	Confident	68 Å²	68	31.1 Å²	31.1	27%	0.267	20%	0.199	S	C	.	.	H	α-helix	trans	-71.6	-40.4	177.2	-76.4	-68.6	0	0	0	111.8	N51 L57 S58 L59 A173	N51-Y55 HydrophobicContact CB-CD2 4.36Å; N51-Y55 HydrophobicContact CB-CE2 4.5Å; N51-Y55 WeakPolarHBondContact O-CD2 3.25Å; N51-Y55 PolarHBondContact O-N 2.99Å; N51-Y55 VanDerWaalsContact OD1-CE2 3.25Å; N51-Y55 WeakPolarHBondContact OD1-CE2 3.3Å; Y55-L57 VanDerWaalsContact C-N 3.32Å; Y55-L57 PolarHBondContact O-N 3.09Å; Y55-S58 PolarHBondContact O-N 3.35Å; Y55-S58 VanDerWaalsContact O-N 3.11Å; Y55-L59 VanDerWaalsContact O-CG 3.31Å; Y55-L59 WeakPolarHBondContact O-CG 3.43Å; Y55-L59 PolarHBondContact O-N 2.87Å; Y55-A173 VanDerWaalsContact CB-CB 3.47Å
56	G	81.1	Confident	78.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56	-46.2	174.9	0	0	0	0	0	112.6	F52 S53 S58 L59 D60 Y191	F52-G56 PolarHBondContact O-N 3.18Å; S53-G56 PolarHBondContact O-N 3.32Å; G56-S58 VanDerWaalsContact C-N 3.33Å; G56-S58 PolarHBondContact O-N 3.46Å; G56-L59 PolarHBondContact O-N 3.07Å; G56-D60 WeakPolarHBondContact O-CB 3.5Å; G56-D60 PolarHBondContact O-N 3.45Å; G56-Y191 VanDerWaalsContact CA-CE1 3.41Å
57	L	79	Confident	77.9	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-37.4	176.9	-163.3	74	0	0	0	112.5	S53 Y55 L59 D60 V61 F110 A128 G131 K132	S53-L57 WeakPolarHBondContact O-CB 3.33Å; S53-L57 PolarHBondContact O-N 3.29Å; Y55-L57 VanDerWaalsContact C-N 3.32Å; Y55-L57 PolarHBondContact O-N 3.09Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-D60 PolarHBondContact O-N 2.95Å; L57-V61 WeakPolarHBondContact O-CG2 3.3Å; L57-V61 PolarHBondContact O-N 3.31Å; L57-F110 HydrophobicContact CB-CZ 3.95Å; L57-F110 HydrophobicContact CD1-CE1 3.89Å; L57-F110 HydrophobicContact CD1-CZ 3.77Å; L57-F110 HydrophobicContact CG-CZ 4.44Å; L57-A128 WeakPolarHBondContact CD2-O 3.46Å; L57-G131 VanDerWaalsContact CD2-C 3.46Å; L57-K132 HydrophobicContact CD2-CB 3.54Å; L57-K132 HydrophobicContact CD2-CD 3.98Å; L57-K132 HydrophobicContact CD2-CG 4.37Å
58	S	81.4	Confident	77.5	Confident	36 Å²	36	41 Å²	41	25%	0.252	25%	0.253	S	S	.	.	H	α-helix	trans	-71.1	-29.4	-179.6	-54.5	0	0	0	0	112.3	Y54 Y55 G56 V61 K132	Y54-S58 WeakPolarHBondContact O-CB 3.12Å; Y54-S58 PolarHBondContact O-N 3.43Å; Y54-S58 VanDerWaalsContact O-N 3.15Å; Y54-S58 PolarHBondContact O-OG 2.91Å; Y55-S58 PolarHBondContact O-N 3.35Å; Y55-S58 VanDerWaalsContact O-N 3.11Å; G56-S58 VanDerWaalsContact C-N 3.33Å; G56-S58 PolarHBondContact O-N 3.46Å; S58-V61 WeakPolarHBondContact O-CB 3.47Å; S58-V61 WeakPolarHBondContact O-CG2 3.35Å; S58-K132 PolarHBondContact OG-NZ 2.93Å
59	L	77.4	Confident	77.3	Confident	73 Å²	73	48.2 Å²	48.2	38%	0.382	28%	0.28	S	S	.	.	H	α-helix	trans	-76.1	-39.3	174.3	-70	167.7	0	0	0	111.8	Y55 G56 L57 V61 S62 A173 P174 A177	Y55-L59 VanDerWaalsContact O-CG 3.31Å; Y55-L59 WeakPolarHBondContact O-CG 3.43Å; Y55-L59 PolarHBondContact O-N 2.87Å; G56-L59 PolarHBondContact O-N 3.07Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L59-V61 PolarHBondContact O-N 3.44Å; L59-S62 PolarHBondContact O-N 3.46Å; L59-S62 PolarHBondContact O-OG 3.09Å; L59-A173 HydrophobicContact CD1-CB 4.27Å; L59-P174 HydrophobicContact CD1-CB 3.9Å; L59-A177 HydrophobicContact CD1-CB 4.32Å
60	D	73	Confident	77.1	Confident	40 Å²	40	53 Å²	53	21%	0.214	30%	0.303	C	S	.	.	H	α-helix	trans	-67.9	-14.5	178.1	-175.2	-94.7	0	0	0	113.4	G56 L57 S62 G63 R113	G56-D60 WeakPolarHBondContact O-CB 3.5Å; G56-D60 PolarHBondContact O-N 3.45Å; L57-D60 PolarHBondContact O-N 2.95Å; D60-S62 PolarHBondContact O-N 2.87Å; D60-S62 VanDerWaalsContact O-N 3.09Å; D60-G63 PolarHBondContact O-N 2.76Å; D60-R113 IonicContact OD1-CZ 3.09Å; D60-R113 IonicContact OD1-NH1 3.98Å; D60-R113 PolarHBondContact OD1-NH1 3.49Å; D60-R113 IonicContact OD1-NH2 2.93Å; D60-R113 PolarHBondContact OD1-NH2 3.35Å
61	V	68.1	Low	76.9	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.048	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-51.3	-33.9	172.7	170.5	0	0	0	0	112.9	L57 S58 L59 G63 L64 T71 F75	L57-V61 WeakPolarHBondContact O-CG2 3.3Å; L57-V61 PolarHBondContact O-N 3.31Å; S58-V61 WeakPolarHBondContact O-CB 3.47Å; S58-V61 WeakPolarHBondContact O-CG2 3.35Å; L59-V61 PolarHBondContact O-N 3.44Å; V61-G63 PolarHBondContact O-N 2.89Å; V61-G63 VanDerWaalsContact O-N 3.14Å; V61-L64 HydrophobicContact CB-CD1 4.5Å; V61-L64 HydrophobicContact CG1-CD1 4.48Å; V61-L64 HydrophobicContact CG2-CD1 4.47Å; V61-L64 WeakPolarHBondContact O-CB 3.48Å; V61-L64 PolarHBondContact O-N 3.35Å; V61-L64 VanDerWaalsContact O-N 3.11Å; V61-T71 HydrophobicContact CG1-CG2 3.84Å; V61-T71 WeakPolarHBondContact CG1-OG1 3.22Å; V61-F75 HydrophobicContact CG2-CD2 4.04Å; V61-F75 HydrophobicContact CG2-CE1 4.49Å; V61-F75 HydrophobicContact CG2-CE2 3.06Å; V61-F75 HydrophobicContact CG2-CZ 3.35Å
62	S	60.8	Low	76.6	Confident	104 Å²	104	58 Å²	58	73%	0.727	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-61.4	-23	-179.2	-46.2	0	0	0	0	112.6	L59 D60	L59-S62 PolarHBondContact O-N 3.46Å; L59-S62 PolarHBondContact O-OG 3.09Å; D60-S62 PolarHBondContact O-N 2.87Å; D60-S62 VanDerWaalsContact O-N 3.09Å
63	G	62.2	Low	76.7	Confident	66 Å²	66	63.8 Å²	63.8	68%	0.68	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-88.2	-3.1	178.5	0	0	0	0	0	115.3	D60 V61 G65	D60-G63 PolarHBondContact O-N 2.76Å; V61-G63 PolarHBondContact O-N 2.89Å; V61-G63 VanDerWaalsContact O-N 3.14Å; G63-G65 VanDerWaalsContact C-N 3.28Å; G63-G65 PolarHBondContact O-N 3.28Å
64	L	62.5	Low	76.7	Confident	8 Å²	8	67 Å²	67	4%	0.042	37%	0.373	C	S	.	.	S	Bend	trans	-76.2	-7.8	-173.7	-75.7	169.5	0	0	0	114.8	V61 L66 T71 A128	V61-L64 HydrophobicContact CB-CD1 4.5Å; V61-L64 HydrophobicContact CG1-CD1 4.48Å; V61-L64 HydrophobicContact CG2-CD1 4.47Å; V61-L64 WeakPolarHBondContact O-CB 3.48Å; V61-L64 PolarHBondContact O-N 3.35Å; V61-L64 VanDerWaalsContact O-N 3.11Å; L64-L66 PolarHBondContact O-N 3.27Å; L64-T71 HydrophobicContact CD1-CG2 4.35Å; L64-A128 HydrophobicContact CD1-CB 3.87Å; L64-A128 HydrophobicContact CD2-CB 4Å
65	G	61.9	Low	76.6	Confident	66 Å²	66	65 Å²	65	68%	0.68	37%	0.366	S	S	*	.	S	Bend	trans	69.8	11.8	180	0	0	0	0	0	114.7	G63	G63-G65 VanDerWaalsContact C-N 3.28Å; G63-G65 PolarHBondContact O-N 3.28Å
66	L	67.3	Low	76.7	Confident	70 Å²	70	63.5 Å²	63.5	37%	0.366	37%	0.37	S	S	.	.	S	Bend	trans	-103.8	157.9	171.8	-71.9	174.5	0	0	0	110.1	L64 V68 T71 T125	L64-L66 PolarHBondContact O-N 3.27Å; L66-V68 PolarHBondContact O-N 3.06Å; L66-T71 HydrophobicContact CB-CG2 3.58Å; L66-T71 HydrophobicContact CD1-CG2 4.03Å; L66-T71 HydrophobicContact CG-CG2 4.45Å; L66-T125 HydrophobicContact CD1-CG2 3.7Å
67	N	80.1	Confident	77.1	Confident	110 Å²	110	66.1 Å²	66.1	59%	0.588	39%	0.393	S	S	*	.			trans	-62.9	137.5	172.3	-78.8	-46.3	0	0	0	110.3	Y69 Q70 T71	N67-Y69 PolarHBondContact O-N 2.66Å; N67-Y69 VanDerWaalsContact O-N 3.08Å; N67-Q70 HydrophobicContact CB-CG 4.38Å; N67-Q70 PolarHBondContact O-N 2.93Å; N67-T71 PolarHBondContact O-N 3.37Å; N67-T71 PolarHBondContact O-OG1 2.88Å
68	V	80.5	Confident	77.6	Confident	87 Å²	87	67.2 Å²	67.2	53%	0.527	40%	0.399	S	S	.	.	H	α-helix	trans	-53	-35.4	-179.3	-179	0	0	0	0	112.1	L66 T71 Q72	L66-V68 PolarHBondContact O-N 3.06Å; V68-T71 WeakPolarHBondContact CA-OG1 3.45Å; V68-T71 PolarHBondContact O-OG1 3.48Å; V68-Q72 WeakPolarHBondContact O-CB 3.47Å; V68-Q72 PolarHBondContact O-N 3.49Å
69	Y	84.3	Confident	77.8	Confident	205 Å²	205	68.2 Å²	68.2	80%	0.804	40%	0.4	S	S	*	.	H	α-helix	trans	-64.2	-40.3	176.3	-61.8	-74.9	0	0	0	113.2	N67 L73	N67-Y69 PolarHBondContact O-N 2.66Å; N67-Y69 VanDerWaalsContact O-N 3.08Å; Y69-L73 WeakPolarHBondContact O-CB 3.21Å; Y69-L73 PolarHBondContact O-N 2.83Å
70	Q	81.3	Confident	78.3	Confident	102 Å²	102	70.9 Å²	70.9	48%	0.477	41%	0.414	S	S	.	.	H	α-helix	trans	-72.1	-41.5	-179	-70.2	178	-41.3	0	0	111.3	N67 Q72 L73 L74	N67-Q70 HydrophobicContact CB-CG 4.38Å; N67-Q70 PolarHBondContact O-N 2.93Å; Q70-Q72 VanDerWaalsContact C-N 3.33Å; Q70-Q72 PolarHBondContact O-N 3.32Å; Q70-L73 PolarHBondContact O-N 3.2Å; Q70-L74 WeakPolarHBondContact O-CB 3.35Å; Q70-L74 PolarHBondContact O-N 2.81Å
71	T	82.6	Confident	79	Confident	3 Å²	3	72.1 Å²	72.1	2%	0.018	42%	0.424	C	S	.	.	H	α-helix	trans	-64.9	-38.7	176.9	50	0	0	0	0	111.7	V61 L64 L66 N67 V68 L74 F75	V61-T71 HydrophobicContact CG1-CG2 3.84Å; V61-T71 WeakPolarHBondContact CG1-OG1 3.22Å; L64-T71 HydrophobicContact CD1-CG2 4.35Å; L66-T71 HydrophobicContact CB-CG2 3.58Å; L66-T71 HydrophobicContact CD1-CG2 4.03Å; L66-T71 HydrophobicContact CG-CG2 4.45Å; N67-T71 PolarHBondContact O-N 3.37Å; N67-T71 PolarHBondContact O-OG1 2.88Å; V68-T71 WeakPolarHBondContact CA-OG1 3.45Å; V68-T71 PolarHBondContact O-OG1 3.48Å; T71-L74 PolarHBondContact O-N 3.14Å; T71-F75 WeakPolarHBondContact O-CB 3.3Å; T71-F75 WeakPolarHBondContact O-CD1 3.39Å; T71-F75 WeakPolarHBondContact O-CG 3.47Å; T71-F75 PolarHBondContact O-N 3.07Å
72	Q	84.2	Confident	79.9	Confident	108 Å²	108	72 Å²	72	51%	0.505	42%	0.424	S	S	.	.	H	α-helix	trans	-68.6	-39.2	176.6	-133.8	73.3	-65.8	0	0	112.4	V68 Q70 F75 G76	V68-Q72 WeakPolarHBondContact O-CB 3.47Å; V68-Q72 PolarHBondContact O-N 3.49Å; Q70-Q72 VanDerWaalsContact C-N 3.33Å; Q70-Q72 PolarHBondContact O-N 3.32Å; Q72-F75 PolarHBondContact O-N 2.95Å; Q72-G76 PolarHBondContact O-N 3.31Å
73	L	87.1	Confident	81.1	Confident	130 Å²	130	71 Å²	71	68%	0.681	41%	0.407	S	S	*	.	H	α-helix	trans	-63.6	-42.7	175.2	-174.4	137.9	0	0	0	111.4	Y69 Q70 G76 A77	Y69-L73 WeakPolarHBondContact O-CB 3.21Å; Y69-L73 PolarHBondContact O-N 2.83Å; Q70-L73 PolarHBondContact O-N 3.2Å; L73-G76 PolarHBondContact O-N 3.3Å; L73-A77 VanDerWaalsContact O-CB 3.26Å; L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 2.98Å
74	L	85.3	Confident	82.2	Confident	68 Å²	68	73.4 Å²	73.4	36%	0.356	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-45.3	173.4	-88	156.9	0	0	0	112.1	Q70 T71 A77 V78	Q70-L74 WeakPolarHBondContact O-CB 3.35Å; Q70-L74 PolarHBondContact O-N 2.81Å; T71-L74 PolarHBondContact O-N 3.14Å; L74-A77 PolarHBondContact O-N 3.46Å; L74-V78 WeakPolarHBondContact O-CB 3.49Å; L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 2.98Å
75	F	84.9	Confident	83.3	Confident	9 Å²	9	78.3 Å²	78.3	4%	0.039	43%	0.428	C	S	.	.	H	α-helix	trans	-63.2	-44.9	179	-78.8	7.3	0	0	0	112.3	V61 T71 Q72 V78 E79 V129 K132	V61-F75 HydrophobicContact CG2-CD2 4.04Å; V61-F75 HydrophobicContact CG2-CE1 4.49Å; V61-F75 HydrophobicContact CG2-CE2 3.06Å; V61-F75 HydrophobicContact CG2-CZ 3.35Å; T71-F75 WeakPolarHBondContact O-CB 3.3Å; T71-F75 WeakPolarHBondContact O-CD1 3.39Å; T71-F75 WeakPolarHBondContact O-CG 3.47Å; T71-F75 PolarHBondContact O-N 3.07Å; Q72-F75 PolarHBondContact O-N 2.95Å; F75-V78 PolarHBondContact O-N 3.47Å; F75-E79 PolarHBondContact O-N 3.11Å; F75-E79 VanDerWaalsContact O-N 3.17Å; F75-V129 HydrophobicContact CD1-CG2 4.37Å; F75-V129 HydrophobicContact CE1-CG2 4.11Å; F75-K132 HydrophobicContact CB-CG 4.34Å; F75-K132 HydrophobicContact CD1-CB 4.22Å; F75-K132 HydrophobicContact CD1-CG 4.01Å; F75-K132 HydrophobicContact CD2-CD 3.94Å; F75-K132 HydrophobicContact CD2-CG 4Å; F75-K132 HydrophobicContact CE1-CB 4.03Å; F75-K132 HydrophobicContact CE1-CG 4.22Å; F75-K132 HydrophobicContact CE2-CD 3.95Å; F75-K132 HydrophobicContact CE2-CG 4.15Å; F75-K132 HydrophobicContact CG-CD 4.34Å; F75-K132 HydrophobicContact CG-CG 3.89Å; F75-K132 HydrophobicContact CZ-CB 4.18Å; F75-K132 HydrophobicContact CZ-CD 4.43Å; F75-K132 HydrophobicContact CZ-CG 4.27Å
76	G	86.8	Confident	84.4	Confident	36 Å²	36	75.4 Å²	75.4	37%	0.371	40%	0.398	S	S	.	.	H	α-helix	trans	-64.7	-40.5	175.2	0	0	0	0	0	112.7	Q72 L73 V78 E79	Q72-G76 PolarHBondContact O-N 3.31Å; L73-G76 PolarHBondContact O-N 3.3Å; G76-V78 VanDerWaalsContact C-N 3.31Å; G76-V78 PolarHBondContact O-N 3.34Å; G76-E79 WeakPolarHBondContact O-CB 3.33Å; G76-E79 PolarHBondContact O-N 3.27Å
77	A	89.1	Confident	85.3	Confident	56 Å²	56	79 Å²	79	46%	0.463	41%	0.407	S	S	.	.	H	α-helix	trans	-64.4	-35.5	178.1	0	0	0	0	0	112.5	L73 L74 E79 P81	L73-A77 VanDerWaalsContact O-CB 3.26Å; L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 2.98Å; L74-A77 PolarHBondContact O-N 3.46Å; A77-E79 VanDerWaalsContact C-N 3.35Å; A77-P81 WeakPolarHBondContact O-CD 3.31Å
78	V	88.3	Confident	85.5	Confident	27 Å²	27	77.5 Å²	77.5	16%	0.164	40%	0.399	C	S	.	.	H	α-helix	trans	-78.2	-21	-180	167.6	0	0	0	0	112.3	L74 F75 G76 L80 P81 S82 V129 A133	L74-V78 WeakPolarHBondContact O-CB 3.49Å; L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 2.98Å; F75-V78 PolarHBondContact O-N 3.47Å; G76-V78 VanDerWaalsContact C-N 3.31Å; G76-V78 PolarHBondContact O-N 3.34Å; V78-L80 VanDerWaalsContact C-N 3.34Å; V78-L80 PolarHBondContact O-N 3.1Å; V78-P81 VanDerWaalsContact O-CD 3.25Å; V78-P81 WeakPolarHBondContact O-CD 3.3Å; V78-P81 VanDerWaalsContact O-CG 3.3Å; V78-P81 WeakPolarHBondContact O-CG 3.16Å; V78-S82 VanDerWaalsContact O-CB 3.3Å; V78-S82 WeakPolarHBondContact O-CB 3.41Å; V78-S82 PolarHBondContact O-N 3.46Å; V78-S82 VanDerWaalsContact O-N 3.14Å; V78-S82 PolarHBondContact O-OG 3.37Å; V78-V129 HydrophobicContact CB-CG1 4.15Å; V78-V129 HydrophobicContact CG1-CG1 3.99Å; V78-V129 HydrophobicContact CG2-CG1 3.38Å; V78-A133 HydrophobicContact CG1-CB 3.59Å
79	E	86.1	Confident	85.5	Confident	57 Å²	57	75.2 Å²	75.2	27%	0.266	39%	0.387	S	S	.	.	H	α-helix	trans	-62.4	-40.7	177.9	-142.1	-178.5	110.7	0	0	112.4	F75 G76 A77 S82 K83 E136	F75-E79 PolarHBondContact O-N 3.11Å; F75-E79 VanDerWaalsContact O-N 3.17Å; G76-E79 WeakPolarHBondContact O-CB 3.33Å; G76-E79 PolarHBondContact O-N 3.27Å; A77-E79 VanDerWaalsContact C-N 3.35Å; E79-S82 PolarHBondContact O-N 2.91Å; E79-K83 WeakPolarHBondContact O-CG 3.44Å; E79-K83 PolarHBondContact O-N 3.01Å; E79-K83 IonicContact OE1-NZ 3.47Å; E79-K83 PolarHBondContact OE1-NZ 3.19Å; E79-E136 HydrophobicContact CG-CB 4.43Å; E79-E136 VanDerWaalsContact CG-CD 3.47Å; E79-E136 HydrophobicContact CG-CG 3.47Å; E79-E136 VanDerWaalsContact CG-CG 3.47Å
80	L	87.8	Confident	85.5	Confident	128 Å²	128	66.7 Å²	66.7	67%	0.67	36%	0.356	S	S	*	.	H	α-helix	trans	-61.1	-56.6	179.2	-64.1	175.8	0	0	0	113.5	V78 S82 K83 L84	V78-L80 VanDerWaalsContact C-N 3.34Å; V78-L80 PolarHBondContact O-N 3.1Å; L80-S82 PolarHBondContact O-N 3.29Å; L80-K83 PolarHBondContact O-N 3.04Å; L80-L84 PolarHBondContact O-N 3.1Å
81	P	87.3	Confident	85.4	Confident	66 Å²	66	70 Å²	70	43%	0.429	36%	0.364	S	S	.	.	H	α-helix	trans	-65	-31.3	177.8	26	-34.2	0	0	0	111.6	A77 V78 K83 L84 L85	A77-P81 WeakPolarHBondContact O-CD 3.31Å; V78-P81 VanDerWaalsContact O-CD 3.25Å; V78-P81 WeakPolarHBondContact O-CD 3.3Å; V78-P81 VanDerWaalsContact O-CG 3.3Å; V78-P81 WeakPolarHBondContact O-CG 3.16Å; P81-K83 PolarHBondContact O-N 2.57Å; P81-L84 WeakPolarHBondContact O-CB 3.31Å; P81-L84 PolarHBondContact O-N 3.3Å; P81-L85 WeakPolarHBondContact O-CB 3.45Å; P81-L85 PolarHBondContact O-N 2.89Å
82	S	86.9	Confident	85.2	Confident	7 Å²	7	78.5 Å²	78.5	5%	0.049	40%	0.397	C	S	.	.	H	α-helix	trans	-61.4	-42.8	176.4	-59.6	0	0	0	0	111.8	V78 E79 L80 L84 L85 V86 A133	V78-S82 VanDerWaalsContact O-CB 3.3Å; V78-S82 WeakPolarHBondContact O-CB 3.41Å; V78-S82 PolarHBondContact O-N 3.46Å; V78-S82 VanDerWaalsContact O-N 3.14Å; V78-S82 PolarHBondContact O-OG 3.37Å; E79-S82 PolarHBondContact O-N 2.91Å; L80-S82 PolarHBondContact O-N 3.29Å; S82-L84 PolarHBondContact O-N 3.31Å; S82-L85 WeakPolarHBondContact O-CB 3.41Å; S82-L85 PolarHBondContact O-N 3.42Å; S82-V86 WeakPolarHBondContact O-CG2 3.13Å; S82-V86 PolarHBondContact O-N 3.47Å; S82-A133 VanDerWaalsContact OG-CA 3.31Å; S82-A133 WeakPolarHBondContact OG-CA 3.36Å; S82-A133 WeakPolarHBondContact OG-CB 3.48Å
83	K	86	Confident	84.7	Confident	83 Å²	83	75.7 Å²	75.7	36%	0.361	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-38.6	176.7	-73.8	176.5	-180	162.3	0	112.7	E79 L80 P81 V86 Y87 E136	E79-K83 WeakPolarHBondContact O-CG 3.44Å; E79-K83 PolarHBondContact O-N 3.01Å; E79-K83 IonicContact OE1-NZ 3.47Å; E79-K83 PolarHBondContact OE1-NZ 3.19Å; L80-K83 PolarHBondContact O-N 3.04Å; P81-K83 PolarHBondContact O-N 2.57Å; K83-V86 PolarHBondContact O-N 2.96Å; K83-Y87 PolarHBondContact O-N 2.72Å; K83-E136 WeakPolarHBondContact CE-OE1 3.41Å; K83-E136 IonicContact NZ-OE1 2.89Å; K83-E136 PolarHBondContact NZ-OE1 3.18Å; K83-E136 VanDerWaalsContact NZ-OE1 3.09Å
84	L	86.9	Confident	84.1	Confident	116 Å²	116	70.3 Å²	70.3	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-62.3	-44.1	171.6	-96.3	150.3	0	0	0	111.8	L80 P81 S82 V86 Y87 L88	L80-L84 PolarHBondContact O-N 3.1Å; P81-L84 WeakPolarHBondContact O-CB 3.31Å; P81-L84 PolarHBondContact O-N 3.3Å; S82-L84 PolarHBondContact O-N 3.31Å; L84-V86 PolarHBondContact O-N 2.87Å; L84-Y87 WeakPolarHBondContact O-CB 3.16Å; L84-Y87 PolarHBondContact O-N 3.13Å; L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 2.8Å
85	L	84.1	Confident	83.5	Confident	110 Å²	110	71.8 Å²	71.8	58%	0.576	37%	0.369	S	S	*	.	H	α-helix	trans	-62.4	-41.4	177.2	-117.2	154.1	0	0	0	112	P81 S82 L88 S89	P81-L85 WeakPolarHBondContact O-CB 3.45Å; P81-L85 PolarHBondContact O-N 2.89Å; S82-L85 WeakPolarHBondContact O-CB 3.41Å; S82-L85 PolarHBondContact O-N 3.42Å; L85-L88 PolarHBondContact O-N 3.24Å; L85-S89 VanDerWaalsContact O-CB 3.25Å; L85-S89 WeakPolarHBondContact O-CB 3.36Å; L85-S89 PolarHBondContact O-N 2.96Å; L85-S89 PolarHBondContact O-OG 3.01Å
86	V	85.4	Confident	83.2	Confident	6 Å²	6	75 Å²	75	4%	0.036	38%	0.381	C	S	.	.	H	α-helix	trans	-59.3	-50.1	172.7	167.6	0	0	0	0	110.8	S82 K83 L84 L88 S89 V90 A137 T140 T141	S82-V86 WeakPolarHBondContact O-CG2 3.13Å; S82-V86 PolarHBondContact O-N 3.47Å; K83-V86 PolarHBondContact O-N 2.96Å; L84-V86 PolarHBondContact O-N 2.87Å; V86-L88 VanDerWaalsContact C-N 3.3Å; V86-L88 PolarHBondContact O-N 2.64Å; V86-S89 PolarHBondContact O-N 3.17Å; V86-S89 VanDerWaalsContact O-N 3.16Å; V86-V90 HydrophobicContact CG1-CG2 4.08Å; V86-V90 WeakPolarHBondContact O-CB 3.26Å; V86-V90 VanDerWaalsContact O-CG2 3.29Å; V86-V90 WeakPolarHBondContact O-CG2 3.35Å; V86-V90 PolarHBondContact O-N 2.64Å; V86-A137 HydrophobicContact CG2-CB 3.3Å; V86-T140 HydrophobicContact CG1-CG2 3.9Å; V86-T141 HydrophobicContact CG1-CG2 3.43Å; V86-T141 VanDerWaalsContact CG1-CG2 3.43Å; V86-T141 HydrophobicContact CG2-CG2 4.38Å
87	Y	86.1	Confident	82.9	Confident	144 Å²	144	78 Å²	78	57%	0.565	39%	0.388	S	S	*	.	H	α-helix	trans	-56.9	-45.7	-178.9	175.6	-97	0	0	0	111.5	K83 L84 R91	K83-Y87 PolarHBondContact O-N 2.72Å; L84-Y87 WeakPolarHBondContact O-CB 3.16Å; L84-Y87 PolarHBondContact O-N 3.13Å; Y87-R91 WeakPolarHBondContact O-CB 3.42Å; Y87-R91 PolarHBondContact O-N 2.96Å
88	L	84.1	Confident	82.7	Confident	79 Å²	79	75.7 Å²	75.7	41%	0.414	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-46.9	175.4	-68.3	171.5	0	0	0	111.7	L84 L85 V86 V90 R91 Y92	L84-L88 WeakPolarHBondContact O-CG 3.39Å; L84-L88 PolarHBondContact O-N 2.8Å; L85-L88 PolarHBondContact O-N 3.24Å; V86-L88 VanDerWaalsContact C-N 3.3Å; V86-L88 PolarHBondContact O-N 2.64Å; L88-V90 PolarHBondContact O-N 3.44Å; L88-R91 WeakPolarHBondContact O-CB 3.46Å; L88-R91 PolarHBondContact O-N 2.9Å; L88-R91 VanDerWaalsContact O-N 3.1Å; L88-Y92 HydrophobicContact CD2-CE2 4.21Å; L88-Y92 VanDerWaalsContact O-CD2 3.26Å; L88-Y92 WeakPolarHBondContact O-CD2 3.39Å; L88-Y92 PolarHBondContact O-N 3.47Å
89	S	81.9	Confident	82.4	Confident	40 Å²	40	74.5 Å²	74.5	28%	0.28	36%	0.361	S	S	.	.	H	α-helix	trans	-62.6	-42.8	-177.5	-59.9	0	0	0	0	111.9	L85 V86 R91 Y92 A93 T98	L85-S89 VanDerWaalsContact O-CB 3.25Å; L85-S89 WeakPolarHBondContact O-CB 3.36Å; L85-S89 PolarHBondContact O-N 2.96Å; L85-S89 PolarHBondContact O-OG 3.01Å; V86-S89 PolarHBondContact O-N 3.17Å; V86-S89 VanDerWaalsContact O-N 3.16Å; S89-R91 VanDerWaalsContact C-N 3.28Å; S89-R91 PolarHBondContact O-N 2.95Å; S89-Y92 PolarHBondContact O-N 3.26Å; S89-A93 WeakPolarHBondContact O-CA 3.16Å; S89-A93 WeakPolarHBondContact O-CB 3.46Å; S89-A93 PolarHBondContact O-N 3.38Å; S89-T98 VanDerWaalsContact C-OG1 3.27Å; S89-T98 PolarHBondContact O-OG1 3Å
90	V	83.1	Confident	82.4	Confident	25 Å²	25	72 Å²	72	15%	0.152	35%	0.35	C	S	.	.	H	α-helix	trans	-60.8	-39.8	174.7	169.8	0	0	0	0	111.1	V86 L88 G94 R95 T98 T141 L144	V86-V90 HydrophobicContact CG1-CG2 4.08Å; V86-V90 WeakPolarHBondContact O-CB 3.26Å; V86-V90 VanDerWaalsContact O-CG2 3.29Å; V86-V90 WeakPolarHBondContact O-CG2 3.35Å; V86-V90 PolarHBondContact O-N 2.64Å; L88-V90 PolarHBondContact O-N 3.44Å; V90-G94 PolarHBondContact O-N 3.43Å; V90-R95 HydrophobicContact CG1-CG 3.74Å; V90-T98 HydrophobicContact CG2-CG2 4.03Å; V90-T98 PolarHBondContact N-OG1 3.27Å; V90-T141 HydrophobicContact CG2-CG2 3.86Å; V90-L144 HydrophobicContact CG1-CD2 3.97Å; V90-L144 HydrophobicContact CG2-CD2 4.36Å
91	R	80.3	Confident	82.2	Confident	173 Å²	173	67.7 Å²	67.7	65%	0.653	34%	0.337	S	S	*	.	H	α-helix	trans	-69.6	-38.2	180	-172.7	173.6	179.3	176.6	-2	113.1	Y87 L88 S89	Y87-R91 WeakPolarHBondContact O-CB 3.42Å; Y87-R91 PolarHBondContact O-N 2.96Å; L88-R91 WeakPolarHBondContact O-CB 3.46Å; L88-R91 PolarHBondContact O-N 2.9Å; L88-R91 VanDerWaalsContact O-N 3.1Å; S89-R91 VanDerWaalsContact C-N 3.28Å; S89-R91 PolarHBondContact O-N 2.95Å
92	Y	77.6	Confident	82.2	Confident	181 Å²	181	65.1 Å²	65.1	71%	0.71	32%	0.32	S	S	*	.	H	α-helix	trans	-95.5	-49.2	-175.5	-74.8	-74.9	0	0	0	114.1	L88 S89	L88-Y92 HydrophobicContact CD2-CE2 4.21Å; L88-Y92 VanDerWaalsContact O-CD2 3.26Å; L88-Y92 WeakPolarHBondContact O-CD2 3.39Å; L88-Y92 PolarHBondContact O-N 3.47Å; S89-Y92 PolarHBondContact O-N 3.26Å
93	A	73.2	Confident	82.1	Confident	49 Å²	49	64.9 Å²	64.9	41%	0.405	32%	0.318	S	S	.	.	H	α-helix	trans	-89.9	-13.2	-173.6	0	0	0	0	0	113.4	S89	S89-A93 WeakPolarHBondContact O-CA 3.16Å; S89-A93 WeakPolarHBondContact O-CB 3.46Å; S89-A93 PolarHBondContact O-N 3.38Å
94	G	74.3	Confident	82.2	Confident	17 Å²	17	64.3 Å²	64.3	18%	0.175	32%	0.319	C	S	.	.			trans	82.6	158.9	-175.3	0	0	0	0	0	113.1	V90 T98	V90-G94 PolarHBondContact O-N 3.43Å; G94-T98 WeakPolarHBondContact O-CB 3.47Å; G94-T98 PolarHBondContact O-N 3.28Å; G94-T98 PolarHBondContact O-OG1 2.99Å
95	R	74	Confident	82.1	Confident	98 Å²	98	59.3 Å²	59.3	37%	0.37	30%	0.295	S	S	.	.	H	α-helix	trans	-67.1	-42.7	-165.2	-69.1	154.7	172.7	168.6	-6.8	114	V90 T98 Q99 F145 E148	V90-R95 HydrophobicContact CG1-CG 3.74Å; R95-T98 PolarHBondContact O-N 3.3Å; R95-Q99 PolarHBondContact O-N 3.42Å; R95-F145 HydrophobicContact CB-CD2 4.32Å; R95-E148 WeakPolarHBondContact CD-OE2 3.26Å; R95-E148 IonicContact CZ-OE1 2.87Å; R95-E148 IonicContact CZ-OE2 2.95Å; R95-E148 IonicContact NE-OE1 2.76Å; R95-E148 PolarHBondContact NE-OE1 3.4Å; R95-E148 VanDerWaalsContact NE-OE1 3.14Å; R95-E148 IonicContact NE-OE2 3.14Å; R95-E148 PolarHBondContact NE-OE2 3.19Å; R95-E148 IonicContact NH1-OE1 3.85Å; R95-E148 IonicContact NH1-OE2 3.02Å; R95-E148 PolarHBondContact NH1-OE2 3.23Å; R95-E148 VanDerWaalsContact NH1-OE2 3.09Å; R95-E148 VanDerWaalsContact NH2-CD 3.28Å; R95-E148 IonicContact NH2-OE1 3.09Å; R95-E148 PolarHBondContact NH2-OE1 2.91Å; R95-E148 IonicContact NH2-OE2 2.65Å; R95-E148 PolarHBondContact NH2-OE2 3.37Å
96	R	78.7	Confident	82.2	Confident	77 Å²	77	54.1 Å²	54.1	29%	0.291	27%	0.267	S	S	.	.	H	α-helix	trans	-66	-49.8	-180	179.6	-176.6	172.6	-149	4.5	112.1	T98 Q99 A100 L203 L205 E207	R96-T98 VanDerWaalsContact C-N 3.28Å; R96-T98 PolarHBondContact O-N 3.17Å; R96-Q99 PolarHBondContact O-N 3.35Å; R96-A100 WeakPolarHBondContact O-CB 3.48Å; R96-A100 PolarHBondContact O-N 2.89Å; R96-L203 PolarHBondContact NE-O 3.18Å; R96-L203 PolarHBondContact NH2-O 3.15Å; R96-L205 WeakPolarHBondContact CD-O 3.38Å; R96-L205 PolarHBondContact NE-O 3.1Å; R96-E207 HydrophobicContact CB-CG 4.4Å; R96-E207 VanDerWaalsContact CD-CG 3.49Å; R96-E207 IonicContact CZ-OE1 2.71Å; R96-E207 IonicContact NH1-OE1 2.72Å; R96-E207 PolarHBondContact NH1-OE1 3.22Å
97	L	80	Confident	82.2	Confident	99 Å²	99	54.1 Å²	54.1	52%	0.518	27%	0.268	S	S	.	.	H	α-helix	trans	-65	-35.4	179.1	-66.4	-179.1	0	0	0	111.4	G101	L97-G101 WeakPolarHBondContact O-CA 3.46Å; L97-G101 PolarHBondContact O-N 3.42Å
98	T	84.7	Confident	82.2	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.043	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-49.1	174.7	-50	0	0	0	0	111	S89 V90 G94 R95 R96 A100 G101 T102 T141	S89-T98 VanDerWaalsContact C-OG1 3.27Å; S89-T98 PolarHBondContact O-OG1 3Å; V90-T98 HydrophobicContact CG2-CG2 4.03Å; V90-T98 PolarHBondContact N-OG1 3.27Å; G94-T98 WeakPolarHBondContact O-CB 3.47Å; G94-T98 PolarHBondContact O-N 3.28Å; G94-T98 PolarHBondContact O-OG1 2.99Å; R95-T98 PolarHBondContact O-N 3.3Å; R96-T98 VanDerWaalsContact C-N 3.28Å; R96-T98 PolarHBondContact O-N 3.17Å; T98-A100 PolarHBondContact O-N 3.41Å; T98-G101 PolarHBondContact O-N 3.4Å; T98-T102 HydrophobicContact CG2-CG2 4.29Å; T98-T102 WeakPolarHBondContact O-CG2 3.48Å; T98-T102 PolarHBondContact O-N 3.22Å; T98-T102 PolarHBondContact O-OG1 3.39Å; T98-T141 HydrophobicContact CG2-CG2 3.78Å
99	Q	83.1	Confident	82.2	Confident	3 Å²	3	49.4 Å²	49.4	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-49.2	178.7	-174.5	70.1	32	0	0	112.1	V46 R95 R96 T102 L103 A138 T141 A202	V46-Q99 HydrophobicContact CG1-CG 4.45Å; V46-Q99 VanDerWaalsContact CG1-NE2 3.27Å; R95-Q99 PolarHBondContact O-N 3.42Å; R96-Q99 PolarHBondContact O-N 3.35Å; Q99-T102 PolarHBondContact O-OG1 2.9Å; Q99-L103 HydrophobicContact CG-CD1 4.23Å; Q99-L103 WeakPolarHBondContact O-CB 3.4Å; Q99-L103 WeakPolarHBondContact O-CG 3.39Å; Q99-L103 PolarHBondContact O-N 3.03Å; Q99-L103 VanDerWaalsContact O-N 3.14Å; Q99-A138 PolarHBondContact NE2-O 3.21Å; Q99-T141 PolarHBondContact OE1-OG1 3.26Å; Q99-A202 HydrophobicContact CB-CB 4.43Å; Q99-A202 HydrophobicContact CG-CB 3.79Å
100	A	84.9	Confident	82.2	Confident	3 Å²	3	47.8 Å²	47.8	3%	0.025	24%	0.242	C	C	.	.	H	α-helix	trans	-64.5	-44.1	178.8	0	0	0	0	0	111	R96 T98 T102 L103 L104 A202 L203	R96-A100 WeakPolarHBondContact O-CB 3.48Å; R96-A100 PolarHBondContact O-N 2.89Å; T98-A100 PolarHBondContact O-N 3.41Å; A100-T102 PolarHBondContact O-N 3.05Å; A100-L103 PolarHBondContact O-N 2.87Å; A100-L104 WeakPolarHBondContact O-CB 3.47Å; A100-L104 VanDerWaalsContact O-CG 3.26Å; A100-L104 WeakPolarHBondContact O-CG 3.44Å; A100-L104 PolarHBondContact O-N 2.91Å; A100-A202 HydrophobicContact CB-CB 4.37Å; A100-L203 HydrophobicContact CB-CD2 3.52Å; A100-L203 HydrophobicContact CB-CG 3.85Å
101	G	84.4	Confident	82	Confident	39 Å²	39	48.2 Å²	48.2	40%	0.402	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-42.8	178.8	0	0	0	0	0	113.1	L97 T98 L104 G105	L97-G101 WeakPolarHBondContact O-CA 3.46Å; L97-G101 PolarHBondContact O-N 3.42Å; T98-G101 PolarHBondContact O-N 3.4Å; G101-L104 PolarHBondContact O-N 2.89Å; G101-G105 PolarHBondContact O-N 2.96Å
102	T	86.1	Confident	82	Confident	12 Å²	12	42.7 Å²	42.7	7%	0.074	24%	0.236	C	C	.	.	H	α-helix	trans	-67.6	-37	177.2	51.4	0	0	0	0	112.3	T98 Q99 A100 T106 A137 A138	T98-T102 HydrophobicContact CG2-CG2 4.29Å; T98-T102 WeakPolarHBondContact O-CG2 3.48Å; T98-T102 PolarHBondContact O-N 3.22Å; T98-T102 PolarHBondContact O-OG1 3.39Å; Q99-T102 PolarHBondContact O-OG1 2.9Å; A100-T102 PolarHBondContact O-N 3.05Å; T102-T106 PolarHBondContact O-N 3.47Å; T102-T106 PolarHBondContact O-OG1 2.84Å; T102-A137 HydrophobicContact CG2-CB 3.6Å; T102-A138 WeakPolarHBondContact OG1-CA 3.4Å; T102-A138 WeakPolarHBondContact OG1-CB 3.32Å
103	L	85.3	Confident	81.9	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-71.6	-41.3	176.5	-78.3	167.5	0	0	0	112	V46 V50 Q99 A100 T106 A107 A138 A198 A199 A202	V46-L103 HydrophobicContact CG1-CD1 4.25Å; V50-L103 HydrophobicContact CG2-CD2 3.72Å; Q99-L103 HydrophobicContact CG-CD1 4.23Å; Q99-L103 WeakPolarHBondContact O-CB 3.4Å; Q99-L103 WeakPolarHBondContact O-CG 3.39Å; Q99-L103 PolarHBondContact O-N 3.03Å; Q99-L103 VanDerWaalsContact O-N 3.14Å; A100-L103 PolarHBondContact O-N 2.87Å; L103-T106 WeakPolarHBondContact O-CB 3.43Å; L103-T106 PolarHBondContact O-N 2.82Å; L103-A107 PolarHBondContact O-N 3.01Å; L103-A138 HydrophobicContact CD2-CB 4.08Å; L103-A138 HydrophobicContact CG-CB 4.08Å; L103-A198 HydrophobicContact CD1-CB 4.07Å; L103-A198 HydrophobicContact CD2-CB 4.15Å; L103-A199 HydrophobicContact CB-CB 3.72Å; L103-A202 HydrophobicContact CD1-CB 4.05Å
104	L	87.6	Confident	82	Confident	71 Å²	71	35.4 Å²	35.4	37%	0.372	20%	0.202	S	C	.	.	H	α-helix	trans	-62	-43.5	172.1	-72.2	175.9	0	0	0	111.2	A100 G101 T106 A107 L108 L196 A199	A100-L104 WeakPolarHBondContact O-CB 3.47Å; A100-L104 VanDerWaalsContact O-CG 3.26Å; A100-L104 WeakPolarHBondContact O-CG 3.44Å; A100-L104 PolarHBondContact O-N 2.91Å; G101-L104 PolarHBondContact O-N 2.89Å; L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 3.2Å; L104-A107 PolarHBondContact O-N 3.41Å; L104-L108 WeakPolarHBondContact O-CB 3.49Å; L104-L108 VanDerWaalsContact O-CG 3.26Å; L104-L108 WeakPolarHBondContact O-CG 3.13Å; L104-L108 PolarHBondContact O-N 2.98Å; L104-L196 HydrophobicContact CD2-CD2 3.99Å; L104-A199 HydrophobicContact CD2-CB 3.62Å; L104-A199 HydrophobicContact CG-CB 3.79Å
105	G	85.5	Confident	81.9	Confident	10 Å²	10	41.8 Å²	41.8	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-40.8	175	0	0	0	0	0	112.3	G101 L108 A109	G101-G105 PolarHBondContact O-N 2.96Å; G105-L108 PolarHBondContact O-N 3.29Å; G105-A109 WeakPolarHBondContact O-CB 3.29Å; G105-A109 PolarHBondContact O-N 2.9Å
106	T	85.6	Confident	81.8	Confident	1 Å²	1	40 Å²	40	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-46.2	174	-52.8	0	0	0	0	111.4	T102 L103 L104 A109 F110 F134 S135	T102-T106 PolarHBondContact O-N 3.47Å; T102-T106 PolarHBondContact O-OG1 2.84Å; L103-T106 WeakPolarHBondContact O-CB 3.43Å; L103-T106 PolarHBondContact O-N 2.82Å; L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 3.2Å; T106-A109 WeakPolarHBondContact O-CB 3.42Å; T106-A109 PolarHBondContact O-N 3.27Å; T106-F110 HydrophobicContact CG2-CD2 4.12Å; T106-F110 HydrophobicContact CG2-CE2 3.91Å; T106-F110 VanDerWaalsContact O-CD2 3.3Å; T106-F110 WeakPolarHBondContact O-CD2 3.29Å; T106-F110 PolarHBondContact O-N 3.18Å; T106-F134 VanDerWaalsContact OG1-C 3.28Å; T106-F134 WeakPolarHBondContact OG1-CB 3.35Å; T106-S135 PolarHBondContact OG1-N 3.5Å
107	A	85.3	Confident	80.7	Confident	6 Å²	6	40.3 Å²	40.3	5%	0.05	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-42.3	177.2	0	0	0	0	0	112.8	L103 L104 A109 F110 G111 A195 L196	L103-A107 PolarHBondContact O-N 3.01Å; L104-A107 PolarHBondContact O-N 3.41Å; A107-A109 VanDerWaalsContact C-N 3.33Å; A107-F110 PolarHBondContact O-N 2.86Å; A107-G111 PolarHBondContact O-N 2.92Å; A107-A195 HydrophobicContact CB-CB 3.98Å; A107-L196 HydrophobicContact CB-CD2 3.54Å; A107-L196 HydrophobicContact CB-CG 3.62Å
108	L	86.5	Confident	79.6	Confident	117 Å²	117	40.7 Å²	40.7	61%	0.613	26%	0.256	S	S	*	.	H	α-helix	trans	-64.3	-38.2	175.2	-72.3	170.3	0	0	0	111.2	L104 G105 F110 G111 T112	L104-L108 WeakPolarHBondContact O-CB 3.49Å; L104-L108 VanDerWaalsContact O-CG 3.26Å; L104-L108 WeakPolarHBondContact O-CG 3.13Å; L104-L108 PolarHBondContact O-N 2.98Å; G105-L108 PolarHBondContact O-N 3.29Å; L108-F110 PolarHBondContact O-N 3.47Å; L108-G111 PolarHBondContact O-N 3.3Å; L108-T112 WeakPolarHBondContact O-CB 3.36Å; L108-T112 VanDerWaalsContact O-CG2 3.29Å; L108-T112 WeakPolarHBondContact O-CG2 3.44Å; L108-T112 PolarHBondContact O-N 2.91Å; L108-T112 PolarHBondContact O-OG1 3.49Å
109	A	84	Confident	78.5	Confident	8 Å²	8	47.5 Å²	47.5	7%	0.066	29%	0.292	C	S	.	.	H	α-helix	trans	-61.6	-42.8	173.7	0	0	0	0	0	111.4	G105 T106 A107 T112 R113	G105-A109 WeakPolarHBondContact O-CB 3.29Å; G105-A109 PolarHBondContact O-N 2.9Å; T106-A109 WeakPolarHBondContact O-CB 3.42Å; T106-A109 PolarHBondContact O-N 3.27Å; A107-A109 VanDerWaalsContact C-N 3.33Å; A109-T112 PolarHBondContact O-OG1 3.33Å; A109-T112 VanDerWaalsContact O-OG1 3.06Å; A109-R113 VanDerWaalsContact O-CB 3.25Å; A109-R113 WeakPolarHBondContact O-CB 3.36Å; A109-R113 PolarHBondContact O-N 3.25Å; A109-R113 VanDerWaalsContact O-N 3.13Å
110	F	82.2	Confident	77.8	Confident	6 Å²	6	52.9 Å²	52.9	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-42.6	173.2	-80.8	-71.2	0	0	0	112.9	L57 T106 A107 L108 R113 L114 Y191	L57-F110 HydrophobicContact CB-CZ 3.95Å; L57-F110 HydrophobicContact CD1-CE1 3.89Å; L57-F110 HydrophobicContact CD1-CZ 3.77Å; L57-F110 HydrophobicContact CG-CZ 4.44Å; T106-F110 HydrophobicContact CG2-CD2 4.12Å; T106-F110 HydrophobicContact CG2-CE2 3.91Å; T106-F110 VanDerWaalsContact O-CD2 3.3Å; T106-F110 WeakPolarHBondContact O-CD2 3.29Å; T106-F110 PolarHBondContact O-N 3.18Å; A107-F110 PolarHBondContact O-N 2.86Å; L108-F110 PolarHBondContact O-N 3.47Å; F110-R113 PolarHBondContact O-N 2.94Å; F110-L114 PolarHBondContact O-N 2.88Å; F110-L114 VanDerWaalsContact O-N 3.09Å; F110-Y191 HydrophobicContact CE1-CD2 4.01Å; F110-Y191 HydrophobicContact CE1-CG 4.21Å; F110-Y191 HydrophobicContact CZ-CD2 4.41Å; F110-Y191 HydrophobicContact CZ-CG 4.23Å
111	G	79.9	Confident	77	Confident	34 Å²	34	59.9 Å²	59.9	35%	0.351	35%	0.348	S	S	.	.	H	α-helix	trans	-66.2	-43.4	-179.9	0	0	0	0	0	113.2	A107 L108 R113 L114 L115	A107-G111 PolarHBondContact O-N 2.92Å; L108-G111 PolarHBondContact O-N 3.3Å; G111-R113 VanDerWaalsContact C-N 3.33Å; G111-R113 PolarHBondContact O-N 3.21Å; G111-L114 WeakPolarHBondContact O-CB 3.26Å; G111-L114 PolarHBondContact O-N 2.84Å; G111-L115 WeakPolarHBondContact O-CG 3.48Å; G111-L115 PolarHBondContact O-N 2.89Å
112	T	80	Confident	76.6	Confident	56 Å²	56	62.2 Å²	62.2	34%	0.344	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-37.8	174.8	50.9	0	0	0	0	111.6	L108 A109 L114 L115 V116	L108-T112 WeakPolarHBondContact O-CB 3.36Å; L108-T112 VanDerWaalsContact O-CG2 3.29Å; L108-T112 WeakPolarHBondContact O-CG2 3.44Å; L108-T112 PolarHBondContact O-N 2.91Å; L108-T112 PolarHBondContact O-OG1 3.49Å; A109-T112 PolarHBondContact O-OG1 3.33Å; A109-T112 VanDerWaalsContact O-OG1 3.06Å; T112-L114 PolarHBondContact O-N 3.38Å; T112-L115 PolarHBondContact O-N 3.01Å; T112-L115 VanDerWaalsContact O-N 3.12Å; T112-V116 WeakPolarHBondContact O-CG2 3.31Å; T112-V116 PolarHBondContact O-N 3.34Å
113	R	75.3	Confident	76.2	Confident	14 Å²	14	69.2 Å²	69.2	5%	0.053	38%	0.384	C	S	.	.	H	α-helix	trans	-70.7	-17.4	176.2	-145	174.3	169.3	-147.3	-21.4	114	D60 A109 F110 G111 S124 L127	D60-R113 IonicContact OD1-CZ 3.09Å; D60-R113 IonicContact OD1-NH1 3.98Å; D60-R113 PolarHBondContact OD1-NH1 3.49Å; D60-R113 IonicContact OD1-NH2 2.93Å; D60-R113 PolarHBondContact OD1-NH2 3.35Å; A109-R113 VanDerWaalsContact O-CB 3.25Å; A109-R113 WeakPolarHBondContact O-CB 3.36Å; A109-R113 PolarHBondContact O-N 3.25Å; A109-R113 VanDerWaalsContact O-N 3.13Å; F110-R113 PolarHBondContact O-N 2.94Å; G111-R113 VanDerWaalsContact C-N 3.33Å; G111-R113 PolarHBondContact O-N 3.21Å; R113-S124 PolarHBondContact NE-O 2.79Å; R113-S124 PolarHBondContact NE-OG 2.89Å; R113-S124 VanDerWaalsContact NE-OG 3.14Å; R113-S124 PolarHBondContact NH2-OG 3.43Å; R113-L127 HydrophobicContact CG-CB 4.33Å; R113-L127 HydrophobicContact CG-CD1 4.48Å
114	L	75.3	Confident	75.8	Confident	64 Å²	64	70.5 Å²	70.5	34%	0.335	39%	0.393	S	S	.	.	H	α-helix	trans	-78	-35.2	169.2	-176.5	69.8	0	0	0	111.6	F110 G111 T112 L189	F110-L114 PolarHBondContact O-N 2.88Å; F110-L114 VanDerWaalsContact O-N 3.09Å; G111-L114 WeakPolarHBondContact O-CB 3.26Å; G111-L114 PolarHBondContact O-N 2.84Å; T112-L114 PolarHBondContact O-N 3.38Å; L114-L189 HydrophobicContact CD2-CD1 4.18Å; L114-L189 HydrophobicContact CD2-CG 4.05Å
115	L	72.5	Confident	75.4	Confident	151 Å²	151	68.1 Å²	68.1	79%	0.791	38%	0.381	S	S	*	.	H	α-helix	trans	-81.2	-27.2	-179.2	-66.4	171.2	0	0	0	113.1	G111 T112 S117	G111-L115 WeakPolarHBondContact O-CG 3.48Å; G111-L115 PolarHBondContact O-N 2.89Å; T112-L115 PolarHBondContact O-N 3.01Å; T112-L115 VanDerWaalsContact O-N 3.12Å; L115-S117 PolarHBondContact O-N 3.26Å
116	V	70.1	Confident	75.2	Confident	59 Å²	59	71.2 Å²	71.2	36%	0.358	40%	0.398	S	S	.	.	S	Bend	trans	-77.3	112.3	176.8	170.7	0	0	0	0	109.7	T112 L127	T112-V116 WeakPolarHBondContact O-CG2 3.31Å; T112-V116 PolarHBondContact O-N 3.34Å; V116-L127 HydrophobicContact CG2-CD1 3.97Å
117	S	56.1	Low	75.1	Confident	85 Å²	85	72.4 Å²	72.4	59%	0.594	40%	0.404	S	S	*	.			trans	-65.2	150.3	173.8	-168.5	0	0	0	0	111.9	L115 D119	L115-S117 PolarHBondContact O-N 3.26Å; S117-D119 PolarHBondContact O-N 3.01Å
118	S	58.3	Low	75	Confident	106 Å²	106	72.1 Å²	72.1	74%	0.741	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-3.3	-172.8	-67.6	0	0	0	0	116.7	M120	S118-M120 VanDerWaalsContact C-N 3.34Å; S118-M120 PolarHBondContact O-N 3.47Å
119	D	60.2	Low	75	Confident	150 Å²	150	67.8 Å²	67.8	80%	0.802	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-22	-176.2	-77.4	-47.8	0	0	0	113.9	S117	S117-D119 PolarHBondContact O-N 3.01Å
120	M	68.1	Low	75.1	Confident	116 Å²	116	71.7 Å²	71.7	57%	0.571	40%	0.398	S	S	*	.			trans	-114.9	76.9	-179.9	-61.7	-154.1	-165	0	0	112.8	S118 S122 W123 S124	S118-M120 VanDerWaalsContact C-N 3.34Å; S118-M120 PolarHBondContact O-N 3.47Å; M120-S122 PolarHBondContact O-N 2.94Å; M120-S122 VanDerWaalsContact O-N 3.16Å; M120-W123 HydrophobicContact CB-CB 4.12Å; M120-W123 HydrophobicContact CB-CG 4.38Å; M120-W123 PolarHBondContact O-N 3.36Å; M120-W123 VanDerWaalsContact O-N 3.08Å; M120-W123 VanDerWaalsContact SD-CD1 3.51Å; M120-S124 PolarHBondContact O-N 3.49Å
121	K	69.6	Low	75.3	Confident	150 Å²	150	71.4 Å²	71.4	65%	0.652	40%	0.397	S	S	*	.	H	α-helix	trans	-50.8	-40.1	178.6	-68.4	179.7	179.1	176.7	0	113.3	W123 S124 T125	K121-W123 PolarHBondContact O-N 3.49Å; K121-S124 PolarHBondContact O-N 3.47Å; K121-T125 PolarHBondContact O-N 2.96Å; K121-T125 PolarHBondContact O-OG1 3.47Å; K121-T125 VanDerWaalsContact O-OG1 3.05Å
122	S	74.2	Confident	75.6	Confident	89 Å²	89	70.1 Å²	70.1	62%	0.622	38%	0.382	S	S	*	.	H	α-helix	trans	-60.4	-44.7	178.6	-178	0	0	0	0	112.8	M120 T125 V126	M120-S122 PolarHBondContact O-N 2.94Å; M120-S122 VanDerWaalsContact O-N 3.16Å; S122-T125 PolarHBondContact O-N 3.28Å; S122-V126 WeakPolarHBondContact O-CG2 3.31Å; S122-V126 PolarHBondContact O-N 3.28Å; S122-V126 VanDerWaalsContact O-N 3.09Å
123	W	77.6	Confident	76	Confident	159 Å²	159	68.4 Å²	68.4	60%	0.602	37%	0.373	S	S	*	.	H	α-helix	trans	-66.1	-39.2	177.5	-81.9	99.2	0	0	0	112.2	M120 K121 T125 V126 L127	M120-W123 HydrophobicContact CB-CB 4.12Å; M120-W123 HydrophobicContact CB-CG 4.38Å; M120-W123 PolarHBondContact O-N 3.36Å; M120-W123 VanDerWaalsContact O-N 3.08Å; M120-W123 VanDerWaalsContact SD-CD1 3.51Å; K121-W123 PolarHBondContact O-N 3.49Å; W123-T125 VanDerWaalsContact C-N 3.31Å; W123-T125 PolarHBondContact O-N 3.36Å; W123-V126 PolarHBondContact O-N 3.15Å; W123-L127 WeakPolarHBondContact O-CG 3.42Å; W123-L127 PolarHBondContact O-N 3.39Å
124	S	77	Confident	76.6	Confident	28 Å²	28	71.3 Å²	71.3	20%	0.196	39%	0.386	C	S	.	.	H	α-helix	trans	-61.9	-38.6	174.3	175.1	0	0	0	0	112.1	R113 M120 K121 L127 A128	R113-S124 PolarHBondContact NE-O 2.79Å; R113-S124 PolarHBondContact NE-OG 2.89Å; R113-S124 VanDerWaalsContact NE-OG 3.14Å; R113-S124 PolarHBondContact NH2-OG 3.43Å; M120-S124 PolarHBondContact O-N 3.49Å; K121-S124 PolarHBondContact O-N 3.47Å; S124-L127 PolarHBondContact O-N 3.47Å; S124-A128 WeakPolarHBondContact O-CB 3.25Å; S124-A128 PolarHBondContact O-N 3.21Å
125	T	79.3	Confident	77.2	Confident	22 Å²	22	68.3 Å²	68.3	14%	0.135	37%	0.371	C	S	.	.	H	α-helix	trans	-65.4	-44.5	175.8	-49.8	0	0	0	0	111.8	L66 K121 S122 W123 L127 A128 V129	L66-T125 HydrophobicContact CD1-CG2 3.7Å; K121-T125 PolarHBondContact O-N 2.96Å; K121-T125 PolarHBondContact O-OG1 3.47Å; K121-T125 VanDerWaalsContact O-OG1 3.05Å; S122-T125 PolarHBondContact O-N 3.28Å; W123-T125 VanDerWaalsContact C-N 3.31Å; W123-T125 PolarHBondContact O-N 3.36Å; T125-L127 VanDerWaalsContact C-N 3.34Å; T125-L127 PolarHBondContact O-N 2.91Å; T125-A128 PolarHBondContact O-N 2.91Å; T125-V129 HydrophobicContact CG2-CG2 4.45Å; T125-V129 VanDerWaalsContact O-CG2 3.31Å; T125-V129 WeakPolarHBondContact O-CG2 3.39Å; T125-V129 PolarHBondContact O-N 3.25Å
126	V	82.8	Confident	77.9	Confident	74 Å²	74	61.7 Å²	61.7	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-60.9	-44.7	177.4	174.6	0	0	0	0	110.8	S122 W123 A128 V129 M130	S122-V126 WeakPolarHBondContact O-CG2 3.31Å; S122-V126 PolarHBondContact O-N 3.28Å; S122-V126 VanDerWaalsContact O-N 3.09Å; W123-V126 PolarHBondContact O-N 3.15Å; V126-A128 PolarHBondContact O-N 3.41Å; V126-V129 PolarHBondContact O-N 3.32Å; V126-M130 VanDerWaalsContact O-CB 3.29Å; V126-M130 WeakPolarHBondContact O-CB 3.47Å; V126-M130 PolarHBondContact O-N 3.03Å
127	L	83.2	Confident	78.8	Confident	26 Å²	26	59.2 Å²	59.2	14%	0.136	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-38.3	176.5	-71.2	174.1	0	0	0	112.4	R113 V116 W123 S124 T125 M130 G131	R113-L127 HydrophobicContact CG-CB 4.33Å; R113-L127 HydrophobicContact CG-CD1 4.48Å; V116-L127 HydrophobicContact CG2-CD1 3.97Å; W123-L127 WeakPolarHBondContact O-CG 3.42Å; W123-L127 PolarHBondContact O-N 3.39Å; S124-L127 PolarHBondContact O-N 3.47Å; T125-L127 VanDerWaalsContact C-N 3.34Å; T125-L127 PolarHBondContact O-N 2.91Å; L127-M130 PolarHBondContact O-N 2.94Å; L127-G131 PolarHBondContact O-N 3.48Å
128	A	83.3	Confident	80.2	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-46.2	175.1	0	0	0	0	0	111.7	L57 L64 S124 T125 V126 M130 G131 K132	L57-A128 WeakPolarHBondContact CD2-O 3.46Å; L64-A128 HydrophobicContact CD1-CB 3.87Å; L64-A128 HydrophobicContact CD2-CB 4Å; S124-A128 WeakPolarHBondContact O-CB 3.25Å; S124-A128 PolarHBondContact O-N 3.21Å; T125-A128 PolarHBondContact O-N 2.91Å; V126-A128 PolarHBondContact O-N 3.41Å; A128-M130 VanDerWaalsContact C-N 3.34Å; A128-M130 PolarHBondContact O-N 3.22Å; A128-G131 PolarHBondContact O-N 3.1Å; A128-K132 WeakPolarHBondContact O-CB 3.31Å; A128-K132 PolarHBondContact O-N 3.38Å
129	V	85.2	Confident	81.6	Confident	26 Å²	26	52.4 Å²	52.4	16%	0.158	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-42.1	177.7	171.1	0	0	0	0	111	F75 V78 T125 V126 K132 A133	F75-V129 HydrophobicContact CD1-CG2 4.37Å; F75-V129 HydrophobicContact CE1-CG2 4.11Å; V78-V129 HydrophobicContact CB-CG1 4.15Å; V78-V129 HydrophobicContact CG1-CG1 3.99Å; V78-V129 HydrophobicContact CG2-CG1 3.38Å; T125-V129 HydrophobicContact CG2-CG2 4.45Å; T125-V129 VanDerWaalsContact O-CG2 3.31Å; T125-V129 WeakPolarHBondContact O-CG2 3.39Å; T125-V129 PolarHBondContact O-N 3.25Å; V126-V129 PolarHBondContact O-N 3.32Å; V129-K132 WeakPolarHBondContact O-CB 3.33Å; V129-K132 PolarHBondContact O-N 3.45Å; V129-A133 PolarHBondContact O-N 3.43Å
130	M	86.8	Confident	82.9	Confident	89 Å²	89	47.3 Å²	47.3	44%	0.438	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-44.1	176.8	-174.6	177.6	-66.7	0	0	111.9	V126 L127 A128 K132 A133 F134	V126-M130 VanDerWaalsContact O-CB 3.29Å; V126-M130 WeakPolarHBondContact O-CB 3.47Å; V126-M130 PolarHBondContact O-N 3.03Å; L127-M130 PolarHBondContact O-N 2.94Å; A128-M130 VanDerWaalsContact C-N 3.34Å; A128-M130 PolarHBondContact O-N 3.22Å; M130-K132 PolarHBondContact O-N 2.92Å; M130-A133 WeakPolarHBondContact O-CB 3.48Å; M130-A133 PolarHBondContact O-N 2.91Å; M130-F134 HydrophobicContact CG-CD2 3.79Å; M130-F134 HydrophobicContact CG-CE2 3.39Å; M130-F134 HydrophobicContact CG-CZ 4.38Å; M130-F134 WeakPolarHBondContact O-CD2 3.46Å; M130-F134 PolarHBondContact O-N 3.45Å; M130-F134 HydrophobicContact SD-CE2 3.94Å
131	G	85.9	Confident	83.7	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-35.3	172.8	0	0	0	0	0	112.3	L57 L127 A128 F134 S135	L57-G131 VanDerWaalsContact CD2-C 3.46Å; L127-G131 PolarHBondContact O-N 3.48Å; A128-G131 PolarHBondContact O-N 3.1Å; G131-F134 PolarHBondContact O-N 2.96Å; G131-S135 VanDerWaalsContact O-CB 3.29Å; G131-S135 WeakPolarHBondContact O-CB 3.26Å; G131-S135 PolarHBondContact O-N 3.37Å
132	K	87.6	Confident	84.4	Confident	8 Å²	8	35 Å²	35	4%	0.035	19%	0.187	C	C	.	.	H	α-helix	trans	-68.3	-44.6	177.3	-173.9	67.2	177.5	-176.4	0	110.9	Y54 L57 S58 F75 A128 V129 M130 F134 S135 E136	Y54-K132 HydrophobicContact CE2-CD 4.35Å; Y54-K132 PolarHBondContact OH-NZ 2.85Å; Y54-K132 VanDerWaalsContact OH-NZ 3.08Å; L57-K132 HydrophobicContact CD2-CB 3.54Å; L57-K132 HydrophobicContact CD2-CD 3.98Å; L57-K132 HydrophobicContact CD2-CG 4.37Å; S58-K132 PolarHBondContact OG-NZ 2.93Å; F75-K132 HydrophobicContact CB-CG 4.34Å; F75-K132 HydrophobicContact CD1-CB 4.22Å; F75-K132 HydrophobicContact CD1-CG 4.01Å; F75-K132 HydrophobicContact CD2-CD 3.94Å; F75-K132 HydrophobicContact CD2-CG 4Å; F75-K132 HydrophobicContact CE1-CB 4.03Å; F75-K132 HydrophobicContact CE1-CG 4.22Å; F75-K132 HydrophobicContact CE2-CD 3.95Å; F75-K132 HydrophobicContact CE2-CG 4.15Å; F75-K132 HydrophobicContact CG-CD 4.34Å; F75-K132 HydrophobicContact CG-CG 3.89Å; F75-K132 HydrophobicContact CZ-CB 4.18Å; F75-K132 HydrophobicContact CZ-CD 4.43Å; F75-K132 HydrophobicContact CZ-CG 4.27Å; A128-K132 WeakPolarHBondContact O-CB 3.31Å; A128-K132 PolarHBondContact O-N 3.38Å; V129-K132 WeakPolarHBondContact O-CB 3.33Å; V129-K132 PolarHBondContact O-N 3.45Å; M130-K132 PolarHBondContact O-N 2.92Å; K132-F134 VanDerWaalsContact C-N 3.35Å; K132-F134 PolarHBondContact O-N 3.47Å; K132-S135 PolarHBondContact O-N 2.93Å; K132-E136 WeakPolarHBondContact O-CB 3.34Å; K132-E136 PolarHBondContact O-N 3.08Å
133	A	87.6	Confident	84.9	Confident	20 Å²	20	35.6 Å²	35.6	17%	0.165	18%	0.176	C	C	.	.	H	α-helix	trans	-56.1	-48.6	174.7	0	0	0	0	0	111.6	V78 S82 V129 M130 A137	V78-A133 HydrophobicContact CG1-CB 3.59Å; S82-A133 VanDerWaalsContact OG-CA 3.31Å; S82-A133 WeakPolarHBondContact OG-CA 3.36Å; S82-A133 WeakPolarHBondContact OG-CB 3.48Å; V129-A133 PolarHBondContact O-N 3.43Å; M130-A133 WeakPolarHBondContact O-CB 3.48Å; M130-A133 PolarHBondContact O-N 2.91Å; A133-A137 WeakPolarHBondContact O-CB 3.39Å; A133-A137 PolarHBondContact O-N 2.91Å
134	F	87.6	Confident	85.3	Confident	74 Å²	74	31.1 Å²	31.1	33%	0.325	16%	0.164	S	C	.	.	H	α-helix	trans	-67	-36.7	178.7	-73.3	-57.2	0	0	0	113.2	T106 M130 G131 K132 A137 A138	T106-F134 VanDerWaalsContact OG1-C 3.28Å; T106-F134 WeakPolarHBondContact OG1-CB 3.35Å; M130-F134 HydrophobicContact CG-CD2 3.79Å; M130-F134 HydrophobicContact CG-CE2 3.39Å; M130-F134 HydrophobicContact CG-CZ 4.38Å; M130-F134 WeakPolarHBondContact O-CD2 3.46Å; M130-F134 PolarHBondContact O-N 3.45Å; M130-F134 HydrophobicContact SD-CE2 3.94Å; G131-F134 PolarHBondContact O-N 2.96Å; K132-F134 VanDerWaalsContact C-N 3.35Å; K132-F134 PolarHBondContact O-N 3.47Å; F134-A137 WeakPolarHBondContact O-CB 3.35Å; F134-A137 PolarHBondContact O-N 2.95Å; F134-A138 WeakPolarHBondContact O-CB 3.45Å; F134-A138 PolarHBondContact O-N 3.24Å
135	S	87.8	Confident	85.4	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-69.3	-43	178.2	-169.2	0	0	0	0	111.9	Y54 T106 G131 K132 A137 A138 F139	Y54-S135 WeakPolarHBondContact CA-OG 3.25Å; Y54-S135 PolarHBondContact N-OG 3.33Å; T106-S135 PolarHBondContact OG1-N 3.5Å; G131-S135 VanDerWaalsContact O-CB 3.29Å; G131-S135 WeakPolarHBondContact O-CB 3.26Å; G131-S135 PolarHBondContact O-N 3.37Å; K132-S135 PolarHBondContact O-N 2.93Å; S135-A137 VanDerWaalsContact C-N 3.29Å; S135-A137 PolarHBondContact O-N 3.45Å; S135-A138 PolarHBondContact O-N 3.49Å; S135-F139 PolarHBondContact O-N 3.34Å
136	E	88.8	Confident	85.4	Confident	12 Å²	12	29.2 Å²	29.2	6%	0.056	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-40.6	171.8	-179.3	66.8	-166.2	0	0	111.5	Y54 E79 K83 K132 A138 F139 T140	Y54-E136 WeakPolarHBondContact CE2-OE2 3.29Å; E79-E136 HydrophobicContact CG-CB 4.43Å; E79-E136 VanDerWaalsContact CG-CD 3.47Å; E79-E136 HydrophobicContact CG-CG 3.47Å; E79-E136 VanDerWaalsContact CG-CG 3.47Å; K83-E136 WeakPolarHBondContact CE-OE1 3.41Å; K83-E136 IonicContact NZ-OE1 2.89Å; K83-E136 PolarHBondContact NZ-OE1 3.18Å; K83-E136 VanDerWaalsContact NZ-OE1 3.09Å; K132-E136 WeakPolarHBondContact O-CB 3.34Å; K132-E136 PolarHBondContact O-N 3.08Å; E136-A138 VanDerWaalsContact C-N 3.32Å; E136-A138 PolarHBondContact O-N 3.44Å; E136-F139 WeakPolarHBondContact O-CB 3.29Å; E136-F139 PolarHBondContact O-N 2.82Å; E136-F139 VanDerWaalsContact O-N 3.17Å; E136-T140 PolarHBondContact O-N 3.46Å; E136-T140 PolarHBondContact O-OG1 3.06Å
137	A	87.5	Confident	85.4	Confident	8 Å²	8	27.3 Å²	27.3	7%	0.066	14%	0.14	C	C	.	.	H	α-helix	trans	-59.8	-46.5	177.2	0	0	0	0	0	111	V86 T102 A133 F134 S135 F139 T140 T141	V86-A137 HydrophobicContact CG2-CB 3.3Å; T102-A137 HydrophobicContact CG2-CB 3.6Å; A133-A137 WeakPolarHBondContact O-CB 3.39Å; A133-A137 PolarHBondContact O-N 2.91Å; F134-A137 WeakPolarHBondContact O-CB 3.35Å; F134-A137 PolarHBondContact O-N 2.95Å; S135-A137 VanDerWaalsContact C-N 3.29Å; S135-A137 PolarHBondContact O-N 3.45Å; A137-F139 VanDerWaalsContact C-N 3.28Å; A137-F139 PolarHBondContact O-N 3.32Å; A137-T140 PolarHBondContact O-N 2.94Å; A137-T141 PolarHBondContact O-N 2.86Å; A137-T141 PolarHBondContact O-OG1 3.06Å
138	A	86.9	Confident	85.3	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-32.2	176	0	0	0	0	0	113.2	V50 Q99 T102 L103 F134 S135 E136 T141 A142	V50-A138 HydrophobicContact CG1-CB 4.42Å; V50-A138 HydrophobicContact CG2-CB 3.95Å; Q99-A138 PolarHBondContact NE2-O 3.21Å; T102-A138 WeakPolarHBondContact OG1-CA 3.4Å; T102-A138 WeakPolarHBondContact OG1-CB 3.32Å; L103-A138 HydrophobicContact CD2-CB 4.08Å; L103-A138 HydrophobicContact CG-CB 4.08Å; F134-A138 WeakPolarHBondContact O-CB 3.45Å; F134-A138 PolarHBondContact O-N 3.24Å; S135-A138 PolarHBondContact O-N 3.49Å; E136-A138 VanDerWaalsContact C-N 3.32Å; E136-A138 PolarHBondContact O-N 3.44Å; A138-T141 WeakPolarHBondContact CA-OG1 3.38Å; A138-T141 PolarHBondContact O-OG1 3.25Å; A138-T141 VanDerWaalsContact O-OG1 3.1Å; A138-A142 WeakPolarHBondContact O-CB 3.25Å; A138-A142 PolarHBondContact O-N 3.3Å
139	F	86.4	Confident	85	Confident	47 Å²	47	29.9 Å²	29.9	21%	0.206	15%	0.152	C	C	.	.	H	α-helix	trans	-68.8	-47.8	175.5	-166.9	-97.3	0	0	0	111.4	W47 V50 S135 E136 A137 T141 A142 Y143	W47-F139 HydrophobicContact CZ3-CE2 4.29Å; V50-F139 HydrophobicContact CG1-CB 3.75Å; V50-F139 HydrophobicContact CG1-CD2 3.73Å; V50-F139 HydrophobicContact CG1-CG 4.24Å; S135-F139 PolarHBondContact O-N 3.34Å; E136-F139 WeakPolarHBondContact O-CB 3.29Å; E136-F139 PolarHBondContact O-N 2.82Å; E136-F139 VanDerWaalsContact O-N 3.17Å; A137-F139 VanDerWaalsContact C-N 3.28Å; A137-F139 PolarHBondContact O-N 3.32Å; F139-T141 PolarHBondContact O-N 3.06Å; F139-A142 PolarHBondContact O-N 2.82Å; F139-Y143 AromaticContact CD1-CD2 3.84Å; F139-Y143 HydrophobicContact CD1-CD2 3.84Å; F139-Y143 AromaticContact CD1-CE2 3.85Å; F139-Y143 HydrophobicContact CD1-CE2 3.85Å; F139-Y143 AromaticContact CE1-CD2 3.7Å; F139-Y143 HydrophobicContact CE1-CD2 3.7Å; F139-Y143 AromaticContact CE1-CE2 3.21Å; F139-Y143 HydrophobicContact CE1-CE2 3.21Å; F139-Y143 HydrophobicContact CE2-CE2 4.03Å; F139-Y143 HydrophobicContact CG-CD2 4.41Å; F139-Y143 HydrophobicContact CG-CE2 4.5Å; F139-Y143 HydrophobicContact CZ-CD2 4.16Å; F139-Y143 AromaticContact CZ-CE2 3.35Å; F139-Y143 HydrophobicContact CZ-CE2 3.35Å; F139-Y143 WeakPolarHBondContact O-CD2 3.26Å; F139-Y143 PolarHBondContact O-N 3.46Å
140	T	88	Confident	84.5	Confident	42 Å²	42	28.8 Å²	28.8	26%	0.258	15%	0.145	S	C	.	.	H	α-helix	trans	-61.7	-45	178.3	-58.6	0	0	0	0	111.2	V86 E136 A137 Y143 L144	V86-T140 HydrophobicContact CG1-CG2 3.9Å; E136-T140 PolarHBondContact O-N 3.46Å; E136-T140 PolarHBondContact O-OG1 3.06Å; A137-T140 PolarHBondContact O-N 2.94Å; T140-Y143 PolarHBondContact O-N 3.11Å; T140-L144 PolarHBondContact O-N 3.4Å
141	T	84.9	Confident	83.9	Confident	5 Å²	5	27.4 Å²	27.4	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-67.6	-37.1	176.9	50.8	0	0	0	0	112.5	V86 V90 T98 Q99 A137 A138 F139 Y143 L144 F145	V86-T141 HydrophobicContact CG1-CG2 3.43Å; V86-T141 VanDerWaalsContact CG1-CG2 3.43Å; V86-T141 HydrophobicContact CG2-CG2 4.38Å; V90-T141 HydrophobicContact CG2-CG2 3.86Å; T98-T141 HydrophobicContact CG2-CG2 3.78Å; Q99-T141 PolarHBondContact OE1-OG1 3.26Å; A137-T141 PolarHBondContact O-N 2.86Å; A137-T141 PolarHBondContact O-OG1 3.06Å; A138-T141 WeakPolarHBondContact CA-OG1 3.38Å; A138-T141 PolarHBondContact O-OG1 3.25Å; A138-T141 VanDerWaalsContact O-OG1 3.1Å; F139-T141 PolarHBondContact O-N 3.06Å; T141-Y143 VanDerWaalsContact C-N 3.33Å; T141-Y143 PolarHBondContact O-N 2.78Å; T141-L144 PolarHBondContact O-N 3.13Å; T141-F145 VanDerWaalsContact O-CB 3.23Å; T141-F145 WeakPolarHBondContact O-CB 3.37Å; T141-F145 PolarHBondContact O-N 3.5Å
142	A	85.1	Confident	83.5	Confident	3 Å²	3	32.7 Å²	32.7	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-63.6	-41.3	177.5	0	0	0	0	0	111.2	V46 A138 F139 T146	V46-A142 HydrophobicContact CG1-CB 4.2Å; A138-A142 WeakPolarHBondContact O-CB 3.25Å; A138-A142 PolarHBondContact O-N 3.3Å; F139-A142 PolarHBondContact O-N 2.82Å; A142-T146 VanDerWaalsContact O-CB 3.31Å; A142-T146 WeakPolarHBondContact O-CB 3.4Å; A142-T146 PolarHBondContact O-N 3.49Å; A142-T146 PolarHBondContact O-OG1 2.87Å
143	Y	84.3	Confident	82.8	Confident	102 Å²	102	37 Å²	37	40%	0.4	20%	0.202	S	C	.	.	H	α-helix	trans	-61	-49.4	173.7	-99.8	-88.3	0	0	0	112.1	W47 F139 T140 T141 F145 T146 S147	W47-Y143 HydrophobicContact CH2-CD1 4.26Å; W47-Y143 AromaticContact CH2-CD2 3.6Å; W47-Y143 HydrophobicContact CH2-CD2 3.6Å; W47-Y143 AromaticContact CH2-CE1 3.81Å; W47-Y143 HydrophobicContact CH2-CE1 3.81Å; W47-Y143 AromaticContact CH2-CE2 3.02Å; W47-Y143 HydrophobicContact CH2-CE2 3.02Å; W47-Y143 HydrophobicContact CH2-CG 4.2Å; W47-Y143 AromaticContact CH2-CZ 3.2Å; W47-Y143 WeakPolarHBondContact CH2-OH 3.46Å; W47-Y143 HydrophobicContact CZ2-CD1 4.19Å; W47-Y143 AromaticContact CZ2-CD2 3.72Å; W47-Y143 HydrophobicContact CZ2-CD2 3.72Å; W47-Y143 HydrophobicContact CZ2-CE1 4.17Å; W47-Y143 AromaticContact CZ2-CE2 3.65Å; W47-Y143 HydrophobicContact CZ2-CE2 3.65Å; W47-Y143 HydrophobicContact CZ2-CG 4.01Å; W47-Y143 AromaticContact CZ2-CZ 3.95Å; W47-Y143 HydrophobicContact CZ3-CD2 4.43Å; W47-Y143 AromaticContact CZ3-CE2 3.69Å; W47-Y143 HydrophobicContact CZ3-CE2 3.69Å; F139-Y143 AromaticContact CD1-CD2 3.84Å; F139-Y143 HydrophobicContact CD1-CD2 3.84Å; F139-Y143 AromaticContact CD1-CE2 3.85Å; F139-Y143 HydrophobicContact CD1-CE2 3.85Å; F139-Y143 AromaticContact CE1-CD2 3.7Å; F139-Y143 HydrophobicContact CE1-CD2 3.7Å; F139-Y143 AromaticContact CE1-CE2 3.21Å; F139-Y143 HydrophobicContact CE1-CE2 3.21Å; F139-Y143 HydrophobicContact CE2-CE2 4.03Å; F139-Y143 HydrophobicContact CG-CD2 4.41Å; F139-Y143 HydrophobicContact CG-CE2 4.5Å; F139-Y143 HydrophobicContact CZ-CD2 4.16Å; F139-Y143 AromaticContact CZ-CE2 3.35Å; F139-Y143 HydrophobicContact CZ-CE2 3.35Å; F139-Y143 WeakPolarHBondContact O-CD2 3.26Å; F139-Y143 PolarHBondContact O-N 3.46Å; T140-Y143 PolarHBondContact O-N 3.11Å; T141-Y143 VanDerWaalsContact C-N 3.33Å; T141-Y143 PolarHBondContact O-N 2.78Å; Y143-F145 VanDerWaalsContact C-N 3.34Å; Y143-F145 PolarHBondContact O-N 2.91Å; Y143-T146 PolarHBondContact O-N 2.9Å; Y143-S147 PolarHBondContact O-N 3.25Å
144	L	85.1	Confident	82.1	Confident	64 Å²	64	37.1 Å²	37.1	34%	0.335	20%	0.199	S	C	.	.	H	α-helix	trans	-58.8	-48.9	178.7	-176.5	64.9	0	0	0	110.7	V90 T140 T141 T146 S147 E148	V90-L144 HydrophobicContact CG1-CD2 3.97Å; V90-L144 HydrophobicContact CG2-CD2 4.36Å; T140-L144 PolarHBondContact O-N 3.4Å; T141-L144 PolarHBondContact O-N 3.13Å; L144-T146 PolarHBondContact O-N 3.08Å; L144-S147 PolarHBondContact O-N 3.5Å; L144-S147 VanDerWaalsContact O-N 3.09Å; L144-S147 PolarHBondContact O-OG 3.32Å; L144-E148 WeakPolarHBondContact CD1-OE1 3.3Å; L144-E148 WeakPolarHBondContact O-CG 3.35Å; L144-E148 PolarHBondContact O-N 3.43Å; L144-E148 VanDerWaalsContact O-N 3.09Å
145	F	78.5	Confident	81.7	Confident	9 Å²	9	37.6 Å²	37.6	4%	0.039	20%	0.199	C	C	.	.	H	α-helix	trans	-60.8	-45.1	179.9	-165.2	-97.1	0	0	0	111.8	R95 T141 Y143 S147 E148 L149 L205 T208	R95-F145 HydrophobicContact CB-CD2 4.32Å; T141-F145 VanDerWaalsContact O-CB 3.23Å; T141-F145 WeakPolarHBondContact O-CB 3.37Å; T141-F145 PolarHBondContact O-N 3.5Å; Y143-F145 VanDerWaalsContact C-N 3.34Å; Y143-F145 PolarHBondContact O-N 2.91Å; F145-S147 VanDerWaalsContact C-N 3.3Å; F145-S147 PolarHBondContact O-N 2.97Å; F145-E148 PolarHBondContact O-N 3.37Å; F145-E148 VanDerWaalsContact O-N 3.17Å; F145-L149 HydrophobicContact CD1-CD1 3.44Å; F145-L149 VanDerWaalsContact CD1-CD1 3.44Å; F145-L149 HydrophobicContact CD1-CD2 4.32Å; F145-L149 HydrophobicContact CD1-CG 4.42Å; F145-L149 HydrophobicContact CD2-CD1 3.68Å; F145-L149 HydrophobicContact CE1-CD1 3.14Å; F145-L149 HydrophobicContact CE1-CD2 3.39Å; F145-L149 HydrophobicContact CE1-CG 3.86Å; F145-L149 HydrophobicContact CE2-CD1 3.47Å; F145-L149 VanDerWaalsContact CE2-CD1 3.47Å; F145-L149 HydrophobicContact CG-CD1 3.67Å; F145-L149 HydrophobicContact CZ-CD1 3.19Å; F145-L149 HydrophobicContact CZ-CD2 3.61Å; F145-L149 HydrophobicContact CZ-CG 4.02Å; F145-L149 WeakPolarHBondContact O-CD1 3.46Å; F145-L149 PolarHBondContact O-N 3.29Å; F145-L205 HydrophobicContact CD1-CD2 3.62Å; F145-L205 HydrophobicContact CD1-CG 4.47Å; F145-L205 HydrophobicContact CE1-CB 4.25Å; F145-L205 HydrophobicContact CE1-CD2 2.95Å; F145-L205 HydrophobicContact CE1-CG 3.39Å; F145-L205 HydrophobicContact CE2-CD2 4.2Å; F145-L205 HydrophobicContact CG-CD2 4.48Å; F145-L205 HydrophobicContact CZ-CB 3.85Å; F145-L205 HydrophobicContact CZ-CD2 3.29Å; F145-L205 HydrophobicContact CZ-CG 3.52Å; F145-T208 HydrophobicContact CE2-CG2 4.38Å
146	T	80.8	Confident	81.4	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-44.3	174.4	-54.6	0	0	0	0	110.4	W47 A142 Y143 L144 E148 Y150 M159	W47-T146 PolarHBondContact NE1-OG1 3.09Å; A142-T146 VanDerWaalsContact O-CB 3.31Å; A142-T146 WeakPolarHBondContact O-CB 3.4Å; A142-T146 PolarHBondContact O-N 3.49Å; A142-T146 PolarHBondContact O-OG1 2.87Å; Y143-T146 PolarHBondContact O-N 2.9Å; L144-T146 PolarHBondContact O-N 3.08Å; T146-E148 VanDerWaalsContact C-N 3.25Å; T146-E148 PolarHBondContact O-N 3.04Å; T146-Y150 HydrophobicContact CG2-CD2 3.66Å; T146-Y150 HydrophobicContact CG2-CE2 3.66Å; T146-Y150 VanDerWaalsContact O-CD2 3.23Å; T146-Y150 WeakPolarHBondContact O-CD2 3.48Å; T146-Y150 PolarHBondContact O-N 3.48Å; T146-M159 HydrophobicContact CG2-CG 3.73Å
147	S	81.8	Confident	81	Confident	35 Å²	35	45.7 Å²	45.7	25%	0.245	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-29.9	179.8	77.8	0	0	0	0	113.7	Y143 L144 F145 R155	Y143-S147 PolarHBondContact O-N 3.25Å; L144-S147 PolarHBondContact O-N 3.5Å; L144-S147 VanDerWaalsContact O-N 3.09Å; L144-S147 PolarHBondContact O-OG 3.32Å; F145-S147 VanDerWaalsContact C-N 3.3Å; F145-S147 PolarHBondContact O-N 2.97Å; S147-R155 PolarHBondContact O-NE 2.99Å; S147-R155 PolarHBondContact O-NH2 3.46Å
148	E	81.6	Confident	80.7	Confident	59 Å²	59	45.3 Å²	45.3	28%	0.276	24%	0.235	S	C	.	.	H	α-helix	trans	-86.3	-34.5	-176.8	-70.1	174.5	-179.9	0	0	113.3	R95 L144 F145 T146	R95-E148 WeakPolarHBondContact CD-OE2 3.26Å; R95-E148 IonicContact CZ-OE1 2.87Å; R95-E148 IonicContact CZ-OE2 2.95Å; R95-E148 IonicContact NE-OE1 2.76Å; R95-E148 PolarHBondContact NE-OE1 3.4Å; R95-E148 VanDerWaalsContact NE-OE1 3.14Å; R95-E148 IonicContact NE-OE2 3.14Å; R95-E148 PolarHBondContact NE-OE2 3.19Å; R95-E148 IonicContact NH1-OE1 3.85Å; R95-E148 IonicContact NH1-OE2 3.02Å; R95-E148 PolarHBondContact NH1-OE2 3.23Å; R95-E148 VanDerWaalsContact NH1-OE2 3.09Å; R95-E148 VanDerWaalsContact NH2-CD 3.28Å; R95-E148 IonicContact NH2-OE1 3.09Å; R95-E148 PolarHBondContact NH2-OE1 2.91Å; R95-E148 IonicContact NH2-OE2 2.65Å; R95-E148 PolarHBondContact NH2-OE2 3.37Å; L144-E148 WeakPolarHBondContact CD1-OE1 3.3Å; L144-E148 WeakPolarHBondContact O-CG 3.35Å; L144-E148 PolarHBondContact O-N 3.43Å; L144-E148 VanDerWaalsContact O-N 3.09Å; F145-E148 PolarHBondContact O-N 3.37Å; F145-E148 VanDerWaalsContact O-N 3.17Å; T146-E148 VanDerWaalsContact C-N 3.25Å; T146-E148 PolarHBondContact O-N 3.04Å
149	L	76.1	Confident	80.5	Confident	22 Å²	22	48 Å²	48	12%	0.115	25%	0.248	C	C	.	.	H	α-helix	trans	-81.9	-30	-178.2	-86.6	84.3	0	0	0	113.6	I39 F145 T208	I39-L149 HydrophobicContact CB-CD2 4.23Å; I39-L149 HydrophobicContact CD1-CD2 3.95Å; I39-L149 HydrophobicContact CG1-CD2 3.8Å; I39-L149 HydrophobicContact CG2-CB 3.89Å; I39-L149 HydrophobicContact CG2-CD2 3.44Å; I39-L149 VanDerWaalsContact CG2-CD2 3.44Å; I39-L149 HydrophobicContact CG2-CG 4.3Å; F145-L149 HydrophobicContact CD1-CD1 3.44Å; F145-L149 VanDerWaalsContact CD1-CD1 3.44Å; F145-L149 HydrophobicContact CD1-CD2 4.32Å; F145-L149 HydrophobicContact CD1-CG 4.42Å; F145-L149 HydrophobicContact CD2-CD1 3.68Å; F145-L149 HydrophobicContact CE1-CD1 3.14Å; F145-L149 HydrophobicContact CE1-CD2 3.39Å; F145-L149 HydrophobicContact CE1-CG 3.86Å; F145-L149 HydrophobicContact CE2-CD1 3.47Å; F145-L149 VanDerWaalsContact CE2-CD1 3.47Å; F145-L149 HydrophobicContact CG-CD1 3.67Å; F145-L149 HydrophobicContact CZ-CD1 3.19Å; F145-L149 HydrophobicContact CZ-CD2 3.61Å; F145-L149 HydrophobicContact CZ-CG 4.02Å; F145-L149 WeakPolarHBondContact O-CD1 3.46Å; F145-L149 PolarHBondContact O-N 3.29Å; L149-T208 HydrophobicContact CD1-CG2 3.42Å; L149-T208 VanDerWaalsContact CD1-CG2 3.42Å; L149-T208 HydrophobicContact CD2-CG2 4.45Å; L149-T208 HydrophobicContact CG-CG2 3.77Å
150	Y	75.6	Confident	80.4	Confident	3 Å²	3	47 Å²	47	1%	0.012	25%	0.251	C	S	.	.	S	Bend	trans	-83.6	129	-179.8	-74.8	-82.6	0	0	0	110.9	L30 S40 T146	L30-Y150 HydrophobicContact CD1-CD1 4.01Å; L30-Y150 HydrophobicContact CD1-CE1 3.78Å; L30-Y150 HydrophobicContact CD2-CE1 3.8Å; L30-Y150 HydrophobicContact CG-CE1 3.9Å; S40-Y150 VanDerWaalsContact CA-OH 3.3Å; S40-Y150 WeakPolarHBondContact CA-OH 3.39Å; S40-Y150 WeakPolarHBondContact CB-OH 3.35Å; S40-Y150 PolarHBondContact OG-OH 2.73Å; T146-Y150 HydrophobicContact CG2-CD2 3.66Å; T146-Y150 HydrophobicContact CG2-CE2 3.66Å; T146-Y150 VanDerWaalsContact O-CD2 3.23Å; T146-Y150 WeakPolarHBondContact O-CD2 3.48Å; T146-Y150 PolarHBondContact O-N 3.48Å
151	P	73.8	Confident	80.2	Confident	59 Å²	59	46.5 Å²	46.5	38%	0.383	25%	0.247	S	C	.	.			trans	-63.5	149	175.3	26.9	-32.1	0	0	0	109.7	V153 L154 R155	P151-V153 PolarHBondContact O-N 2.97Å; P151-L154 HydrophobicContact CG-CB 4.05Å; P151-L154 HydrophobicContact CG-CD1 3.98Å; P151-L154 HydrophobicContact CG-CG 4.4Å; P151-L154 CarbonylContact O-C 3.57Å; P151-L154 PolarHBondContact O-N 2.97Å; P151-R155 PolarHBondContact O-N 3.41Å
152	T	77.3	Confident	80.3	Confident	112 Å²	112	46.3 Å²	46.3	69%	0.687	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-36.4	-173.2	34.9	0	0	0	0	113.9
153	V	73.9	Confident	80.3	Confident	98 Å²	98	47.9 Å²	47.9	59%	0.594	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-32.9	179.2	-169.9	0	0	0	0	112.9	P25 P151	P25-V153 HydrophobicContact CB-CG1 4.33Å; P25-V153 HydrophobicContact CG-CG1 4.13Å; P25-V153 VanDerWaalsContact CG-O 3.3Å; P25-V153 WeakPolarHBondContact CG-O 3.37Å; P151-V153 PolarHBondContact O-N 2.97Å
154	L	72.8	Confident	80.4	Confident	22 Å²	22	48.3 Å²	48.3	12%	0.115	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-5.4	-176.4	-69.6	164.8	0	0	0	113.6	P25 D29 L30 L36 P151 Q156 T157 G158	P25-L154 HydrophobicContact CB-CD2 3.55Å; P25-L154 HydrophobicContact CB-CG 4.45Å; D29-L154 HydrophobicContact CB-CD2 4.31Å; L30-L154 HydrophobicContact CD1-CB 3.74Å; L30-L154 HydrophobicContact CD1-CD1 4.32Å; L30-L154 HydrophobicContact CD1-CD2 3.88Å; L30-L154 HydrophobicContact CD1-CG 4.2Å; L36-L154 HydrophobicContact CD2-CD1 3.63Å; P151-L154 HydrophobicContact CG-CB 4.05Å; P151-L154 HydrophobicContact CG-CD1 3.98Å; P151-L154 HydrophobicContact CG-CG 4.4Å; P151-L154 CarbonylContact O-C 3.57Å; P151-L154 PolarHBondContact O-N 2.97Å; L154-Q156 PolarHBondContact O-N 3.25Å; L154-T157 PolarHBondContact O-N 3.05Å; L154-G158 PolarHBondContact O-N 2.91Å
155	R	79.7	Confident	80.6	Confident	85 Å²	85	46.5 Å²	46.5	32%	0.321	26%	0.259	S	S	.	.	H	α-helix	trans	-59.6	-46.2	-174.9	-170.2	-174	-71.7	157	-5.6	112.8	S147 P151 G158 M159	S147-R155 PolarHBondContact O-NE 2.99Å; S147-R155 PolarHBondContact O-NH2 3.46Å; P151-R155 PolarHBondContact O-N 3.41Å; R155-G158 PolarHBondContact O-N 3.46Å; R155-M159 HydrophobicContact CG-CE 3.79Å; R155-M159 HydrophobicContact CG-CG 4.44Å; R155-M159 HydrophobicContact CG-SD 4.17Å; R155-M159 WeakPolarHBondContact O-CB 3.49Å; R155-M159 VanDerWaalsContact O-CG 3.28Å; R155-M159 WeakPolarHBondContact O-CG 3.38Å; R155-M159 PolarHBondContact O-N 3.31Å
156	Q	80	Confident	80.9	Confident	163 Å²	163	46.1 Å²	46.1	76%	0.762	26%	0.257	S	S	*	.	H	α-helix	trans	-63.8	-42.8	178.6	-74.3	-171.2	-32.5	0	0	111.9	L154 G160	L154-Q156 PolarHBondContact O-N 3.25Å; Q156-G160 PolarHBondContact O-N 3.4Å
157	T	81.9	Confident	81.2	Confident	20 Å²	20	53.3 Å²	53.3	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-44.2	177.9	-49.2	0	0	0	0	111.8	Y27 L154 G160 L161	Y27-T157 HydrophobicContact CD1-CG2 3.29Å; Y27-T157 HydrophobicContact CD2-CG2 4.41Å; Y27-T157 HydrophobicContact CE1-CG2 3.46Å; Y27-T157 VanDerWaalsContact CE1-CG2 3.46Å; Y27-T157 HydrophobicContact CG-CG2 3.81Å; L154-T157 PolarHBondContact O-N 3.05Å; T157-G160 PolarHBondContact O-N 2.99Å; T157-L161 PolarHBondContact O-N 2.87Å
158	G	79.6	Confident	81.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-46.7	176.3	0	0	0	0	0	112.7	L154 R155 G160 L161 T162	L154-G158 PolarHBondContact O-N 2.91Å; R155-G158 PolarHBondContact O-N 3.46Å; G158-G160 VanDerWaalsContact C-N 3.3Å; G158-G160 PolarHBondContact O-N 2.92Å; G158-L161 PolarHBondContact O-N 3.48Å; G158-T162 PolarHBondContact O-N 2.96Å; G158-T162 PolarHBondContact O-OG1 2.88Å
159	M	82.7	Confident	81.7	Confident	57 Å²	57	54 Å²	54	28%	0.281	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-37.8	175.1	-73.8	-172.3	-54.7	0	0	112.2	T146 R155 T162 A163	T146-M159 HydrophobicContact CG2-CG 3.73Å; R155-M159 HydrophobicContact CG-CE 3.79Å; R155-M159 HydrophobicContact CG-CG 4.44Å; R155-M159 HydrophobicContact CG-SD 4.17Å; R155-M159 WeakPolarHBondContact O-CB 3.49Å; R155-M159 VanDerWaalsContact O-CG 3.28Å; R155-M159 WeakPolarHBondContact O-CG 3.38Å; R155-M159 PolarHBondContact O-N 3.31Å; M159-T162 WeakPolarHBondContact CA-OG1 3.19Å; M159-T162 PolarHBondContact O-OG1 3.44Å; M159-A163 WeakPolarHBondContact O-CB 3.43Å; M159-A163 PolarHBondContact O-N 3.37Å
160	G	84.9	Confident	82.1	Confident	26 Å²	26	53.4 Å²	53.4	27%	0.268	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-45.6	174.1	0	0	0	0	0	112.1	Q156 T157 G158 A163 L164	Q156-G160 PolarHBondContact O-N 3.4Å; T157-G160 PolarHBondContact O-N 2.99Å; G158-G160 VanDerWaalsContact C-N 3.3Å; G158-G160 PolarHBondContact O-N 2.92Å; G160-A163 PolarHBondContact O-N 2.7Å; G160-L164 WeakPolarHBondContact O-CG 3.21Å; G160-L164 PolarHBondContact O-N 3.47Å
161	L	85.1	Confident	82.7	Confident	32 Å²	32	57 Å²	57	17%	0.168	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-45.7	178.2	-176.1	138.8	0	0	0	112.2	Y27 F31 V44 T157 G158 A163 L164 V165	Y27-L161 HydrophobicContact CD1-CB 4.44Å; Y27-L161 HydrophobicContact CD1-CD1 4.23Å; Y27-L161 HydrophobicContact CE1-CB 4.41Å; F31-L161 HydrophobicContact CE2-CD1 4.41Å; V44-L161 HydrophobicContact CG2-CD2 3.27Å; T157-L161 PolarHBondContact O-N 2.87Å; G158-L161 PolarHBondContact O-N 3.48Å; L161-A163 VanDerWaalsContact C-N 3.3Å; L161-A163 PolarHBondContact O-N 3.15Å; L161-L164 PolarHBondContact O-N 2.88Å; L161-V165 WeakPolarHBondContact O-CG2 3.27Å; L161-V165 PolarHBondContact O-N 3.48Å; L161-V165 VanDerWaalsContact O-N 3.11Å
162	T	85.1	Confident	83.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-34.5	176.2	54.5	0	0	0	0	112.1	C43 W47 G158 M159 V165 G166	C43-T162 HydrophobicContact CB-CG2 3.96Å; W47-T162 HydrophobicContact CG-CG2 4.2Å; G158-T162 PolarHBondContact O-N 2.96Å; G158-T162 PolarHBondContact O-OG1 2.88Å; M159-T162 WeakPolarHBondContact CA-OG1 3.19Å; M159-T162 PolarHBondContact O-OG1 3.44Å; T162-V165 PolarHBondContact O-N 2.88Å; T162-G166 PolarHBondContact O-N 3.41Å
163	A	85.3	Confident	83.5	Confident	37 Å²	37	52.5 Å²	52.5	31%	0.306	28%	0.28	S	S	.	.	H	α-helix	trans	-66.6	-42.1	175	0	0	0	0	0	111.9	M159 G160 L161 V165 G166 R167	M159-A163 WeakPolarHBondContact O-CB 3.43Å; M159-A163 PolarHBondContact O-N 3.37Å; G160-A163 PolarHBondContact O-N 2.7Å; L161-A163 VanDerWaalsContact C-N 3.3Å; L161-A163 PolarHBondContact O-N 3.15Å; A163-V165 PolarHBondContact O-N 3.11Å; A163-G166 PolarHBondContact O-N 3.24Å; A163-R167 VanDerWaalsContact O-CG 3.29Å; A163-R167 WeakPolarHBondContact O-CG 3.16Å; A163-R167 PolarHBondContact O-N 2.9Å
164	L	87.9	Confident	83.9	Confident	110 Å²	110	50.2 Å²	50.2	58%	0.576	27%	0.267	S	S	*	.	H	α-helix	trans	-58.5	-47.8	174.3	-73.4	170.9	0	0	0	111.1	G160 L161 G166 R167 L168	G160-L164 WeakPolarHBondContact O-CG 3.21Å; G160-L164 PolarHBondContact O-N 3.47Å; L161-L164 PolarHBondContact O-N 2.88Å; L164-G166 VanDerWaalsContact C-N 3.34Å; L164-G166 PolarHBondContact O-N 3.1Å; L164-R167 WeakPolarHBondContact O-CB 3.4Å; L164-R167 PolarHBondContact O-N 3.22Å; L164-L168 WeakPolarHBondContact O-CG 3.44Å; L164-L168 PolarHBondContact O-N 3.19Å
165	V	87.8	Confident	84.3	Confident	26 Å²	26	54.2 Å²	54.2	16%	0.158	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-41	176.6	175.5	0	0	0	0	111.1	V44 F48 L161 T162 A163 R167 L168 G169	V44-V165 HydrophobicContact CG1-CB 4.4Å; V44-V165 HydrophobicContact CG1-CG1 3.84Å; V44-V165 HydrophobicContact CG1-CG2 3.97Å; V44-V165 HydrophobicContact CG2-CG2 4.29Å; F48-V165 HydrophobicContact CB-CG1 3.79Å; F48-V165 HydrophobicContact CD2-CG1 3.96Å; F48-V165 HydrophobicContact CG-CG1 4.37Å; L161-V165 WeakPolarHBondContact O-CG2 3.27Å; L161-V165 PolarHBondContact O-N 3.48Å; L161-V165 VanDerWaalsContact O-N 3.11Å; T162-V165 PolarHBondContact O-N 2.88Å; A163-V165 PolarHBondContact O-N 3.11Å; V165-R167 VanDerWaalsContact C-N 3.29Å; V165-R167 PolarHBondContact O-N 2.86Å; V165-L168 WeakPolarHBondContact O-CB 3.12Å; V165-L168 PolarHBondContact O-N 3.47Å; V165-L168 VanDerWaalsContact O-N 3.14Å; V165-G169 PolarHBondContact O-N 3.07Å
166	G	85.8	Confident	84.2	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-41.2	174.1	0	0	0	0	0	112.2	N51 T162 A163 L164 G169 G170	N51-G166 WeakPolarHBondContact CB-O 3.49Å; N51-G166 VanDerWaalsContact CG-O 3.26Å; N51-G166 VanDerWaalsContact ND2-CA 3.34Å; N51-G166 WeakPolarHBondContact ND2-CA 3Å; N51-G166 PolarHBondContact OD1-O 3.36Å; T162-G166 PolarHBondContact O-N 3.41Å; A163-G166 PolarHBondContact O-N 3.24Å; L164-G166 VanDerWaalsContact C-N 3.34Å; L164-G166 PolarHBondContact O-N 3.1Å; G166-G169 PolarHBondContact O-N 3.5Å; G166-G170 PolarHBondContact O-N 3.18Å
167	R	87.3	Confident	84	Confident	153 Å²	153	44.5 Å²	44.5	58%	0.577	25%	0.254	S	S	*	.	H	α-helix	trans	-64.2	-40.5	174	-67.7	-71.4	136.8	176.3	-3.9	111.7	A163 L164 V165 G169 G170 S171	A163-R167 VanDerWaalsContact O-CG 3.29Å; A163-R167 WeakPolarHBondContact O-CG 3.16Å; A163-R167 PolarHBondContact O-N 2.9Å; L164-R167 WeakPolarHBondContact O-CB 3.4Å; L164-R167 PolarHBondContact O-N 3.22Å; V165-R167 VanDerWaalsContact C-N 3.29Å; V165-R167 PolarHBondContact O-N 2.86Å; R167-G169 VanDerWaalsContact C-N 3.33Å; R167-G169 PolarHBondContact O-N 3.14Å; R167-G170 PolarHBondContact O-N 2.89Å; R167-S171 PolarHBondContact O-N 2.97Å; R167-S171 PolarHBondContact O-OG 3.4Å; R167-S171 VanDerWaalsContact O-OG 3.1Å
168	L	88.3	Confident	83.7	Confident	107 Å²	107	50 Å²	50	56%	0.56	28%	0.282	S	S	*	.	H	α-helix	trans	-61.2	-42.5	172.6	-64.8	174.8	0	0	0	111.5	L164 V165 G170 S171 L172	L164-L168 WeakPolarHBondContact O-CG 3.44Å; L164-L168 PolarHBondContact O-N 3.19Å; V165-L168 WeakPolarHBondContact O-CB 3.12Å; V165-L168 PolarHBondContact O-N 3.47Å; V165-L168 VanDerWaalsContact O-N 3.14Å; L168-G170 VanDerWaalsContact C-N 3.34Å; L168-G170 PolarHBondContact O-N 3.08Å; L168-S171 PolarHBondContact O-N 2.96Å; L168-L172 WeakPolarHBondContact O-CB 3.44Å; L168-L172 VanDerWaalsContact O-CG 3.31Å; L168-L172 WeakPolarHBondContact O-CG 3.41Å; L168-L172 PolarHBondContact O-N 3.34Å
169	G	84.5	Confident	83.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-42.1	173.8	0	0	0	0	0	112.5	F52 V165 G166 R167 L172 A173	F52-G169 WeakPolarHBondContact CD2-O 3.23Å; V165-G169 PolarHBondContact O-N 3.07Å; G166-G169 PolarHBondContact O-N 3.5Å; R167-G169 VanDerWaalsContact C-N 3.33Å; R167-G169 PolarHBondContact O-N 3.14Å; G169-L172 PolarHBondContact O-N 3.21Å; G169-A173 PolarHBondContact O-N 3.09Å
170	G	85.1	Confident	82.5	Confident	11 Å²	11	54.3 Å²	54.3	11%	0.113	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-37.4	174.7	0	0	0	0	0	114.1	G166 R167 L168 A173 P174	G166-G170 PolarHBondContact O-N 3.18Å; R167-G170 PolarHBondContact O-N 2.89Å; L168-G170 VanDerWaalsContact C-N 3.34Å; L168-G170 PolarHBondContact O-N 3.08Å; G170-A173 WeakPolarHBondContact O-CB 3.43Å; G170-A173 PolarHBondContact O-N 3.48Å; G170-P174 WeakPolarHBondContact O-CD 3.49Å
171	S	87.3	Confident	81.4	Confident	79 Å²	79	56.8 Å²	56.8	55%	0.552	33%	0.331	S	S	*	.	H	α-helix	trans	-71.2	-30.7	175.5	-61.5	0	0	0	0	113	R167 L168 P174	R167-S171 PolarHBondContact O-N 2.97Å; R167-S171 PolarHBondContact O-OG 3.4Å; R167-S171 VanDerWaalsContact O-OG 3.1Å; L168-S171 PolarHBondContact O-N 2.96Å; S171-P174 WeakPolarHBondContact O-CD 3.38Å; S171-P174 WeakPolarHBondContact O-CG 3.22Å
172	L	86	Confident	80.5	Confident	75 Å²	75	60.4 Å²	60.4	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-79	-23.4	175.8	-72.7	170.4	0	0	0	112.9	F48 F52 L168 G169 L175 A176	F48-L172 HydrophobicContact CE2-CD1 3.78Å; F48-L172 HydrophobicContact CZ-CD1 3.77Å; F52-L172 HydrophobicContact CD2-CB 4.18Å; F52-L172 HydrophobicContact CE2-CB 3.98Å; L168-L172 WeakPolarHBondContact O-CB 3.44Å; L168-L172 VanDerWaalsContact O-CG 3.31Å; L168-L172 WeakPolarHBondContact O-CG 3.41Å; L168-L172 PolarHBondContact O-N 3.34Å; G169-L172 PolarHBondContact O-N 3.21Å; L172-L175 HydrophobicContact CD2-CD2 4.45Å; L172-L175 WeakPolarHBondContact O-CB 3.36Å; L172-L175 PolarHBondContact O-N 3.12Å; L172-A176 PolarHBondContact O-N 2.81Å
173	A	83.3	Confident	79.6	Confident	0 Å²	0	69 Å²	69	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-56.4	-47.8	178.2	0	0	0	0	0	113.9	F52 Y55 L59 G169 G170 A176 A177 Y191	F52-A173 HydrophobicContact CD2-CB 4.3Å; Y55-A173 VanDerWaalsContact CB-CB 3.47Å; L59-A173 HydrophobicContact CD1-CB 4.27Å; G169-A173 PolarHBondContact O-N 3.09Å; G170-A173 WeakPolarHBondContact O-CB 3.43Å; G170-A173 PolarHBondContact O-N 3.48Å; A173-A176 PolarHBondContact O-N 3.48Å; A173-A177 PolarHBondContact O-N 3.21Å; A173-Y191 HydrophobicContact CB-CE1 4.42Å; A173-Y191 PolarHBondContact O-OH 3.18Å
174	P	81.9	Confident	78.7	Confident	51 Å²	51	72.9 Å²	72.9	33%	0.331	40%	0.402	S	S	.	.	H	α-helix	trans	-67.7	-32.1	174.7	25.1	-33.3	0	0	0	113	L59 G170 S171 A176 A177 L178	L59-P174 HydrophobicContact CD1-CB 3.9Å; G170-P174 WeakPolarHBondContact O-CD 3.49Å; S171-P174 WeakPolarHBondContact O-CD 3.38Å; S171-P174 WeakPolarHBondContact O-CG 3.22Å; P174-A176 VanDerWaalsContact C-N 3.27Å; P174-A176 PolarHBondContact O-N 3.3Å; P174-A177 WeakPolarHBondContact O-CB 3.35Å; P174-A177 PolarHBondContact O-N 3.45Å; P174-A177 VanDerWaalsContact O-N 3.12Å; P174-L178 WeakPolarHBondContact O-CD1 3.42Å; P174-L178 PolarHBondContact O-N 3.38Å
175	L	82.1	Confident	77.8	Confident	105 Å²	105	70 Å²	70	55%	0.55	39%	0.391	S	S	.	.	H	α-helix	trans	-59.2	-40.9	170.6	-101.2	85.5	0	0	0	111.5	L172 A177 L178 L179	L172-L175 HydrophobicContact CD2-CD2 4.45Å; L172-L175 WeakPolarHBondContact O-CB 3.36Å; L172-L175 PolarHBondContact O-N 3.12Å; L175-A177 VanDerWaalsContact C-N 3.35Å; L175-L178 WeakPolarHBondContact O-CB 3.5Å; L175-L178 PolarHBondContact O-N 3.26Å; L175-L179 WeakPolarHBondContact O-CD1 3.4Å
176	A	77.4	Confident	77	Confident	12 Å²	12	71.7 Å²	71.7	10%	0.099	40%	0.399	C	S	.	.	H	α-helix	trans	-71.1	-29.8	175	0	0	0	0	0	112.7	F52 L172 A173 P174 L178 L179 Y191	F52-A176 HydrophobicContact CE2-CB 4Å; F52-A176 HydrophobicContact CZ-CB 3.49Å; F52-A176 VanDerWaalsContact CZ-CB 3.49Å; L172-A176 PolarHBondContact O-N 2.81Å; A173-A176 PolarHBondContact O-N 3.48Å; P174-A176 VanDerWaalsContact C-N 3.27Å; P174-A176 PolarHBondContact O-N 3.3Å; A176-L178 VanDerWaalsContact C-N 3.33Å; A176-L179 WeakPolarHBondContact O-CB 3.4Å; A176-L179 PolarHBondContact O-N 3.16Å; A176-Y191 HydrophobicContact CB-CE1 4.08Å
177	A	75.3	Confident	76.4	Confident	33 Å²	33	72 Å²	72	27%	0.273	40%	0.401	S	S	.	.	H	α-helix	trans	-68.4	-33	172.3	0	0	0	0	0	111.8	L59 A173 P174 L175 L179 D180 Y191	L59-A177 HydrophobicContact CD1-CB 4.32Å; A173-A177 PolarHBondContact O-N 3.21Å; P174-A177 WeakPolarHBondContact O-CB 3.35Å; P174-A177 PolarHBondContact O-N 3.45Å; P174-A177 VanDerWaalsContact O-N 3.12Å; L175-A177 VanDerWaalsContact C-N 3.35Å; A177-L179 PolarHBondContact O-N 3.14Å; A177-D180 WeakPolarHBondContact O-CB 3.39Å; A177-D180 PolarHBondContact O-N 2.99Å; A177-D180 VanDerWaalsContact O-N 3.1Å; A177-Y191 PolarHBondContact N-OH 2.91Å
178	L	75.6	Confident	75.9	Confident	135 Å²	135	67.3 Å²	67.3	71%	0.707	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-63.4	-20.7	174.4	-83.2	142.5	0	0	0	113.4	P174 L175 A176 D180 G181	P174-L178 WeakPolarHBondContact O-CD1 3.42Å; P174-L178 PolarHBondContact O-N 3.38Å; L175-L178 WeakPolarHBondContact O-CB 3.5Å; L175-L178 PolarHBondContact O-N 3.26Å; A176-L178 VanDerWaalsContact C-N 3.33Å; L178-D180 PolarHBondContact O-N 2.96Å; L178-G181 PolarHBondContact O-N 3.26Å
179	L	71	Confident	75.5	Confident	73 Å²	73	67 Å²	67	38%	0.382	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-67.5	-11.9	173.8	-91.8	63.8	0	0	0	113.3	L175 A176 A177 G181 V182 W183	L175-L179 WeakPolarHBondContact O-CD1 3.4Å; A176-L179 WeakPolarHBondContact O-CB 3.4Å; A176-L179 PolarHBondContact O-N 3.16Å; A177-L179 PolarHBondContact O-N 3.14Å; L179-G181 PolarHBondContact O-N 2.72Å; L179-V182 PolarHBondContact O-N 3.29Å; L179-W183 PolarHBondContact O-N 2.71Å
180	D	66.3	Low	75.4	Confident	75 Å²	75	69 Å²	69	40%	0.401	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-56.8	-27.4	173.1	-160.4	46.9	0	0	0	112.1	A177 L178 V182 L184 P187	A177-D180 WeakPolarHBondContact O-CB 3.39Å; A177-D180 PolarHBondContact O-N 2.99Å; A177-D180 VanDerWaalsContact O-N 3.1Å; L178-D180 PolarHBondContact O-N 2.96Å; D180-V182 PolarHBondContact O-N 2.99Å; D180-L184 VanDerWaalsContact OD1-CA 3.29Å; D180-L184 WeakPolarHBondContact OD1-CA 3.41Å; D180-P187 HydrophobicContact CB-CG 3.95Å
181	G	61.8	Low	75.3	Confident	77 Å²	77	68.8 Å²	68.8	79%	0.794	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-68.9	-14.3	175.4	0	0	0	0	0	115.1	L178 L179	L178-G181 PolarHBondContact O-N 3.26Å; L179-G181 PolarHBondContact O-N 2.72Å
182	V	65.9	Low	75.1	Confident	109 Å²	109	65.4 Å²	65.4	66%	0.661	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-48.7	175.9	-162.6	0	0	0	0	110	L179 D180	L179-V182 PolarHBondContact O-N 3.29Å; D180-V182 PolarHBondContact O-N 2.99Å
183	W	66.1	Low	75	Confident	181 Å²	181	63.2 Å²	63.2	69%	0.686	36%	0.364	S	S	*	.			trans	-145.9	129.6	174.6	-77.4	59.8	0	0	0	111.5	L179 S185 L186 P187	L179-W183 PolarHBondContact O-N 2.71Å; W183-S185 PolarHBondContact O-N 3.38Å; W183-L186 HydrophobicContact CB-CB 4.2Å; W183-L186 HydrophobicContact CB-CD1 3.72Å; W183-L186 HydrophobicContact CB-CG 3.79Å; W183-L186 HydrophobicContact CG-CD1 4.13Å; W183-L186 HydrophobicContact CG-CG 4.42Å; W183-L186 PolarHBondContact O-N 3.35Å; W183-L186 VanDerWaalsContact O-N 3.15Å; W183-P187 WeakPolarHBondContact O-CD 3.31Å
184	L	65.2	Low	75.2	Confident	117 Å²	117	65.2 Å²	65.2	61%	0.613	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.9	-179	-155.8	78.1	0	0	0	114.8	D180	D180-L184 VanDerWaalsContact OD1-CA 3.29Å; D180-L184 WeakPolarHBondContact OD1-CA 3.41Å
185	S	69.1	Low	75.3	Confident	50 Å²	50	62.8 Å²	62.8	35%	0.35	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-14.8	-175.5	-67.2	0	0	0	0	114	W183 L189	W183-S185 PolarHBondContact O-N 3.38Å; S185-L189 PolarHBondContact O-N 3.05Å
186	L	71.4	Confident	75.6	Confident	62 Å²	62	62.2 Å²	62.2	33%	0.325	36%	0.356	S	S	.	.	H	α-helix	trans	-63.1	-45.7	-176.6	-90.8	173	0	0	0	113.3	W183 K188 L189 T190	W183-L186 HydrophobicContact CB-CB 4.2Å; W183-L186 HydrophobicContact CB-CD1 3.72Å; W183-L186 HydrophobicContact CB-CG 3.79Å; W183-L186 HydrophobicContact CG-CD1 4.13Å; W183-L186 HydrophobicContact CG-CG 4.42Å; W183-L186 PolarHBondContact O-N 3.35Å; W183-L186 VanDerWaalsContact O-N 3.15Å; L186-K188 VanDerWaalsContact C-N 3.35Å; L186-K188 PolarHBondContact O-N 3.44Å; L186-L189 PolarHBondContact O-N 2.75Å; L186-T190 WeakPolarHBondContact O-CG2 3.5Å; L186-T190 PolarHBondContact O-N 3.11Å; L186-T190 PolarHBondContact O-OG1 3.14Å
187	P	74.3	Confident	76.1	Confident	8 Å²	8	67.5 Å²	67.5	5%	0.052	38%	0.382	C	S	.	.	H	α-helix	trans	-59.8	-46.2	-178.7	-22.9	32.7	0	0	0	111.4	D180 W183 L189 T190 Y191	D180-P187 HydrophobicContact CB-CG 3.95Å; W183-P187 WeakPolarHBondContact O-CD 3.31Å; P187-L189 VanDerWaalsContact C-N 3.33Å; P187-L189 PolarHBondContact O-N 2.91Å; P187-T190 PolarHBondContact O-N 3.09Å; P187-T190 VanDerWaalsContact O-N 3.15Å; P187-T190 PolarHBondContact O-OG1 3.24Å; P187-Y191 VanDerWaalsContact C-CD2 3.5Å; P187-Y191 HydrophobicContact CB-CD2 4.42Å; P187-Y191 HydrophobicContact CB-CE2 3.82Å; P187-Y191 WeakPolarHBondContact O-CD2 3.37Å; P187-Y191 WeakPolarHBondContact O-CE2 3.43Å; P187-Y191 PolarHBondContact O-N 2.99Å
188	K	75.3	Confident	76.7	Confident	53 Å²	53	66 Å²	66	23%	0.23	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-40.5	179.6	-62.6	175.1	-171.9	168.9	0	112.3	L186 G192	L186-K188 VanDerWaalsContact C-N 3.35Å; L186-K188 PolarHBondContact O-N 3.44Å; K188-G192 PolarHBondContact O-N 3.24Å
189	L	80.3	Confident	77.2	Confident	101 Å²	101	59.6 Å²	59.6	53%	0.529	34%	0.336	S	S	.	.	H	α-helix	trans	-65.3	-41.5	175.1	-104.1	155	0	0	0	112.4	L114 S185 L186 P187 G193	L114-L189 HydrophobicContact CD2-CD1 4.18Å; L114-L189 HydrophobicContact CD2-CG 4.05Å; S185-L189 PolarHBondContact O-N 3.05Å; L186-L189 PolarHBondContact O-N 2.75Å; P187-L189 VanDerWaalsContact C-N 3.33Å; P187-L189 PolarHBondContact O-N 2.91Å; L189-G193 PolarHBondContact O-N 3.05Å
190	T	83.1	Confident	77.8	Confident	43 Å²	43	57.7 Å²	57.7	26%	0.264	33%	0.334	S	S	.	.	H	α-helix	trans	-67.5	-44	178.2	59.4	0	0	0	0	112.2	L186 P187 G193 I194	L186-T190 WeakPolarHBondContact O-CG2 3.5Å; L186-T190 PolarHBondContact O-N 3.11Å; L186-T190 PolarHBondContact O-OG1 3.14Å; P187-T190 PolarHBondContact O-N 3.09Å; P187-T190 VanDerWaalsContact O-N 3.15Å; P187-T190 PolarHBondContact O-OG1 3.24Å; T190-G193 PolarHBondContact O-N 3.4Å; T190-I194 WeakPolarHBondContact O-CB 3.34Å; T190-I194 WeakPolarHBondContact O-CG1 3.03Å; T190-I194 PolarHBondContact O-N 3.42Å
191	Y	82.8	Confident	78.6	Confident	5 Å²	5	55.5 Å²	55.5	2%	0.02	32%	0.323	C	S	.	.	H	α-helix	trans	-61.4	-48.8	175	-60.4	-52.2	0	0	0	111.5	F52 G56 F110 A173 A176 A177 P187 A195	F52-Y191 AromaticContact CD1-CD1 3.49Å; F52-Y191 HydrophobicContact CD1-CD1 3.49Å; F52-Y191 VanDerWaalsContact CD1-CD1 3.49Å; F52-Y191 AromaticContact CD1-CE1 3.98Å; F52-Y191 HydrophobicContact CD1-CE1 3.98Å; F52-Y191 AromaticContact CE1-CD1 3.15Å; F52-Y191 HydrophobicContact CE1-CD1 3.15Å; F52-Y191 AromaticContact CE1-CE1 3.46Å; F52-Y191 HydrophobicContact CE1-CE1 3.46Å; F52-Y191 VanDerWaalsContact CE1-CE1 3.46Å; F52-Y191 HydrophobicContact CE1-CG 4.2Å; F52-Y191 HydrophobicContact CE2-CE1 4.31Å; F52-Y191 HydrophobicContact CG-CD1 4.4Å; F52-Y191 AromaticContact CZ-CD1 3.87Å; F52-Y191 HydrophobicContact CZ-CD1 3.87Å; F52-Y191 AromaticContact CZ-CE1 3.66Å; F52-Y191 HydrophobicContact CZ-CE1 3.66Å; G56-Y191 VanDerWaalsContact CA-CE1 3.41Å; F110-Y191 HydrophobicContact CE1-CD2 4.01Å; F110-Y191 HydrophobicContact CE1-CG 4.21Å; F110-Y191 HydrophobicContact CZ-CD2 4.41Å; F110-Y191 HydrophobicContact CZ-CG 4.23Å; A173-Y191 HydrophobicContact CB-CE1 4.42Å; A173-Y191 PolarHBondContact O-OH 3.18Å; A176-Y191 HydrophobicContact CB-CE1 4.08Å; A177-Y191 PolarHBondContact N-OH 2.91Å; P187-Y191 VanDerWaalsContact C-CD2 3.5Å; P187-Y191 HydrophobicContact CB-CD2 4.42Å; P187-Y191 HydrophobicContact CB-CE2 3.82Å; P187-Y191 WeakPolarHBondContact O-CD2 3.37Å; P187-Y191 WeakPolarHBondContact O-CE2 3.43Å; P187-Y191 PolarHBondContact O-N 2.99Å; Y191-A195 WeakPolarHBondContact O-CB 3.37Å; Y191-A195 PolarHBondContact O-N 2.92Å
192	G	82.2	Confident	79.6	Confident	8 Å²	8	51.8 Å²	51.8	8%	0.082	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-43.1	177.9	0	0	0	0	0	113.1	K188 A195 L196	K188-G192 PolarHBondContact O-N 3.24Å; G192-A195 WeakPolarHBondContact O-CB 3.43Å; G192-A195 PolarHBondContact O-N 3.46Å; G192-L196 WeakPolarHBondContact O-CG 3.31Å; G192-L196 PolarHBondContact O-N 3.28Å
193	G	85.2	Confident	80.2	Confident	29 Å²	29	50 Å²	50	30%	0.299	27%	0.272	S	S	.	.	H	α-helix	trans	-64.5	-43.2	179.2	0	0	0	0	0	112.7	L189 T190 A195 L196 L197	L189-G193 PolarHBondContact O-N 3.05Å; T190-G193 PolarHBondContact O-N 3.4Å; G193-A195 VanDerWaalsContact C-N 3.35Å; G193-L196 PolarHBondContact O-N 3.49Å; G193-L197 WeakPolarHBondContact O-CG 3.47Å; G193-L197 PolarHBondContact O-N 2.88Å
194	I	86.7	Confident	80.8	Confident	42 Å²	42	46.9 Å²	46.9	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-67.1	-38.3	175.6	-70.8	164.5	0	0	0	110.8	F48 F52 T190 L196 L197 A198	F48-I194 HydrophobicContact CD1-CG2 4.18Å; F48-I194 HydrophobicContact CE1-CD1 4.49Å; F48-I194 HydrophobicContact CE1-CG2 4.27Å; F52-I194 HydrophobicContact CD1-CB 4.15Å; F52-I194 HydrophobicContact CD1-CD1 3.55Å; F52-I194 HydrophobicContact CD1-CG1 4.44Å; F52-I194 HydrophobicContact CD1-CG2 4.09Å; F52-I194 HydrophobicContact CE1-CB 4.49Å; F52-I194 HydrophobicContact CE1-CD1 3.26Å; F52-I194 HydrophobicContact CE1-CG1 4.41Å; F52-I194 HydrophobicContact CE2-CD1 4.44Å; F52-I194 HydrophobicContact CG-CD1 4.27Å; F52-I194 HydrophobicContact CZ-CD1 3.76Å; T190-I194 WeakPolarHBondContact O-CB 3.34Å; T190-I194 WeakPolarHBondContact O-CG1 3.03Å; T190-I194 PolarHBondContact O-N 3.42Å; I194-L196 VanDerWaalsContact C-N 3.35Å; I194-L196 PolarHBondContact O-N 3.35Å; I194-L197 PolarHBondContact O-N 3.45Å; I194-A198 WeakPolarHBondContact O-CB 3.4Å; I194-A198 PolarHBondContact O-N 3.39Å
195	A	85.3	Confident	81	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-39.4	173.4	0	0	0	0	0	112.4	A107 Y191 G192 G193 A198 A199	A107-A195 HydrophobicContact CB-CB 3.98Å; Y191-A195 WeakPolarHBondContact O-CB 3.37Å; Y191-A195 PolarHBondContact O-N 2.92Å; G192-A195 WeakPolarHBondContact O-CB 3.43Å; G192-A195 PolarHBondContact O-N 3.46Å; G193-A195 VanDerWaalsContact C-N 3.35Å; A195-A198 PolarHBondContact O-N 3.22Å; A195-A199 WeakPolarHBondContact O-CB 3.49Å; A195-A199 PolarHBondContact O-N 3.36Å
196	L	87.9	Confident	80.7	Confident	94 Å²	94	42.5 Å²	42.5	49%	0.492	25%	0.245	S	C	.	.	H	α-helix	trans	-65.2	-44.2	174.5	-75.1	172.8	0	0	0	112.3	L104 A107 G192 G193 I194 A198 A199 G200	L104-L196 HydrophobicContact CD2-CD2 3.99Å; A107-L196 HydrophobicContact CB-CD2 3.54Å; A107-L196 HydrophobicContact CB-CG 3.62Å; G192-L196 WeakPolarHBondContact O-CG 3.31Å; G192-L196 PolarHBondContact O-N 3.28Å; G193-L196 PolarHBondContact O-N 3.49Å; I194-L196 VanDerWaalsContact C-N 3.35Å; I194-L196 PolarHBondContact O-N 3.35Å; L196-A198 VanDerWaalsContact C-N 3.31Å; L196-A198 PolarHBondContact O-N 2.78Å; L196-A199 WeakPolarHBondContact O-CB 2.94Å; L196-A199 PolarHBondContact O-N 3.26Å; L196-G200 PolarHBondContact O-N 2.98Å
197	L	88.1	Confident	80.1	Confident	122 Å²	122	44.8 Å²	44.8	64%	0.639	25%	0.254	S	S	*	.	H	α-helix	trans	-61	-43	175.3	-71.2	173.4	0	0	0	110.9	G193 I194 A199 G200 T201	G193-L197 WeakPolarHBondContact O-CG 3.47Å; G193-L197 PolarHBondContact O-N 2.88Å; I194-L197 PolarHBondContact O-N 3.45Å; L197-A199 VanDerWaalsContact C-N 3.33Å; L197-A199 PolarHBondContact O-N 3.32Å; L197-G200 PolarHBondContact O-N 3.31Å; L197-T201 WeakPolarHBondContact O-CG2 3.4Å; L197-T201 PolarHBondContact O-N 3.42Å; L197-T201 PolarHBondContact O-OG1 3.21Å
198	A	86.5	Confident	79.2	Confident	1 Å²	1	46 Å²	46	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-36.8	174.7	0	0	0	0	0	112.5	L103 I194 A195 L196 T201 A202	L103-A198 HydrophobicContact CD1-CB 4.07Å; L103-A198 HydrophobicContact CD2-CB 4.15Å; I194-A198 WeakPolarHBondContact O-CB 3.4Å; I194-A198 PolarHBondContact O-N 3.39Å; A195-A198 PolarHBondContact O-N 3.22Å; L196-A198 VanDerWaalsContact C-N 3.31Å; L196-A198 PolarHBondContact O-N 2.78Å; A198-T201 WeakPolarHBondContact CA-OG1 3.43Å; A198-T201 PolarHBondContact O-N 3.37Å; A198-T201 PolarHBondContact O-OG1 3.15Å; A198-A202 WeakPolarHBondContact O-CB 3.41Å; A198-A202 PolarHBondContact O-N 2.95Å
199	A	86.1	Confident	77.8	Confident	1 Å²	1	53 Å²	53	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-42.8	174	0	0	0	0	0	111.8	L103 L104 A195 L196 L197 A202 L203	L103-A199 HydrophobicContact CB-CB 3.72Å; L104-A199 HydrophobicContact CD2-CB 3.62Å; L104-A199 HydrophobicContact CG-CB 3.79Å; A195-A199 WeakPolarHBondContact O-CB 3.49Å; A195-A199 PolarHBondContact O-N 3.36Å; L196-A199 WeakPolarHBondContact O-CB 2.94Å; L196-A199 PolarHBondContact O-N 3.26Å; L197-A199 VanDerWaalsContact C-N 3.33Å; L197-A199 PolarHBondContact O-N 3.32Å; A199-A202 WeakPolarHBondContact O-CB 3.37Å; A199-A202 PolarHBondContact O-N 3.12Å; A199-L203 PolarHBondContact O-N 2.96Å; A199-L203 VanDerWaalsContact O-N 3.07Å
200	G	84.3	Confident	75.7	Confident	34 Å²	34	57.3 Å²	57.3	35%	0.351	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-42.8	175.7	0	0	0	0	0	112.3	L196 L197 L203 L204	L196-G200 PolarHBondContact O-N 2.98Å; L197-G200 PolarHBondContact O-N 3.31Å; G200-L203 WeakPolarHBondContact O-CB 3.29Å; G200-L203 PolarHBondContact O-N 3.35Å; G200-L204 PolarHBondContact O-N 3.33Å
201	T	83.4	Confident	73.6	Confident	28 Å²	28	63.3 Å²	63.3	17%	0.172	36%	0.357	C	S	.	.	H	α-helix	trans	-69.8	-32.1	174.8	59.2	0	0	0	0	112.8	V45 L197 A198 L203 L204 L205	V45-T201 HydrophobicContact CB-CG2 4.31Å; V45-T201 HydrophobicContact CG1-CG2 3.78Å; V45-T201 WeakPolarHBondContact CG1-OG1 3.44Å; L197-T201 WeakPolarHBondContact O-CG2 3.4Å; L197-T201 PolarHBondContact O-N 3.42Å; L197-T201 PolarHBondContact O-OG1 3.21Å; A198-T201 WeakPolarHBondContact CA-OG1 3.43Å; A198-T201 PolarHBondContact O-N 3.37Å; A198-T201 PolarHBondContact O-OG1 3.15Å; T201-L203 PolarHBondContact O-N 2.94Å; T201-L204 WeakPolarHBondContact O-CB 3.14Å; T201-L204 PolarHBondContact O-N 3.17Å; T201-L205 PolarHBondContact O-N 3.29Å
202	A	81.7	Confident	73.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-63.9	-29	171.3	0	0	0	0	0	112.6	V46 Q99 A100 L103 A198 A199 L205	V46-A202 HydrophobicContact CG2-CB 4.11Å; Q99-A202 HydrophobicContact CB-CB 4.43Å; Q99-A202 HydrophobicContact CG-CB 3.79Å; A100-A202 HydrophobicContact CB-CB 4.37Å; L103-A202 HydrophobicContact CD1-CB 4.05Å; A198-A202 WeakPolarHBondContact O-CB 3.41Å; A198-A202 PolarHBondContact O-N 2.95Å; A199-A202 WeakPolarHBondContact O-CB 3.37Å; A199-A202 PolarHBondContact O-N 3.12Å; A202-L205 WeakPolarHBondContact O-CB 3.35Å
203	L	80.3	Confident	72.6	Confident	71 Å²	71	69.3 Å²	69.3	37%	0.372	39%	0.39	S	S	.	.	H	α-helix	trans	-74.2	-27.5	171.5	-68.2	172.9	0	0	0	112.3	R96 A100 A199 G200 T201 L205	R96-L203 PolarHBondContact NE-O 3.18Å; R96-L203 PolarHBondContact NH2-O 3.15Å; A100-L203 HydrophobicContact CB-CD2 3.52Å; A100-L203 HydrophobicContact CB-CG 3.85Å; A199-L203 PolarHBondContact O-N 2.96Å; A199-L203 VanDerWaalsContact O-N 3.07Å; G200-L203 WeakPolarHBondContact O-CB 3.29Å; G200-L203 PolarHBondContact O-N 3.35Å; T201-L203 PolarHBondContact O-N 2.94Å; L203-L205 PolarHBondContact O-N 3Å
204	L	77.9	Confident	71.9	Confident	116 Å²	116	71.5 Å²	71.5	61%	0.607	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-7.7	176.7	-73.9	156.1	0	0	0	113.5	G200 T201	G200-L204 PolarHBondContact O-N 3.33Å; T201-L204 WeakPolarHBondContact O-CB 3.14Å; T201-L204 PolarHBondContact O-N 3.17Å
205	L	69.6	Low	71.1	Confident	4 Å²	4	73.2 Å²	73.2	2%	0.021	41%	0.405	C	S	.	.	S	Bend	trans	-67.6	130.3	175.3	-100.1	42	0	0	0	111.6	C42 R96 F145 T201 A202 L203	C42-L205 HydrophobicContact CB-CD1 3.05Å; R96-L205 WeakPolarHBondContact CD-O 3.38Å; R96-L205 PolarHBondContact NE-O 3.1Å; F145-L205 HydrophobicContact CD1-CD2 3.62Å; F145-L205 HydrophobicContact CD1-CG 4.47Å; F145-L205 HydrophobicContact CE1-CB 4.25Å; F145-L205 HydrophobicContact CE1-CD2 2.95Å; F145-L205 HydrophobicContact CE1-CG 3.39Å; F145-L205 HydrophobicContact CE2-CD2 4.2Å; F145-L205 HydrophobicContact CG-CD2 4.48Å; F145-L205 HydrophobicContact CZ-CB 3.85Å; F145-L205 HydrophobicContact CZ-CD2 3.29Å; F145-L205 HydrophobicContact CZ-CG 3.52Å; T201-L205 PolarHBondContact O-N 3.29Å; A202-L205 WeakPolarHBondContact O-CB 3.35Å; L203-L205 PolarHBondContact O-N 3Å
206	P	61.7	Low	70.2	Confident	71 Å²	71	77.8 Å²	77.8	46%	0.461	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-62.9	137.6	171.4	25.7	-31.3	0	0	0	110.2	T208	P206-T208 PolarHBondContact O-N 2.99Å
207	E	59.1	Low	69	Low	110 Å²	110	76.7 Å²	76.7	51%	0.514	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-66.8	123.4	-177.4	-69.7	-169.1	168.6	0	0	111.5	R96 R209	R96-E207 HydrophobicContact CB-CG 4.4Å; R96-E207 VanDerWaalsContact CD-CG 3.49Å; R96-E207 IonicContact CZ-OE1 2.71Å; R96-E207 IonicContact NH1-OE1 2.72Å; R96-E207 PolarHBondContact NH1-OE1 3.22Å; E207-R209 PolarHBondContact O-N 3.23Å
208	T	56.8	Low	67.6	Low	34 Å²	34	73.5 Å²	73.5	21%	0.209	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	14.6	172.6	42.7	0	0	0	0	113.7	F145 L149 P206 Q210	F145-T208 HydrophobicContact CE2-CG2 4.38Å; L149-T208 HydrophobicContact CD1-CG2 3.42Å; L149-T208 VanDerWaalsContact CD1-CG2 3.42Å; L149-T208 HydrophobicContact CD2-CG2 4.45Å; L149-T208 HydrophobicContact CG-CG2 3.77Å; P206-T208 PolarHBondContact O-N 2.99Å; T208-Q210 PolarHBondContact O-N 3.3Å
209	R	45	Very low	66.2	Low	198 Å²	198	79.1 Å²	79.1	75%	0.747	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-2.2	-176.7	-150.7	-177.2	176.7	164.5	1.5	113.6	E207	E207-R209 PolarHBondContact O-N 3.23Å
210	Q	36.9	Very low	64.5	Low	193 Å²	193	85.6 Å²	85.6	90%	0.902	48%	0.479	S	S	*	.			trans	-128.5	77.1	173	-70.6	-176.7	-24.5	0	0	110.2	T208	T208-Q210 PolarHBondContact O-N 3.3Å
211	A	37.5	Very low	62.7	Low	168 Å²	168	90.3 Å²	90.3	100%	1.388	49%	0.49	S	S	*	.			trans	-146	0	159.2	0	0	0	0	0	108.3

Retrieved 211 of 211 residues in 45.8 ms (Link to these results)

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