A0A096M212_POEFO Loading...

Solute carrier family 24 member 4

AlphaFold DB , UniProt , Accession A0A096M212, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 593 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	35.2	Very low	28.4	Very low	241 Å²	241	153.1 Å²	153.1	100%	1.187	81%	0.812	S	S	*	*				0	116.4	0	-152.5	158.9	178.5	0	0	105.6
2	E	30.4	Very low	28.8	Very low	195 Å²	195	146.4 Å²	146.4	91%	0.911	79%	0.787	S	S	*	*			trans	-58.3	152.7	-152.8	-87.1	124.8	129.6	0	0	117.5
3	R	28.1	Very low	28.8	Very low	216 Å²	216	148.6 Å²	148.6	82%	0.815	79%	0.785	S	S	*	*			trans	-92.3	131.8	175.2	-167.1	-172	-63.6	170.7	-1.8	106.4	D5	R3-D5 WeakPolarHBondContact CD-OD2 3.27Å
4	D	26.7	Very low	29.1	Very low	167 Å²	167	149.4 Å²	149.4	89%	0.893	78%	0.778	S	S	*	*			trans	-128.2	95.1	172.5	-142.9	4.1	0	0	0	108.1
5	D	28.3	Very low	29.3	Very low	129 Å²	129	143.8 Å²	143.8	69%	0.69	75%	0.753	S	S	*	*			trans	-88.7	102.5	174.4	-72.1	-46.9	0	0	0	107.8	R3 E7	R3-D5 WeakPolarHBondContact CD-OD2 3.27Å; D5-E7 PolarHBondContact O-N 3.46Å
6	S	26.5	Very low	29.6	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	73%	0.728	S	S	*	*			trans	-84.5	88.4	170.1	61.3	0	0	0	0	109.9	T8	S6-T8 PolarHBondContact O-N 3.22Å; S6-T8 VanDerWaalsContact O-N 3.15Å
7	E	26	Very low	29.8	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	72%	0.715	S	S	*	*			trans	-64.6	104.7	165.1	-80.1	-175.3	149.4	0	0	109.7	D5 V9	D5-E7 PolarHBondContact O-N 3.46Å; E7-V9 PolarHBondContact O-N 3.32Å; E7-V9 VanDerWaalsContact O-N 3.11Å
8	T	25.8	Very low	30.1	Very low	134 Å²	134	131.4 Å²	131.4	82%	0.822	69%	0.694	S	S	*	*			trans	-70.5	101.1	165	42.7	0	0	0	0	109.3	S6 C10	S6-T8 PolarHBondContact O-N 3.22Å; S6-T8 VanDerWaalsContact O-N 3.15Å; T8-C10 PolarHBondContact O-N 3.45Å; T8-C10 VanDerWaalsContact O-N 3.1Å
9	V	28.2	Very low	30.5	Very low	130 Å²	130	130.5 Å²	130.5	79%	0.788	68%	0.684	S	S	*	*			trans	-60.2	109.7	169.4	178.2	0	0	0	0	108.6	E7 P11	E7-V9 PolarHBondContact O-N 3.32Å; E7-V9 VanDerWaalsContact O-N 3.11Å; V9-P11 WeakPolarHBondContact O-CD 3.42Å
10	C	26.5	Very low	30.5	Very low	112 Å²	112	128.7 Å²	128.7	76%	0.757	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-72	119.8	175.7	-150.2	0	0	0	0	108	T8 S12	T8-C10 PolarHBondContact O-N 3.45Å; T8-C10 VanDerWaalsContact O-N 3.1Å; C10-S12 PolarHBondContact O-N 3.41Å
11	P	31.1	Very low	30.7	Very low	70 Å²	70	127.7 Å²	127.7	46%	0.455	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-62.4	139.5	-177.5	21.1	-27.9	0	0	0	110.2	V9 K13 I16	V9-P11 WeakPolarHBondContact O-CD 3.42Å; P11-K13 PolarHBondContact O-N 3.48Å; P11-I16 HydrophobicContact CB-CG1 4.36Å; P11-I16 HydrophobicContact CG-CD1 4.07Å; P11-I16 HydrophobicContact CG-CG1 3.99Å
12	S	32.8	Very low	31	Very low	73 Å²	73	120.5 Å²	120.5	51%	0.51	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-47.5	138.3	177.9	177.7	0	0	0	0	110.9	C10 K14 T15 I16	C10-S12 PolarHBondContact O-N 3.41Å; S12-K14 PolarHBondContact O-N 3.36Å; S12-T15 WeakPolarHBondContact O-CB 3.39Å; S12-T15 PolarHBondContact O-N 3.05Å; S12-T15 PolarHBondContact O-OG1 3.14Å; S12-I16 PolarHBondContact O-N 2.9Å
13	K	29	Very low	31.4	Very low	175 Å²	175	114.7 Å²	114.7	76%	0.761	60%	0.604	S	S	*	*	H	α-helix	trans	-51.1	-26.3	179	-75.4	180	177.8	176.9	0	112.8	P11 I17	P11-K13 PolarHBondContact O-N 3.48Å; K13-I17 WeakPolarHBondContact O-CD1 3.34Å; K13-I17 VanDerWaalsContact O-CG1 3.25Å; K13-I17 WeakPolarHBondContact O-CG1 3.47Å; K13-I17 PolarHBondContact O-N 3.35Å
14	K	32.9	Very low	31.7	Very low	160 Å²	160	113.7 Å²	113.7	70%	0.696	60%	0.6	S	S	*	*	H	α-helix	trans	-65.1	-43.6	173.6	-68.5	-175.6	177.6	-178.9	0	112.4	S12 I16 I17 A18	S12-K14 PolarHBondContact O-N 3.36Å; K14-I16 PolarHBondContact O-N 3.4Å; K14-I17 PolarHBondContact O-N 2.96Å; K14-A18 WeakPolarHBondContact O-CB 3.44Å; K14-A18 PolarHBondContact O-N 3.02Å
15	T	32.7	Very low	32.6	Very low	65 Å²	65	108.4 Å²	108.4	40%	0.399	57%	0.569	S	S	.	*	H	α-helix	trans	-66.7	-37	179.7	-43.6	0	0	0	0	112.1	S12 K19	S12-T15 WeakPolarHBondContact O-CB 3.39Å; S12-T15 PolarHBondContact O-N 3.05Å; S12-T15 PolarHBondContact O-OG1 3.14Å; T15-K19 WeakPolarHBondContact O-CB 3.24Å; T15-K19 WeakPolarHBondContact O-CG 2.99Å; T15-K19 PolarHBondContact O-N 3.34Å
16	I	33.4	Very low	33.6	Very low	70 Å²	70	105.4 Å²	105.4	36%	0.359	55%	0.548	S	S	.	.	H	α-helix	trans	-70.7	-42.6	178	-59.5	176.4	0	0	0	110.8	P11 S12 K14 K19 I20	P11-I16 HydrophobicContact CB-CG1 4.36Å; P11-I16 HydrophobicContact CG-CD1 4.07Å; P11-I16 HydrophobicContact CG-CG1 3.99Å; S12-I16 PolarHBondContact O-N 2.9Å; K14-I16 PolarHBondContact O-N 3.4Å; I16-K19 PolarHBondContact O-N 3.06Å; I16-I20 HydrophobicContact CG2-CD1 3.66Å; I16-I20 HydrophobicContact CG2-CG1 4.34Å; I16-I20 WeakPolarHBondContact O-CB 3.49Å; I16-I20 WeakPolarHBondContact O-CD1 3.48Å; I16-I20 WeakPolarHBondContact O-CG1 3.42Å; I16-I20 PolarHBondContact O-N 3.42Å
17	I	32.4	Very low	34.3	Very low	99 Å²	99	106.3 Å²	106.3	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-67	-38.1	177.4	-67.4	167.8	0	0	0	111.2	K13 K14 I20 F21	K13-I17 WeakPolarHBondContact O-CD1 3.34Å; K13-I17 VanDerWaalsContact O-CG1 3.25Å; K13-I17 WeakPolarHBondContact O-CG1 3.47Å; K13-I17 PolarHBondContact O-N 3.35Å; K14-I17 PolarHBondContact O-N 2.96Å; I17-I20 PolarHBondContact O-N 3.06Å; I17-F21 PolarHBondContact O-N 2.81Å; I17-F21 VanDerWaalsContact O-N 3.15Å
18	A	35.4	Very low	35.5	Very low	40 Å²	40	102.5 Å²	102.5	33%	0.331	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-46.3	172	0	0	0	0	0	111.6	K14 F21 K22	K14-A18 WeakPolarHBondContact O-CB 3.44Å; K14-A18 PolarHBondContact O-N 3.02Å; A18-F21 PolarHBondContact O-N 3.36Å; A18-K22 VanDerWaalsContact O-CB 3.31Å; A18-K22 WeakPolarHBondContact O-CB 3.3Å; A18-K22 PolarHBondContact O-N 2.98Å
19	K	37.4	Very low	36.5	Very low	114 Å²	114	97.1 Å²	97.1	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-63	-41.7	175.8	-79.6	-176.9	176.4	-178.3	0	113	T15 I16 F21 K22 V23	T15-K19 WeakPolarHBondContact O-CB 3.24Å; T15-K19 WeakPolarHBondContact O-CG 2.99Å; T15-K19 PolarHBondContact O-N 3.34Å; I16-K19 PolarHBondContact O-N 3.06Å; K19-F21 VanDerWaalsContact C-N 3.34Å; K19-F21 PolarHBondContact O-N 3.47Å; K19-K22 PolarHBondContact O-N 3.42Å; K19-V23 PolarHBondContact O-N 3.02Å
20	I	31.5	Very low	37.4	Very low	94 Å²	94	92.6 Å²	92.6	48%	0.482	45%	0.454	S	S	.	.	H	α-helix	trans	-65.2	-34.8	180	-71	167.4	0	0	0	112.1	I16 I17	I16-I20 HydrophobicContact CG2-CD1 3.66Å; I16-I20 HydrophobicContact CG2-CG1 4.34Å; I16-I20 WeakPolarHBondContact O-CB 3.49Å; I16-I20 WeakPolarHBondContact O-CD1 3.48Å; I16-I20 WeakPolarHBondContact O-CG1 3.42Å; I16-I20 PolarHBondContact O-N 3.42Å; I17-I20 PolarHBondContact O-N 3.06Å
21	F	35.3	Very low	38.5	Very low	107 Å²	107	94.2 Å²	94.2	47%	0.469	45%	0.448	S	S	.	.	H	α-helix	trans	-85.3	-27.9	176	-100.1	-90.2	0	0	0	114	I17 A18 K19 V23 R24	I17-F21 PolarHBondContact O-N 2.81Å; I17-F21 VanDerWaalsContact O-N 3.15Å; A18-F21 PolarHBondContact O-N 3.36Å; K19-F21 VanDerWaalsContact C-N 3.34Å; K19-F21 PolarHBondContact O-N 3.47Å; F21-V23 PolarHBondContact O-N 3.41Å; F21-R24 PolarHBondContact O-N 3.34Å
22	K	40.4	Very low	39.6	Very low	91 Å²	91	94 Å²	94	40%	0.396	45%	0.445	S	S	.	.	H	α-helix	trans	-57.6	-28.7	173.1	-158.1	173.7	-174.7	-178.7	0	111.9	A18 K19 E137	A18-K22 VanDerWaalsContact O-CB 3.31Å; A18-K22 WeakPolarHBondContact O-CB 3.3Å; A18-K22 PolarHBondContact O-N 2.98Å; K19-K22 PolarHBondContact O-N 3.42Å; K22-E137 IonicContact NZ-OE1 3.48Å
23	V	38.6	Very low	40.5	Very low	73 Å²	73	90.8 Å²	90.8	44%	0.442	42%	0.422	S	S	.	.	H	α-helix	trans	-88.9	-36.8	175.8	-179.1	0	0	0	0	112.7	K19 F21 K25	K19-V23 PolarHBondContact O-N 3.02Å; F21-V23 PolarHBondContact O-N 3.41Å; V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.25Å
24	R	34.6	Very low	41.8	Very low	194 Å²	194	84.7 Å²	84.7	73%	0.732	40%	0.4	S	S	*	.	H	α-helix	trans	-73	-14.5	-170.6	-159.3	162.3	-175.4	148.8	1	115	F21	F21-R24 PolarHBondContact O-N 3.34Å
25	K	46	Very low	43.1	Very low	56 Å²	56	80 Å²	80	24%	0.243	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	11.1	-171.5	-139.6	-179.8	179.5	-149.3	0	117	V23 R27 E28	V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.25Å; K25-R27 PolarHBondContact O-N 2.75Å; K25-R27 VanDerWaalsContact O-N 3.08Å; K25-E28 WeakPolarHBondContact CE-OE1 3.44Å; K25-E28 WeakPolarHBondContact CE-OE2 3.25Å; K25-E28 IonicContact NZ-OE1 2.81Å; K25-E28 IonicContact NZ-OE2 2.85Å; K25-E28 PolarHBondContact NZ-OE2 3.37Å; K25-E28 PolarHBondContact O-N 3.21Å
26	R	49.6	Very low	44.5	Very low	67 Å²	67	79.6 Å²	79.6	25%	0.253	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-16.8	169	-66.8	-177.3	-166.2	170.3	3.2	113.9	E28 M29 E130	R26-E28 VanDerWaalsContact C-N 3.27Å; R26-E28 PolarHBondContact O-N 3.24Å; R26-M29 PolarHBondContact O-N 3.22Å; R26-E130 IonicContact CZ-OE1 3Å; R26-E130 IonicContact NH1-OE1 2.76Å; R26-E130 PolarHBondContact NH1-OE1 3.12Å; R26-E130 IonicContact NH1-OE2 3.31Å; R26-E130 IonicContact NH2-OE1 3.19Å; R26-E130 PolarHBondContact NH2-OE1 2.65Å
27	R	41.3	Very low	45.8	Very low	130 Å²	130	76.3 Å²	76.3	49%	0.491	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-24.3	174.2	-97.4	-177.8	165.7	-156.1	5.9	113.9	K25 S395 K398	K25-R27 PolarHBondContact O-N 2.75Å; K25-R27 VanDerWaalsContact O-N 3.08Å; R27-S395 PolarHBondContact NE-OG 2.81Å; R27-S395 PolarHBondContact NH2-OG 3.14Å; R27-K398 HydrophobicContact CG-CD 4.38Å; R27-K398 PolarHBondContact O-NZ 2.93Å
28	E	50.1	Low	47	Very low	98 Å²	98	74.2 Å²	74.2	46%	0.458	36%	0.356	S	S	.	.	H	α-helix	trans	-96.2	-22.5	179.3	-74.7	178.6	-156.9	0	0	113	K25 R26 L30 F31 V32	K25-E28 WeakPolarHBondContact CE-OE1 3.44Å; K25-E28 WeakPolarHBondContact CE-OE2 3.25Å; K25-E28 IonicContact NZ-OE1 2.81Å; K25-E28 IonicContact NZ-OE2 2.85Å; K25-E28 PolarHBondContact NZ-OE2 3.37Å; K25-E28 PolarHBondContact O-N 3.21Å; R26-E28 VanDerWaalsContact C-N 3.27Å; R26-E28 PolarHBondContact O-N 3.24Å; E28-L30 PolarHBondContact O-N 3.02Å; E28-F31 PolarHBondContact O-N 2.98Å; E28-V32 HydrophobicContact CB-CG2 4.37Å; E28-V32 VanDerWaalsContact O-CB 3.29Å; E28-V32 WeakPolarHBondContact O-CB 3.45Å; E28-V32 VanDerWaalsContact O-CG2 3.24Å; E28-V32 WeakPolarHBondContact O-CG2 3.42Å; E28-V32 PolarHBondContact O-N 3.15Å
29	M	47.3	Very low	48.4	Very low	21 Å²	21	75.5 Å²	75.5	10%	0.103	36%	0.362	C	S	.	.	H	α-helix	trans	-54.4	-54.8	-176.4	-65	-99.8	-79.2	0	0	112.1	R26 F31 V32 Q33 P473 I476	R26-M29 PolarHBondContact O-N 3.22Å; M29-F31 PolarHBondContact O-N 3.07Å; M29-V32 PolarHBondContact O-N 3.22Å; M29-Q33 WeakPolarHBondContact O-CA 3.49Å; M29-Q33 WeakPolarHBondContact O-CB 3.27Å; M29-Q33 WeakPolarHBondContact O-CG 3.29Å; M29-Q33 PolarHBondContact O-N 2.7Å; M29-Q33 PolarHBondContact O-OE1 2.71Å; M29-P473 HydrophobicContact CE-CB 4.11Å; M29-I476 HydrophobicContact CB-CD1 4.3Å; M29-I476 HydrophobicContact CG-CD1 3.97Å; M29-I476 HydrophobicContact SD-CB 3.87Å; M29-I476 HydrophobicContact SD-CD1 3.33Å; M29-I476 WeakPolarHBondContact SD-CD1 3.43Å; M29-I476 HydrophobicContact SD-CG1 4.17Å; M29-I476 HydrophobicContact SD-CG2 3.77Å
30	L	47.9	Very low	49.5	Very low	36 Å²	36	70.9 Å²	70.9	19%	0.188	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-44.4	-179.3	-93.5	165.2	0	0	0	114	E28 V34 L122	E28-L30 PolarHBondContact O-N 3.02Å; L30-V34 WeakPolarHBondContact O-CB 3.47Å; L30-V34 WeakPolarHBondContact O-CG2 3.28Å; L30-V34 PolarHBondContact O-N 3.42Å; L30-L122 HydrophobicContact CD1-CD1 3.72Å; L30-L122 HydrophobicContact CD1-CD2 3.77Å; L30-L122 HydrophobicContact CD1-CG 4.33Å; L30-L122 HydrophobicContact CD2-CB 4.08Å; L30-L122 HydrophobicContact CD2-CD1 3.93Å; L30-L122 HydrophobicContact CD2-CD2 4.02Å; L30-L122 HydrophobicContact CD2-CG 4.21Å; L30-L122 HydrophobicContact CG-CD1 3.68Å; L30-L122 HydrophobicContact CG-CD2 4.28Å; L30-L122 HydrophobicContact CG-CG 4.43Å
31	F	48.7	Very low	50.8	Low	145 Å²	145	67.6 Å²	67.6	64%	0.636	33%	0.327	S	S	*	.	H	α-helix	trans	-72.5	-37.8	-176.4	-171.4	-98.8	0	0	0	110.9	E28 M29 C35	E28-F31 PolarHBondContact O-N 2.98Å; M29-F31 PolarHBondContact O-N 3.07Å; F31-C35 VanDerWaalsContact O-CB 3.23Å; F31-C35 WeakPolarHBondContact O-CB 3.06Å; F31-C35 PolarHBondContact O-N 3.44Å; F31-C35 PolarHBondContact O-SG 3.39Å
32	V	54.7	Low	52.4	Low	66 Å²	66	68.7 Å²	68.7	40%	0.4	33%	0.332	S	S	.	.	H	α-helix	trans	-71	-42.4	175.1	175.6	0	0	0	0	111	E28 M29 C35 F36	E28-V32 HydrophobicContact CB-CG2 4.37Å; E28-V32 VanDerWaalsContact O-CB 3.29Å; E28-V32 WeakPolarHBondContact O-CB 3.45Å; E28-V32 VanDerWaalsContact O-CG2 3.24Å; E28-V32 WeakPolarHBondContact O-CG2 3.42Å; E28-V32 PolarHBondContact O-N 3.15Å; M29-V32 PolarHBondContact O-N 3.22Å; V32-C35 PolarHBondContact O-N 3.49Å; V32-F36 WeakPolarHBondContact O-CB 3.33Å; V32-F36 PolarHBondContact O-N 3.43Å
33	Q	52.1	Low	53.7	Low	5 Å²	5	68 Å²	68	2%	0.023	34%	0.335	C	S	.	.	H	α-helix	trans	-57.3	-52.9	172.1	-81.2	173	-49.1	0	0	110.5	M29 F36 I37 V472	M29-Q33 WeakPolarHBondContact O-CA 3.49Å; M29-Q33 WeakPolarHBondContact O-CB 3.27Å; M29-Q33 WeakPolarHBondContact O-CG 3.29Å; M29-Q33 PolarHBondContact O-N 2.7Å; M29-Q33 PolarHBondContact O-OE1 2.71Å; Q33-F36 PolarHBondContact O-N 3.01Å; Q33-I37 HydrophobicContact CB-CD1 4.28Å; Q33-I37 WeakPolarHBondContact O-CB 3.29Å; Q33-I37 WeakPolarHBondContact O-CD1 3.01Å; Q33-I37 WeakPolarHBondContact O-CG1 3.18Å; Q33-I37 PolarHBondContact O-N 3.35Å; Q33-V472 HydrophobicContact CB-CG1 4.37Å; Q33-V472 HydrophobicContact CG-CB 3.73Å; Q33-V472 HydrophobicContact CG-CG1 3.23Å; Q33-V472 HydrophobicContact CG-CG2 4.32Å
34	V	56.5	Low	54.5	Low	47 Å²	47	65 Å²	65	29%	0.285	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-47.8	179.8	173.4	0	0	0	0	110.9	L30 F36 C38 L118	L30-V34 WeakPolarHBondContact O-CB 3.47Å; L30-V34 WeakPolarHBondContact O-CG2 3.28Å; L30-V34 PolarHBondContact O-N 3.42Å; V34-F36 PolarHBondContact O-N 3.31Å; V34-C38 WeakPolarHBondContact O-CB 3.27Å; V34-C38 PolarHBondContact O-N 3.27Å; V34-C38 PolarHBondContact O-SG 3.08Å; V34-L118 HydrophobicContact CG1-CD1 4.32Å; V34-L118 HydrophobicContact CG2-CD1 4.11Å; V34-L118 HydrophobicContact CG2-CD2 4.04Å
35	C	58.8	Low	56	Low	61 Å²	61	62.2 Å²	62.2	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-39.7	178.9	-73.7	0	0	0	0	112.8	F31 V32 S39	F31-C35 VanDerWaalsContact O-CB 3.23Å; F31-C35 WeakPolarHBondContact O-CB 3.06Å; F31-C35 PolarHBondContact O-N 3.44Å; F31-C35 PolarHBondContact O-SG 3.39Å; V32-C35 PolarHBondContact O-N 3.49Å; C35-S39 VanDerWaalsContact O-CB 3.22Å; C35-S39 WeakPolarHBondContact O-CB 3.34Å; C35-S39 PolarHBondContact O-N 3.49Å
36	F	63	Low	56.7	Low	58 Å²	58	61.5 Å²	61.5	25%	0.254	31%	0.309	S	S	.	.	H	α-helix	trans	-69.4	-50	179	-174.2	-91.5	0	0	0	111	V32 Q33 V34 C38 S39 V40 F189 A468 V472	V32-F36 WeakPolarHBondContact O-CB 3.33Å; V32-F36 PolarHBondContact O-N 3.43Å; Q33-F36 PolarHBondContact O-N 3.01Å; V34-F36 PolarHBondContact O-N 3.31Å; F36-C38 PolarHBondContact O-N 2.91Å; F36-S39 WeakPolarHBondContact O-CB 3.5Å; F36-S39 PolarHBondContact O-N 3.44Å; F36-S39 VanDerWaalsContact O-N 3.12Å; F36-V40 HydrophobicContact CD1-CG2 4.08Å; F36-V40 HydrophobicContact CE1-CG2 3.63Å; F36-V40 HydrophobicContact CZ-CG2 3.99Å; F36-V40 WeakPolarHBondContact O-CG2 3.5Å; F36-V40 PolarHBondContact O-N 2.89Å; F36-F189 HydrophobicContact CD1-CE2 4.49Å; F36-F189 AromaticContact CE1-CE2 3.46Å; F36-F189 HydrophobicContact CE1-CE2 3.46Å; F36-F189 VanDerWaalsContact CE1-CE2 3.46Å; F36-F189 HydrophobicContact CE1-CZ 4Å; F36-F189 AromaticContact CZ-CE2 3.57Å; F36-F189 HydrophobicContact CZ-CE2 3.57Å; F36-F189 HydrophobicContact CZ-CZ 4.16Å; F36-A468 HydrophobicContact CD1-CB 4.42Å; F36-A468 HydrophobicContact CE1-CB 3.9Å; F36-V472 HydrophobicContact CD1-CG2 4.24Å
37	I	60.3	Low	57	Low	1 Å²	1	60.6 Å²	60.6	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-61.9	-44.5	178.1	-68.4	169	0	0	0	110.7	Q33 S39 V40 L41 L118 F121 F465	Q33-I37 HydrophobicContact CB-CD1 4.28Å; Q33-I37 WeakPolarHBondContact O-CB 3.29Å; Q33-I37 WeakPolarHBondContact O-CD1 3.01Å; Q33-I37 WeakPolarHBondContact O-CG1 3.18Å; Q33-I37 PolarHBondContact O-N 3.35Å; I37-S39 VanDerWaalsContact C-N 3.32Å; I37-S39 PolarHBondContact O-N 3.43Å; I37-V40 PolarHBondContact O-N 3.49Å; I37-L41 HydrophobicContact CG2-CD1 4.48Å; I37-L41 WeakPolarHBondContact O-CB 3.33Å; I37-L41 WeakPolarHBondContact O-CG 3.48Å; I37-L41 PolarHBondContact O-N 2.9Å; I37-L118 HydrophobicContact CB-CD2 4.28Å; I37-L118 HydrophobicContact CD1-CD2 3.91Å; I37-L118 HydrophobicContact CG2-CD2 4.01Å; I37-F121 HydrophobicContact CD1-CD2 4Å; I37-F121 HydrophobicContact CD1-CE2 4.2Å; I37-F465 HydrophobicContact CG2-CD2 3.77Å; I37-F465 HydrophobicContact CG2-CE2 3.08Å; I37-F465 HydrophobicContact CG2-CZ 3.7Å
38	C	57.1	Low	57.8	Low	55 Å²	55	54.9 Å²	54.9	37%	0.372	29%	0.288	S	S	.	.	H	α-helix	trans	-64.7	-34.9	174.7	-69.9	0	0	0	0	112.2	V34 F36 F42	V34-C38 WeakPolarHBondContact O-CB 3.27Å; V34-C38 PolarHBondContact O-N 3.27Å; V34-C38 PolarHBondContact O-SG 3.08Å; F36-C38 PolarHBondContact O-N 2.91Å; C38-F42 WeakPolarHBondContact O-CB 3.25Å; C38-F42 PolarHBondContact O-N 3.07Å
39	S	64.5	Low	58.3	Low	67 Å²	67	51.8 Å²	51.8	47%	0.469	28%	0.28	S	S	.	.	H	α-helix	trans	-67	-41.4	173.7	-173.6	0	0	0	0	111.5	C35 F36 I37 F42 V43	C35-S39 VanDerWaalsContact O-CB 3.22Å; C35-S39 WeakPolarHBondContact O-CB 3.34Å; C35-S39 PolarHBondContact O-N 3.49Å; F36-S39 WeakPolarHBondContact O-CB 3.5Å; F36-S39 PolarHBondContact O-N 3.44Å; F36-S39 VanDerWaalsContact O-N 3.12Å; I37-S39 VanDerWaalsContact C-N 3.32Å; I37-S39 PolarHBondContact O-N 3.43Å; S39-F42 PolarHBondContact O-N 3.28Å; S39-V43 WeakPolarHBondContact O-CB 3.43Å; S39-V43 VanDerWaalsContact O-CG2 3.23Å; S39-V43 WeakPolarHBondContact O-CG2 3.2Å; S39-V43 PolarHBondContact O-N 3.1Å
40	V	60.5	Low	58.8	Low	17 Å²	17	55.7 Å²	55.7	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-46.3	176.6	172.6	0	0	0	0	110.4	F36 I37 F42 V43 A44	F36-V40 HydrophobicContact CD1-CG2 4.08Å; F36-V40 HydrophobicContact CE1-CG2 3.63Å; F36-V40 HydrophobicContact CZ-CG2 3.99Å; F36-V40 WeakPolarHBondContact O-CG2 3.5Å; F36-V40 PolarHBondContact O-N 2.89Å; I37-V40 PolarHBondContact O-N 3.49Å; V40-F42 VanDerWaalsContact C-N 3.35Å; V40-F42 PolarHBondContact O-N 3.31Å; V40-V43 PolarHBondContact O-N 3.15Å; V40-A44 VanDerWaalsContact O-CB 3.31Å; V40-A44 WeakPolarHBondContact O-CB 3.44Å; V40-A44 PolarHBondContact O-N 3.49Å
41	L	59.1	Low	59	Low	24 Å²	24	55.2 Å²	55.2	13%	0.126	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-43.2	174.2	-79.4	-179.4	0	0	0	112.2	I37 V43 A44 W45 F465	I37-L41 HydrophobicContact CG2-CD1 4.48Å; I37-L41 WeakPolarHBondContact O-CB 3.33Å; I37-L41 WeakPolarHBondContact O-CG 3.48Å; I37-L41 PolarHBondContact O-N 2.9Å; L41-V43 VanDerWaalsContact C-N 3.33Å; L41-V43 PolarHBondContact O-N 3.46Å; L41-A44 PolarHBondContact O-N 2.97Å; L41-W45 WeakPolarHBondContact O-CB 3.49Å; L41-W45 PolarHBondContact O-N 2.95Å; L41-F465 HydrophobicContact CD1-CD2 3.99Å; L41-F465 HydrophobicContact CD1-CE2 3.45Å; L41-F465 VanDerWaalsContact CD1-CE2 3.45Å; L41-F465 HydrophobicContact CD1-CZ 4.46Å; L41-F465 HydrophobicContact CD2-CD2 3.34Å; L41-F465 HydrophobicContact CD2-CE2 3.7Å; L41-F465 HydrophobicContact CD2-CG 4.24Å; L41-F465 HydrophobicContact CG-CD2 3.51Å; L41-F465 HydrophobicContact CG-CE2 3.53Å
42	F	68.9	Low	59.4	Low	130 Å²	130	52.4 Å²	52.4	57%	0.57	29%	0.293	S	S	*	.	H	α-helix	trans	-64.8	-40.2	178.8	-178.6	-99.6	0	0	0	111.4	C38 S39 V40 S46	C38-F42 WeakPolarHBondContact O-CB 3.25Å; C38-F42 PolarHBondContact O-N 3.07Å; S39-F42 PolarHBondContact O-N 3.28Å; V40-F42 VanDerWaalsContact C-N 3.35Å; V40-F42 PolarHBondContact O-N 3.31Å; F42-S46 WeakPolarHBondContact O-CB 3.46Å; F42-S46 PolarHBondContact O-N 3Å; F42-S46 PolarHBondContact O-OG 3.48Å
43	V	67.8	Low	59.3	Low	78 Å²	78	57.8 Å²	57.8	47%	0.473	31%	0.311	S	S	.	.	H	α-helix	trans	-67.7	-46.4	175.4	170.9	0	0	0	0	110.8	S39 V40 L41 W45 S46 M47	S39-V43 WeakPolarHBondContact O-CB 3.43Å; S39-V43 VanDerWaalsContact O-CG2 3.23Å; S39-V43 WeakPolarHBondContact O-CG2 3.2Å; S39-V43 PolarHBondContact O-N 3.1Å; V40-V43 PolarHBondContact O-N 3.15Å; L41-V43 VanDerWaalsContact C-N 3.33Å; L41-V43 PolarHBondContact O-N 3.46Å; V43-W45 PolarHBondContact O-N 3.22Å; V43-S46 PolarHBondContact O-N 3.36Å; V43-M47 HydrophobicContact CG1-CG 4.26Å; V43-M47 VanDerWaalsContact O-CB 3.25Å; V43-M47 WeakPolarHBondContact O-CB 3.25Å; V43-M47 VanDerWaalsContact O-CG 3.23Å; V43-M47 WeakPolarHBondContact O-CG 3.08Å; V43-M47 PolarHBondContact O-N 3.26Å
44	A	56.3	Low	59.2	Low	9 Å²	9	62 Å²	62	7%	0.074	34%	0.337	C	S	.	.	H	α-helix	trans	-61.4	-44.5	177.8	0	0	0	0	0	111.5	V40 L41 M47 S48	V40-A44 VanDerWaalsContact O-CB 3.31Å; V40-A44 WeakPolarHBondContact O-CB 3.44Å; V40-A44 PolarHBondContact O-N 3.49Å; L41-A44 PolarHBondContact O-N 2.97Å; A44-M47 PolarHBondContact O-N 3.1Å; A44-S48 WeakPolarHBondContact O-CB 3.15Å; A44-S48 PolarHBondContact O-N 3.45Å
45	W	65.6	Low	58.4	Low	136 Å²	136	62.3 Å²	62.3	52%	0.515	35%	0.35	S	S	.	.	H	α-helix	trans	-66.5	-43.3	175.6	-177.4	77.1	0	0	0	112.1	L41 V43 M47 S48 A49	L41-W45 WeakPolarHBondContact O-CB 3.49Å; L41-W45 PolarHBondContact O-N 2.95Å; V43-W45 PolarHBondContact O-N 3.22Å; W45-M47 VanDerWaalsContact C-N 3.35Å; W45-M47 PolarHBondContact O-N 3.15Å; W45-S48 PolarHBondContact O-N 3.19Å; W45-A49 WeakPolarHBondContact O-CB 3.45Å; W45-A49 PolarHBondContact O-N 3.28Å
46	S	60.1	Low	57.3	Low	41 Å²	41	67.9 Å²	67.9	29%	0.287	37%	0.369	S	S	.	.	H	α-helix	trans	-64.8	-40.9	177.5	-62.2	0	0	0	0	111.5	F42 V43 L50	F42-S46 WeakPolarHBondContact O-CB 3.46Å; F42-S46 PolarHBondContact O-N 3Å; F42-S46 PolarHBondContact O-OG 3.48Å; V43-S46 PolarHBondContact O-N 3.36Å; S46-L50 WeakPolarHBondContact O-CB 3.34Å; S46-L50 PolarHBondContact O-N 2.74Å
47	M	57.4	Low	56	Low	47 Å²	47	68 Å²	68	23%	0.232	39%	0.386	C	S	.	.	H	α-helix	trans	-67.4	-44.9	175.6	-75.6	-64.2	-65.3	0	0	111.2	V43 A44 W45 L50 L51	V43-M47 HydrophobicContact CG1-CG 4.26Å; V43-M47 VanDerWaalsContact O-CB 3.25Å; V43-M47 WeakPolarHBondContact O-CB 3.25Å; V43-M47 VanDerWaalsContact O-CG 3.23Å; V43-M47 WeakPolarHBondContact O-CG 3.08Å; V43-M47 PolarHBondContact O-N 3.26Å; A44-M47 PolarHBondContact O-N 3.1Å; W45-M47 VanDerWaalsContact C-N 3.35Å; W45-M47 PolarHBondContact O-N 3.15Å; M47-L50 PolarHBondContact O-N 3.11Å; M47-L51 HydrophobicContact CE-CD1 4.47Å; M47-L51 VanDerWaalsContact O-CB 3.24Å; M47-L51 WeakPolarHBondContact O-CB 3.33Å; M47-L51 WeakPolarHBondContact O-CD1 3.48Å; M47-L51 WeakPolarHBondContact O-CG 3.43Å; M47-L51 PolarHBondContact O-N 2.85Å
48	S	56.4	Low	54.7	Low	10 Å²	10	75.3 Å²	75.3	7%	0.07	42%	0.423	C	S	.	.	H	α-helix	trans	-60.2	-51.9	175.3	-176.1	0	0	0	0	110.5	A44 W45 L50 L51 T52 Y579	A44-S48 WeakPolarHBondContact O-CB 3.15Å; A44-S48 PolarHBondContact O-N 3.45Å; W45-S48 PolarHBondContact O-N 3.19Å; S48-L50 VanDerWaalsContact C-N 3.31Å; S48-L50 PolarHBondContact O-N 3.39Å; S48-L51 CarbonylContact O-C 3.42Å; S48-L51 PolarHBondContact O-N 3.37Å; S48-L51 VanDerWaalsContact O-N 3.07Å; S48-T52 PolarHBondContact O-N 3.18Å; S48-T52 PolarHBondContact O-OG1 3.48Å; S48-Y579 PolarHBondContact OG-OH 3.19Å
49	A	60.3	Low	53.6	Low	33 Å²	33	80.1 Å²	80.1	27%	0.273	44%	0.443	S	S	.	.	H	α-helix	trans	-62.4	-34.4	177.6	0	0	0	0	0	113.5	W45 K53	W45-A49 WeakPolarHBondContact O-CB 3.45Å; W45-A49 PolarHBondContact O-N 3.28Å; A49-K53 WeakPolarHBondContact O-CB 3.36Å; A49-K53 WeakPolarHBondContact O-CG 3.47Å; A49-K53 PolarHBondContact O-N 2.89Å; A49-K53 VanDerWaalsContact O-N 3.12Å
50	L	57.8	Low	51.9	Low	103 Å²	103	83.2 Å²	83.2	54%	0.539	46%	0.459	S	S	.	.	H	α-helix	trans	-67.3	-45.2	173	-174.5	67.1	0	0	0	110.4	S46 M47 S48 K53 T54	S46-L50 WeakPolarHBondContact O-CB 3.34Å; S46-L50 PolarHBondContact O-N 2.74Å; M47-L50 PolarHBondContact O-N 3.11Å; S48-L50 VanDerWaalsContact C-N 3.31Å; S48-L50 PolarHBondContact O-N 3.39Å; L50-K53 PolarHBondContact O-N 3.1Å; L50-T54 WeakPolarHBondContact O-CG2 3.17Å; L50-T54 PolarHBondContact O-N 2.93Å; L50-T54 PolarHBondContact O-OG1 2.87Å
51	L	53.7	Low	50.4	Low	26 Å²	26	91.2 Å²	91.2	14%	0.136	50%	0.495	C	S	.	.	H	α-helix	trans	-68.2	-36.9	178.8	-74.3	163.9	0	0	0	112.5	M47 S48 K53 T54 G55 I575 L576 Y579 V581	M47-L51 HydrophobicContact CE-CD1 4.47Å; M47-L51 VanDerWaalsContact O-CB 3.24Å; M47-L51 WeakPolarHBondContact O-CB 3.33Å; M47-L51 WeakPolarHBondContact O-CD1 3.48Å; M47-L51 WeakPolarHBondContact O-CG 3.43Å; M47-L51 PolarHBondContact O-N 2.85Å; S48-L51 CarbonylContact O-C 3.42Å; S48-L51 PolarHBondContact O-N 3.37Å; S48-L51 VanDerWaalsContact O-N 3.07Å; L51-K53 VanDerWaalsContact C-N 3.34Å; L51-T54 WeakPolarHBondContact CA-OG1 3.45Å; L51-T54 PolarHBondContact O-N 3.41Å; L51-T54 PolarHBondContact O-OG1 3.14Å; L51-G55 VanDerWaalsContact O-CA 3.3Å; L51-G55 WeakPolarHBondContact O-CA 3.39Å; L51-G55 PolarHBondContact O-N 3.09Å; L51-I575 HydrophobicContact CD1-CG2 4.4Å; L51-L576 HydrophobicContact CD1-CD2 3.79Å; L51-L576 HydrophobicContact CD2-CD2 3.57Å; L51-L576 HydrophobicContact CG-CD2 4.3Å; L51-Y579 HydrophobicContact CD1-CD2 4.28Å; L51-V581 HydrophobicContact CD2-CG2 3.97Å
52	T	55.7	Low	49	Very low	86 Å²	86	93.2 Å²	93.2	53%	0.528	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-36	173.2	-38.6	0	0	0	0	111.1	S48	S48-T52 PolarHBondContact O-N 3.18Å; S48-T52 PolarHBondContact O-OG1 3.48Å
53	K	54.2	Low	46.9	Very low	180 Å²	180	95.5 Å²	95.5	78%	0.783	53%	0.534	S	S	*	.	H	α-helix	trans	-71.8	-35.2	174.9	-82.6	-175	177.5	-178.2	0	113.2	A49 L50 L51	A49-K53 WeakPolarHBondContact O-CB 3.36Å; A49-K53 WeakPolarHBondContact O-CG 3.47Å; A49-K53 PolarHBondContact O-N 2.89Å; A49-K53 VanDerWaalsContact O-N 3.12Å; L50-K53 PolarHBondContact O-N 3.1Å; L51-K53 VanDerWaalsContact C-N 3.34Å
54	T	49.1	Very low	45.3	Very low	94 Å²	94	97.2 Å²	97.2	58%	0.577	55%	0.546	S	S	*	.	H	α-helix	trans	-85	-20	176.1	55.6	0	0	0	0	113.1	L50 L51	L50-T54 WeakPolarHBondContact O-CG2 3.17Å; L50-T54 PolarHBondContact O-N 2.93Å; L50-T54 PolarHBondContact O-OG1 2.87Å; L51-T54 WeakPolarHBondContact CA-OG1 3.45Å; L51-T54 PolarHBondContact O-N 3.41Å; L51-T54 PolarHBondContact O-OG1 3.14Å
55	G	39.9	Very low	44.1	Very low	53 Å²	53	104 Å²	104	55%	0.546	58%	0.581	S	S	.	*	S	Bend	trans	-81.1	-5.9	-177.6	0	0	0	0	0	115.1	L51 G57	L51-G55 VanDerWaalsContact O-CA 3.3Å; L51-G55 WeakPolarHBondContact O-CA 3.39Å; L51-G55 PolarHBondContact O-N 3.09Å; G55-G57 PolarHBondContact O-N 3.35Å
56	H	36.5	Very low	42.3	Very low	177 Å²	177	105.5 Å²	105.5	82%	0.819	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	15.4	167.3	-100.4	65.3	0	0	0	113.8
57	G	35.5	Very low	41	Very low	60 Å²	60	112.3 Å²	112.3	62%	0.619	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	9.7	-171	0	0	0	0	0	116.9	G55	G55-G57 PolarHBondContact O-N 3.35Å
58	M	33.3	Very low	39.6	Very low	156 Å²	156	119.5 Å²	119.5	77%	0.768	66%	0.659	S	S	*	*			trans	-133.4	68	170.9	-65.1	-152.6	-47.3	0	0	111.5	V60	M58-V60 PolarHBondContact O-N 2.97Å
59	I	32.1	Very low	38.4	Very low	155 Å²	155	131.4 Å²	131.4	80%	0.795	70%	0.702	S	S	*	*			trans	-70.3	113.1	153	-64.8	174	0	0	0	105.7	E61	I59-E61 PolarHBondContact O-N 3.36Å; I59-E61 VanDerWaalsContact O-N 3.11Å
60	V	30.6	Very low	37	Very low	132 Å²	132	133 Å²	133	80%	0.8	72%	0.721	S	S	*	*			trans	-62.4	108.6	162.3	172.1	0	0	0	0	106.3	M58 G62	M58-V60 PolarHBondContact O-N 2.97Å; V60-G62 PolarHBondContact O-N 2.97Å
61	E	28.2	Very low	35.8	Very low	185 Å²	185	139.3 Å²	139.3	86%	0.864	74%	0.738	S	S	*	*			trans	-59.2	101.3	166.2	-77.7	-168.5	153.3	0	0	108.2	I59 H63	I59-E61 PolarHBondContact O-N 3.36Å; I59-E61 VanDerWaalsContact O-N 3.11Å; E61-H63 PolarHBondContact O-N 2.92Å
62	G	28.8	Very low	35.3	Very low	67 Å²	67	150 Å²	150	69%	0.691	78%	0.777	S	S	*	*			trans	-66.2	125.7	159.8	0	0	0	0	0	108.7	V60	V60-G62 PolarHBondContact O-N 2.97Å
63	H	26.6	Very low	34.2	Very low	178 Å²	178	153.7 Å²	153.7	82%	0.824	79%	0.792	S	S	*	*			trans	-48.4	140.2	176.2	-98.4	-34.9	0	0	0	112.9	E61 D65	E61-H63 PolarHBondContact O-N 2.92Å; H63-D65 PolarHBondContact O-N 3.25Å
64	P	32.4	Very low	33.6	Very low	113 Å²	113	154.6 Å²	154.6	73%	0.734	80%	0.801	S	S	*	*			trans	-90.6	101.3	177.7	34.3	-27	0	0	0	110
65	D	31.1	Very low	32.8	Very low	151 Å²	151	154.8 Å²	154.8	81%	0.807	81%	0.813	S	S	*	*			trans	-110.7	100.8	167.6	-81.4	-34.3	0	0	0	111.5	H63	H63-D65 PolarHBondContact O-N 3.25Å
66	L	28.5	Very low	32.2	Very low	169 Å²	169	157.6 Å²	157.6	89%	0.885	82%	0.824	S	S	*	*			trans	64.1	125.8	136	-131.6	75	0	0	0	121.1
67	E	34	Very low	32.3	Very low	184 Å²	184	159 Å²	159	86%	0.86	82%	0.822	S	S	*	*			trans	-48	139.3	173.8	-58.7	-174	135.9	0	0	115.3
68	H	27.1	Very low	31.9	Very low	197 Å²	197	161.2 Å²	161.2	91%	0.912	83%	0.828	S	S	*	*			trans	-144.9	112.3	132.3	-128.6	-37.9	0	0	0	112.4
69	W	31.3	Very low	32.3	Very low	261 Å²	261	160.4 Å²	160.4	99%	0.989	82%	0.822	S	S	*	*			trans	-65.3	124.2	173.3	-154.8	44.1	0	0	0	110.8
70	G	30.3	Very low	32.7	Very low	65 Å²	65	160.2 Å²	160.2	67%	0.67	82%	0.823	S	S	*	*			trans	177.3	85.1	176.3	0	0	0	0	0	117.9
71	R	33.5	Very low	32.9	Very low	237 Å²	237	161.4 Å²	161.4	89%	0.894	83%	0.825	S	S	*	*			trans	51.5	109.2	147	-70.1	-177.9	-86.8	-120.3	-0.8	120.2	L73	R71-L73 PolarHBondContact O-N 2.95Å
72	R	42.5	Very low	33.6	Very low	251 Å²	251	159.6 Å²	159.6	95%	0.947	83%	0.826	S	S	*	*			trans	-42.3	128.4	149.2	-83.3	174.5	167.6	173.1	-4.5	111.9
73	L	32.4	Very low	34.3	Very low	163 Å²	163	164.5 Å²	164.5	85%	0.853	83%	0.831	S	S	*	*			trans	-144.5	133.2	154.4	-99.9	158.8	0	0	0	108.5	R71 A75	R71-L73 PolarHBondContact O-N 2.95Å; L73-A75 PolarHBondContact O-N 3.44Å
74	M	42.7	Very low	35.2	Very low	198 Å²	198	161.2 Å²	161.2	98%	0.975	83%	0.826	S	S	*	*			trans	-54.2	122.1	179.9	-65.2	-148	-132.5	0	0	111.3
75	A	31.1	Very low	36.3	Very low	98 Å²	98	162.2 Å²	162.2	81%	0.81	82%	0.819	S	S	*	*			trans	-116.8	120.6	161.8	0	0	0	0	0	108.2	L73	L73-A75 PolarHBondContact O-N 3.44Å
76	S	27.6	Very low	38.3	Very low	112 Å²	112	161.4 Å²	161.4	78%	0.783	81%	0.814	S	S	*	*			trans	-48.3	136.1	173.8	177.5	0	0	0	0	111.4	S78	S76-S78 PolarHBondContact O-N 3.04Å; S76-S78 VanDerWaalsContact O-N 3.16Å
77	R	38.4	Very low	40.5	Very low	208 Å²	208	155.3 Å²	155.3	79%	0.785	79%	0.786	S	S	*	*			trans	-50.6	114.7	165.6	-175.7	168.2	176.2	151.6	-2.5	109.6	E79	R77-E79 IonicContact CZ-OE1 3.99Å; R77-E79 IonicContact NE-OE1 3.68Å; R77-E79 IonicContact NH2-OE1 3.36Å; R77-E79 PolarHBondContact NH2-OE1 3.27Å
78	S	27.3	Very low	42.3	Very low	105 Å²	105	149 Å²	149	73%	0.734	76%	0.762	S	S	*	*			trans	-117.3	107.9	156.8	55.3	0	0	0	0	106.9	S76	S76-S78 PolarHBondContact O-N 3.04Å; S76-S78 VanDerWaalsContact O-N 3.16Å
79	E	41.2	Very low	44.7	Very low	140 Å²	140	146 Å²	146	65%	0.654	75%	0.748	S	S	*	*			trans	-55.4	135.2	161.5	-76.5	163.4	176.5	0	0	108.5	R77	R77-E79 IonicContact CZ-OE1 3.99Å; R77-E79 IonicContact NE-OE1 3.68Å; R77-E79 IonicContact NH2-OE1 3.36Å; R77-E79 PolarHBondContact NH2-OE1 3.27Å
80	N	41.8	Very low	46.8	Very low	150 Å²	150	133.8 Å²	133.8	80%	0.802	70%	0.703	S	S	*	*			trans	109.1	75.4	-179.7	-59.9	-19	0	0	0	113.7
81	D	33.8	Very low	49.1	Very low	158 Å²	158	131 Å²	131	85%	0.845	67%	0.673	S	S	*	*			trans	-150.3	121.6	137	-91.7	-36.5	0	0	0	107.9	E83	D81-E83 VanDerWaalsContact C-N 3.34Å; D81-E83 PolarHBondContact O-N 3.11Å
82	T	44.3	Very low	51.3	Low	146 Å²	146	120.7 Å²	120.7	90%	0.896	64%	0.636	S	S	*	*			trans	-60.9	89.9	171.2	23.1	0	0	0	0	109.7
83	E	42	Very low	53	Low	170 Å²	170	113.2 Å²	113.2	79%	0.794	61%	0.611	S	S	*	*			trans	-67.7	137.5	152.3	-70.9	-156.5	156.2	0	0	108.3	D81 K85	D81-E83 VanDerWaalsContact C-N 3.34Å; D81-E83 PolarHBondContact O-N 3.11Å; E83-K85 PolarHBondContact O-N 3.1Å
84	P	45.7	Very low	55.4	Low	110 Å²	110	109.6 Å²	109.6	71%	0.714	59%	0.59	S	S	*	*			trans	-62.3	110.2	171.3	26.7	-31	0	0	0	107.5	N86	P84-N86 PolarHBondContact O-N 2.65Å; P84-N86 VanDerWaalsContact O-N 3.1Å
85	K	55	Low	57.4	Low	134 Å²	134	100.6 Å²	100.6	58%	0.583	55%	0.545	S	S	*	.			trans	-56.7	119.2	172.2	-75	178.3	175.3	174.6	0	107.5	E83 C87 E89	E83-K85 PolarHBondContact O-N 3.1Å; K85-C87 PolarHBondContact O-N 3.27Å; K85-E89 IonicContact NZ-OE1 2.58Å; K85-E89 PolarHBondContact NZ-OE1 3.22Å
86	N	74.5	Confident	60	Low	133 Å²	133	99 Å²	99	71%	0.711	53%	0.527	S	S	*	.	S	Bend	trans	-73.5	15.3	176.3	-76.3	-29.6	0	0	0	113	P84 L587	P84-N86 PolarHBondContact O-N 2.65Å; P84-N86 VanDerWaalsContact O-N 3.1Å; N86-L587 WeakPolarHBondContact O-CD2 3.4Å
87	C	73.3	Confident	62.5	Low	42 Å²	42	101.1 Å²	101.1	28%	0.284	53%	0.529	S	S	.	.	S	Bend	trans	-144.8	148.3	-179.3	64.2	0	0	0	0	110.9	K85 P588 C590	K85-C87 PolarHBondContact O-N 3.27Å; C87-P588 CarbonylContact C-O 3.53Å; C87-P588 WeakPolarHBondContact CA-O 3.25Å; C87-P588 WeakPolarHBondContact CB-O 3.15Å; C87-C590 HydrophobicContact CB-CB 3.98Å; C87-C590 WeakPolarHBondContact CB-SG 3.28Å; C87-C590 WeakPolarHBondContact SG-CB 3.37Å; C87-C590 CovalentContact SG-SG 2.03Å; C87-C590 PolarHBondContact SG-SG 2.95Å
88	S	73.2	Confident	64.6	Low	52 Å²	52	92.9 Å²	92.9	36%	0.364	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-84.8	137.2	174.6	-62	0	0	0	0	110.2	P588 C590	S88-P588 PolarHBondContact N-O 3.06Å; S88-C590 PolarHBondContact O-N 3.46Å; S88-C590 PolarHBondContact O-SG 3.11Å; S88-C590 VanDerWaalsContact O-SG 3.4Å
89	E	76.7	Confident	67.1	Low	132 Å²	132	95.2 Å²	95.2	62%	0.617	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-68.1	135.6	175.2	-64.8	-174.5	171.3	0	0	110.1	K85	K85-E89 IonicContact NZ-OE1 2.58Å; K85-E89 PolarHBondContact NZ-OE1 3.22Å
90	P	75.8	Confident	69.1	Low	6 Å²	6	91.5 Å²	91.5	4%	0.039	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-75.5	141.4	-178.8	29.6	-33.2	0	0	0	111.3	I92 H93 Y452 M589	P90-I92 HydrophobicContact CB-CG2 3.94Å; P90-I92 HydrophobicContact CG-CG2 3.91Å; P90-I92 PolarHBondContact O-N 2.85Å; P90-H93 PolarHBondContact O-N 3.28Å; P90-Y452 HydrophobicContact CB-CD2 3.62Å; P90-Y452 HydrophobicContact CB-CE2 3.83Å; P90-Y452 HydrophobicContact CG-CD2 4.02Å; P90-Y452 HydrophobicContact CG-CE2 3.69Å; P90-M589 HydrophobicContact CB-CE 4.41Å; P90-M589 HydrophobicContact CB-CG 3.82Å; P90-M589 HydrophobicContact CB-SD 3.82Å
91	A	77.7	Confident	71	Confident	7 Å²	7	88.1 Å²	88.1	6%	0.058	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-64.4	-9.1	-179.7	0	0	0	0	0	114	H93 E94 F95 T448 D458	A91-H93 VanDerWaalsContact C-N 3.27Å; A91-H93 PolarHBondContact O-N 3.42Å; A91-E94 PolarHBondContact O-N 2.87Å; A91-F95 WeakPolarHBondContact O-CD2 3.2Å; A91-T448 HydrophobicContact CB-CG2 4.4Å; A91-D458 VanDerWaalsContact CB-OD2 3.27Å; A91-D458 WeakPolarHBondContact CB-OD2 3.46Å; A91-D458 PolarHBondContact N-OD2 3.47Å
92	I	81.1	Confident	73.1	Confident	19 Å²	19	81.9 Å²	81.9	10%	0.097	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-61.8	-32.3	179.7	-164.9	171.8	0	0	0	113.1	P90 E94 F95 I449 Y452	P90-I92 HydrophobicContact CB-CG2 3.94Å; P90-I92 HydrophobicContact CG-CG2 3.91Å; P90-I92 PolarHBondContact O-N 2.85Å; I92-E94 PolarHBondContact O-N 3.04Å; I92-F95 PolarHBondContact O-N 3.33Å; I92-I449 HydrophobicContact CD1-CB 4.42Å; I92-I449 HydrophobicContact CD1-CG1 3.98Å; I92-I449 HydrophobicContact CD1-CG2 4.49Å; I92-I449 HydrophobicContact CG1-CG1 4.17Å; I92-Y452 HydrophobicContact CB-CG 4.49Å; I92-Y452 HydrophobicContact CD1-CD1 3.65Å; I92-Y452 HydrophobicContact CD1-CE1 4.36Å; I92-Y452 HydrophobicContact CD1-CG 4.06Å; I92-Y452 HydrophobicContact CG2-CD1 4.28Å; I92-Y452 HydrophobicContact CG2-CD2 4.18Å; I92-Y452 HydrophobicContact CG2-CE1 4.48Å; I92-Y452 HydrophobicContact CG2-CE2 4.44Å; I92-Y452 HydrophobicContact CG2-CG 4.12Å
93	H	78.3	Confident	74.7	Confident	95 Å²	95	80 Å²	80	44%	0.44	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-74.6	-13.5	180	-61.4	-67.1	0	0	0	113.3	P90 A91 F95 E592	P90-H93 PolarHBondContact O-N 3.28Å; A91-H93 VanDerWaalsContact C-N 3.27Å; A91-H93 PolarHBondContact O-N 3.42Å; H93-F95 VanDerWaalsContact C-N 3.27Å; H93-E592 IonicContact CE1-OE1 3.43Å; H93-E592 PolarHBondContact CE1-OE1 3.49Å; H93-E592 IonicContact CE1-OE2 3.43Å; H93-E592 PolarHBondContact CE1-OE2 3.45Å; H93-E592 IonicContact NE2-OE1 3.62Å; H93-E592 IonicContact NE2-OE2 3.97Å
94	E	82.2	Confident	76.6	Confident	86 Å²	86	76.3 Å²	76.3	40%	0.402	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-82	-12.8	174.6	-55.7	-166.3	-158.5	0	0	111.8	A91 I92 I173 T174 H175	A91-E94 PolarHBondContact O-N 2.87Å; I92-E94 PolarHBondContact O-N 3.04Å; E94-I173 WeakPolarHBondContact CB-O 3.37Å; E94-T174 VanDerWaalsContact CD-C 3.47Å; E94-T174 WeakPolarHBondContact OE2-CA 3.28Å; E94-H175 IonicContact OE2-CD2 2.82Å; E94-H175 IonicContact OE2-CG 2.6Å; E94-H175 PolarHBondContact OE2-N 2.76Å
95	F	85.3	Confident	78.4	Confident	9 Å²	9	72 Å²	72	4%	0.039	38%	0.375	C	S	.	.	S	Bend	trans	-99.7	161.9	172.7	-68.5	-76.4	0	0	0	112.2	A91 I92 H93 I169 I173 T174 Y441 V444 W445 T448	A91-F95 WeakPolarHBondContact O-CD2 3.2Å; I92-F95 PolarHBondContact O-N 3.33Å; H93-F95 VanDerWaalsContact C-N 3.27Å; F95-I169 HydrophobicContact CZ-CG2 4.46Å; F95-I173 HydrophobicContact CD1-CG2 4.38Å; F95-I173 HydrophobicContact CE1-CG2 3.93Å; F95-I173 HydrophobicContact CZ-CG2 4.29Å; F95-T174 HydrophobicContact CD2-CG2 4.38Å; F95-T174 HydrophobicContact CE1-CG2 4.37Å; F95-T174 HydrophobicContact CE2-CG2 3.29Å; F95-T174 HydrophobicContact CZ-CG2 3.27Å; F95-Y441 AromaticContact CD1-CE2 3.77Å; F95-Y441 HydrophobicContact CD1-CE2 3.77Å; F95-Y441 AromaticContact CD1-CZ 3.9Å; F95-Y441 HydrophobicContact CE1-CD2 4.02Å; F95-Y441 AromaticContact CE1-CE2 3.54Å; F95-Y441 HydrophobicContact CE1-CE2 3.54Å; F95-V444 HydrophobicContact CE2-CG1 4.43Å; F95-V444 HydrophobicContact CZ-CB 4.4Å; F95-V444 HydrophobicContact CZ-CG1 3.84Å; F95-W445 HydrophobicContact CB-CD2 4.4Å; F95-W445 HydrophobicContact CB-CG 3.96Å; F95-W445 VanDerWaalsContact CB-NE1 3.33Å; F95-W445 HydrophobicContact CD1-CB 3.64Å; F95-W445 AromaticContact CD1-CD1 3.75Å; F95-W445 HydrophobicContact CD1-CD2 4.37Å; F95-W445 AromaticContact CD1-CG 3.65Å; F95-W445 HydrophobicContact CD1-CG 3.65Å; F95-W445 AromaticContact CD2-CD1 3.89Å; F95-W445 HydrophobicContact CD2-CG 4.46Å; F95-W445 HydrophobicContact CE1-CB 3.73Å; F95-W445 HydrophobicContact CE1-CG 4.26Å; F95-W445 HydrophobicContact CG-CB 4.09Å; F95-W445 AromaticContact CG-CD1 3.36Å; F95-W445 AromaticContact CG-CG 3.78Å; F95-W445 HydrophobicContact CG-CG 3.78Å; F95-W445 AromaticContact CG-NE1 3.98Å; F95-W445 HydrophobicContact CZ-CB 4.23Å; F95-T448 HydrophobicContact CE2-CG2 4.06Å; F95-T448 WeakPolarHBondContact CE2-OG1 3.37Å
96	P	85.3	Confident	79.5	Confident	66 Å²	66	71.6 Å²	71.6	43%	0.429	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-56.9	148.1	173.5	-22	32.4	0	0	0	112.2	D98 Y441 W445	P96-D98 PolarHBondContact O-N 3.24Å; P96-Y441 VanDerWaalsContact CD-OH 3.3Å; P96-Y441 WeakPolarHBondContact CD-OH 3.36Å; P96-W445 HydrophobicContact CB-CH2 4.05Å; P96-W445 HydrophobicContact CB-CZ2 3.89Å; P96-W445 HydrophobicContact CG-CH2 4.22Å; P96-W445 HydrophobicContact CG-CZ2 4.24Å; P96-W445 VanDerWaalsContact O-CZ2 3.23Å; P96-W445 WeakPolarHBondContact O-CZ2 3.3Å; P96-W445 PolarHBondContact O-NE1 3.26Å
97	D	80.4	Confident	79.8	Confident	155 Å²	155	70.2 Å²	70.2	83%	0.829	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-56.9	126.1	175.4	-65.2	-41.8	0	0	0	110.6
98	D	81.9	Confident	80.2	Confident	35 Å²	35	69.9 Å²	69.9	19%	0.187	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-76.5	154.5	176.3	161.6	62	0	0	0	111.6	P96 F100 R105 H113 I449	P96-D98 PolarHBondContact O-N 3.24Å; D98-F100 PolarHBondContact O-N 2.88Å; D98-F100 PolarHBondContact OD2-N 3.08Å; D98-R105 VanDerWaalsContact CB-NH2 3.25Å; D98-R105 IonicContact OD2-CZ 3.95Å; D98-R105 IonicContact OD2-NE 3.14Å; D98-R105 PolarHBondContact OD2-NE 3.47Å; D98-R105 IonicContact OD2-NH2 3.62Å; D98-R105 PolarHBondContact OD2-NH2 3.35Å; D98-H113 IonicContact OD1-CE1 3.95Å; D98-H113 IonicContact OD1-NE2 3.5Å; D98-H113 PolarHBondContact OD1-NE2 3.34Å; D98-H113 IonicContact OD2-CE1 3.99Å; D98-H113 PolarHBondContact OD2-CE1 3.44Å; D98-H113 IonicContact OD2-NE2 2.84Å; D98-H113 PolarHBondContact OD2-NE2 2.85Å; D98-I449 HydrophobicContact CB-CD1 3.88Å
99	L	79.4	Confident	80.7	Confident	155 Å²	155	68 Å²	68	81%	0.812	37%	0.365	S	S	*	.	S	Bend	trans	-65	-24.4	-173	-153.4	89.7	0	0	0	112.8
100	F	83.1	Confident	81.1	Confident	62 Å²	62	62.6 Å²	62.6	27%	0.272	34%	0.341	S	S	.	.	S	Bend	trans	-104.9	143	-177.3	-58.9	-77	0	0	0	111.4	D98 E104 R105 A109 L112 H113	D98-F100 PolarHBondContact O-N 2.88Å; D98-F100 PolarHBondContact OD2-N 3.08Å; F100-E104 WeakPolarHBondContact CA-OE2 3.32Å; F100-E104 HydrophobicContact CB-CB 4.21Å; F100-E104 HydrophobicContact CD1-CB 4.49Å; F100-R105 HydrophobicContact CB-CG 3.99Å; F100-R105 PolarHBondContact O-NE 3.31Å; F100-R105 PolarHBondContact O-NH2 2.82Å; F100-A109 HydrophobicContact CB-CB 4.37Å; F100-A109 HydrophobicContact CD1-CB 4.02Å; F100-A109 HydrophobicContact CD2-CB 4.3Å; F100-A109 HydrophobicContact CE1-CB 4.37Å; F100-A109 HydrophobicContact CG-CB 3.96Å; F100-L112 HydrophobicContact CE2-CD1 4.23Å; F100-L112 HydrophobicContact CZ-CD1 3.88Å; F100-H113 AromaticContact CD2-CE1 3.85Å
101	T	81.7	Confident	81.6	Confident	78 Å²	78	68.3 Å²	68.3	48%	0.479	37%	0.37	S	S	.	.			trans	-74.6	164	173	65.2	0	0	0	0	111.7	D103 E104 R105	T101-D103 VanDerWaalsContact C-N 3.26Å; T101-D103 PolarHBondContact O-N 3.33Å; T101-E104 PolarHBondContact N-OE2 3.34Å; T101-E104 VanDerWaalsContact N-OE2 3.12Å; T101-E104 PolarHBondContact O-N 2.81Å; T101-E104 VanDerWaalsContact O-N 3.13Å; T101-E104 WeakPolarHBondContact OG1-CG 3.46Å; T101-E104 PolarHBondContact OG1-N 3.29Å; T101-R105 WeakPolarHBondContact O-CG 3.37Å; T101-R105 PolarHBondContact O-N 2.84Å
102	N	78.8	Confident	82.1	Confident	28 Å²	28	73 Å²	73	15%	0.15	39%	0.394	C	S	.	.	H	α-helix	trans	-56.7	-40.9	179.2	-164.3	-36.6	0	0	0	111.9	R105 K106 Y452	N102-R105 WeakPolarHBondContact O-CB 3.46Å; N102-R105 PolarHBondContact O-N 3.44Å; N102-K106 WeakPolarHBondContact O-CG 3.46Å; N102-K106 PolarHBondContact O-N 2.92Å; N102-K106 WeakPolarHBondContact OD1-CE 3.39Å; N102-K106 PolarHBondContact OD1-NZ 3.49Å; N102-Y452 VanDerWaalsContact ND2-CE1 3.31Å; N102-Y452 WeakPolarHBondContact ND2-CE1 3.5Å
103	D	77.6	Confident	82.4	Confident	107 Å²	107	72.3 Å²	72.3	57%	0.572	39%	0.39	S	S	*	.	H	α-helix	trans	-64.2	-42.1	176.5	-70.4	-28.9	0	0	0	112.6	T101 R105 K106 S107	T101-D103 VanDerWaalsContact C-N 3.26Å; T101-D103 PolarHBondContact O-N 3.33Å; D103-R105 VanDerWaalsContact C-N 3.33Å; D103-R105 PolarHBondContact O-N 3.05Å; D103-K106 PolarHBondContact O-N 3.48Å; D103-S107 WeakPolarHBondContact O-CB 3.42Å; D103-S107 PolarHBondContact O-N 3.47Å
104	E	82.5	Confident	82.9	Confident	91 Å²	91	69.4 Å²	69.4	43%	0.425	38%	0.377	S	S	.	.	H	α-helix	trans	-65.7	-38.3	176.6	-72.2	175.9	156.9	0	0	111.5	F100 T101 S107 G108 A109	F100-E104 WeakPolarHBondContact CA-OE2 3.32Å; F100-E104 HydrophobicContact CB-CB 4.21Å; F100-E104 HydrophobicContact CD1-CB 4.49Å; T101-E104 PolarHBondContact N-OE2 3.34Å; T101-E104 VanDerWaalsContact N-OE2 3.12Å; T101-E104 PolarHBondContact O-N 2.81Å; T101-E104 VanDerWaalsContact O-N 3.13Å; T101-E104 WeakPolarHBondContact OG1-CG 3.46Å; T101-E104 PolarHBondContact OG1-N 3.29Å; E104-S107 WeakPolarHBondContact CA-OG 3.49Å; E104-S107 PolarHBondContact O-N 3.4Å; E104-S107 PolarHBondContact O-OG 3.2Å; E104-G108 PolarHBondContact O-N 2.9Å; E104-A109 WeakPolarHBondContact O-CB 3.26Å; E104-A109 PolarHBondContact O-N 3.37Å; E104-A109 VanDerWaalsContact O-N 3.13Å
105	R	83.3	Confident	83.1	Confident	21 Å²	21	67.9 Å²	67.9	8%	0.079	38%	0.38	C	S	.	.	I	π-helix	trans	-60.3	-52.7	173	-68	-177.8	-159.1	147.2	16.5	110.9	D98 F100 T101 N102 D103 S107 G108 A109 V110 T453	D98-R105 VanDerWaalsContact CB-NH2 3.25Å; D98-R105 IonicContact OD2-CZ 3.95Å; D98-R105 IonicContact OD2-NE 3.14Å; D98-R105 PolarHBondContact OD2-NE 3.47Å; D98-R105 IonicContact OD2-NH2 3.62Å; D98-R105 PolarHBondContact OD2-NH2 3.35Å; F100-R105 HydrophobicContact CB-CG 3.99Å; F100-R105 PolarHBondContact O-NE 3.31Å; F100-R105 PolarHBondContact O-NH2 2.82Å; T101-R105 WeakPolarHBondContact O-CG 3.37Å; T101-R105 PolarHBondContact O-N 2.84Å; N102-R105 WeakPolarHBondContact O-CB 3.46Å; N102-R105 PolarHBondContact O-N 3.44Å; D103-R105 VanDerWaalsContact C-N 3.33Å; D103-R105 PolarHBondContact O-N 3.05Å; R105-S107 PolarHBondContact O-N 2.86Å; R105-G108 PolarHBondContact O-N 3.4Å; R105-G108 VanDerWaalsContact O-N 3.08Å; R105-A109 PolarHBondContact O-N 3.46Å; R105-V110 HydrophobicContact CB-CG2 3.94Å; R105-V110 VanDerWaalsContact O-CG2 3.27Å; R105-V110 WeakPolarHBondContact O-CG2 3.44Å; R105-V110 PolarHBondContact O-N 3.45Å; R105-T453 HydrophobicContact CB-CG2 3.61Å; R105-T453 VanDerWaalsContact CD-CG2 3.4Å; R105-T453 HydrophobicContact CG-CG2 4.11Å
106	K	78.5	Confident	83.3	Confident	125 Å²	125	69 Å²	69	54%	0.543	39%	0.39	S	S	.	.	I	π-helix	trans	-59.6	-32.3	176.6	-73.3	172.5	178.7	161.4	0	112.6	N102 D103 G108	N102-K106 WeakPolarHBondContact O-CG 3.46Å; N102-K106 PolarHBondContact O-N 2.92Å; N102-K106 WeakPolarHBondContact OD1-CE 3.39Å; N102-K106 PolarHBondContact OD1-NZ 3.49Å; D103-K106 PolarHBondContact O-N 3.48Å; K106-G108 PolarHBondContact O-N 3.44Å
107	S	80.3	Confident	83.5	Confident	103 Å²	103	65.8 Å²	65.8	72%	0.72	37%	0.37	S	S	*	.	I	π-helix	trans	-73.9	-8.6	178.2	79.8	0	0	0	0	114.9	D103 E104 R105	D103-S107 WeakPolarHBondContact O-CB 3.42Å; D103-S107 PolarHBondContact O-N 3.47Å; E104-S107 WeakPolarHBondContact CA-OG 3.49Å; E104-S107 PolarHBondContact O-N 3.4Å; E104-S107 PolarHBondContact O-OG 3.2Å; R105-S107 PolarHBondContact O-N 2.86Å
108	G	80.3	Confident	83.7	Confident	35 Å²	35	59.7 Å²	59.7	36%	0.361	34%	0.337	S	S	.	.	I	π-helix	trans	138.8	-9.8	173.7	0	0	0	0	0	115.4	E104 R105 K106 V110 L111	E104-G108 PolarHBondContact O-N 2.9Å; R105-G108 PolarHBondContact O-N 3.4Å; R105-G108 VanDerWaalsContact O-N 3.08Å; K106-G108 PolarHBondContact O-N 3.44Å; G108-V110 PolarHBondContact O-N 3.29Å; G108-V110 VanDerWaalsContact O-N 3.14Å; G108-L111 WeakPolarHBondContact O-CB 3.49Å; G108-L111 PolarHBondContact O-N 3.37Å; G108-L111 VanDerWaalsContact O-N 3.08Å
109	A	84.9	Confident	84	Confident	14 Å²	14	61.3 Å²	61.3	12%	0.116	34%	0.341	C	S	.	.	I	π-helix	trans	-66.9	-12.6	179	0	0	0	0	0	113.4	F100 E104 R105 L111 L112 H113	F100-A109 HydrophobicContact CB-CB 4.37Å; F100-A109 HydrophobicContact CD1-CB 4.02Å; F100-A109 HydrophobicContact CD2-CB 4.3Å; F100-A109 HydrophobicContact CE1-CB 4.37Å; F100-A109 HydrophobicContact CG-CB 3.96Å; E104-A109 WeakPolarHBondContact O-CB 3.26Å; E104-A109 PolarHBondContact O-N 3.37Å; E104-A109 VanDerWaalsContact O-N 3.13Å; R105-A109 PolarHBondContact O-N 3.46Å; A109-L111 PolarHBondContact O-N 3.43Å; A109-L112 WeakPolarHBondContact O-CB 3.42Å; A109-L112 PolarHBondContact O-N 2.9Å; A109-L112 VanDerWaalsContact O-N 3.12Å; A109-H113 PolarHBondContact O-N 3.45Å; A109-H113 PolarHBondContact O-ND1 3.44Å
110	V	85.1	Confident	84.5	Confident	18 Å²	18	55.3 Å²	55.3	11%	0.109	31%	0.309	C	S	.	.	H	α-helix	trans	-57.4	-31.5	168.2	172	0	0	0	0	112.4	R105 G108 L112 H113 I114 T453	R105-V110 HydrophobicContact CB-CG2 3.94Å; R105-V110 VanDerWaalsContact O-CG2 3.27Å; R105-V110 WeakPolarHBondContact O-CG2 3.44Å; R105-V110 PolarHBondContact O-N 3.45Å; G108-V110 PolarHBondContact O-N 3.29Å; G108-V110 VanDerWaalsContact O-N 3.14Å; V110-L112 VanDerWaalsContact C-N 3.26Å; V110-L112 PolarHBondContact O-N 3.43Å; V110-H113 WeakPolarHBondContact O-CB 3.17Å; V110-H113 PolarHBondContact O-N 2.84Å; V110-H113 VanDerWaalsContact O-N 3.15Å; V110-I114 HydrophobicContact CG1-CD1 3.98Å; V110-I114 HydrophobicContact CG1-CG1 4.31Å; V110-I114 WeakPolarHBondContact O-CG1 3.34Å; V110-I114 PolarHBondContact O-N 3.26Å; V110-T453 HydrophobicContact CG2-CG2 3.86Å; V110-T453 VanDerWaalsContact CG2-OG1 3.26Å; V110-T453 WeakPolarHBondContact CG2-OG1 3.38Å
111	L	85.5	Confident	84.8	Confident	125 Å²	125	52.6 Å²	52.6	65%	0.654	30%	0.297	S	S	*	.	H	α-helix	trans	-63.9	-32.5	177.3	-69	175.1	0	0	0	112.6	G108 A109 I114 A115	G108-L111 WeakPolarHBondContact O-CB 3.49Å; G108-L111 PolarHBondContact O-N 3.37Å; G108-L111 VanDerWaalsContact O-N 3.08Å; A109-L111 PolarHBondContact O-N 3.43Å; L111-I114 HydrophobicContact CD2-CD1 4.47Å; L111-I114 PolarHBondContact O-N 2.99Å; L111-A115 WeakPolarHBondContact O-CB 3.49Å; L111-A115 PolarHBondContact O-N 3.2Å
112	L	87.9	Confident	84.9	Confident	105 Å²	105	49.5 Å²	49.5	55%	0.55	28%	0.278	S	S	.	.	H	α-helix	trans	-68.3	-39.8	175.1	-65.8	176	0	0	0	111.1	F100 A109 V110 A115 A116	F100-L112 HydrophobicContact CE2-CD1 4.23Å; F100-L112 HydrophobicContact CZ-CD1 3.88Å; A109-L112 WeakPolarHBondContact O-CB 3.42Å; A109-L112 PolarHBondContact O-N 2.9Å; A109-L112 VanDerWaalsContact O-N 3.12Å; V110-L112 VanDerWaalsContact C-N 3.26Å; V110-L112 PolarHBondContact O-N 3.43Å; L112-A115 PolarHBondContact O-N 3.5Å; L112-A116 WeakPolarHBondContact O-CB 3.48Å; L112-A116 PolarHBondContact O-N 3.27Å
113	H	88.6	Confident	85.4	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.028	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-43.9	174.7	-67.4	77.7	0	0	0	111.1	D98 F100 A109 V110 A115 A116 T117 I450	D98-H113 IonicContact OD1-CE1 3.95Å; D98-H113 IonicContact OD1-NE2 3.5Å; D98-H113 PolarHBondContact OD1-NE2 3.34Å; D98-H113 IonicContact OD2-CE1 3.99Å; D98-H113 PolarHBondContact OD2-CE1 3.44Å; D98-H113 IonicContact OD2-NE2 2.84Å; D98-H113 PolarHBondContact OD2-NE2 2.85Å; F100-H113 AromaticContact CD2-CE1 3.85Å; A109-H113 PolarHBondContact O-N 3.45Å; A109-H113 PolarHBondContact O-ND1 3.44Å; V110-H113 WeakPolarHBondContact O-CB 3.17Å; V110-H113 PolarHBondContact O-N 2.84Å; V110-H113 VanDerWaalsContact O-N 3.15Å; H113-A115 VanDerWaalsContact C-N 3.32Å; H113-A115 PolarHBondContact O-N 3.31Å; H113-A116 WeakPolarHBondContact O-CB 3.49Å; H113-A116 PolarHBondContact O-N 3.19Å; H113-T117 WeakPolarHBondContact O-CB 3.32Å; H113-T117 PolarHBondContact O-N 3.22Å; H113-T117 PolarHBondContact O-OG1 3.46Å; H113-I450 HydrophobicContact CB-CD1 4.13Å; H113-I450 HydrophobicContact CB-CG1 3.76Å
114	I	87.4	Confident	85.9	Confident	33 Å²	33	43.3 Å²	43.3	17%	0.169	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-43.9	175	-66.9	168.7	0	0	0	110.8	V110 L111 T117 L118 I450	V110-I114 HydrophobicContact CG1-CD1 3.98Å; V110-I114 HydrophobicContact CG1-CG1 4.31Å; V110-I114 WeakPolarHBondContact O-CG1 3.34Å; V110-I114 PolarHBondContact O-N 3.26Å; L111-I114 HydrophobicContact CD2-CD1 4.47Å; L111-I114 PolarHBondContact O-N 2.99Å; I114-T117 PolarHBondContact O-N 3.15Å; I114-L118 HydrophobicContact CG2-CD1 4.08Å; I114-L118 VanDerWaalsContact O-CG 3.31Å; I114-L118 WeakPolarHBondContact O-CG 3.37Å; I114-L118 PolarHBondContact O-N 3.3Å; I114-I450 HydrophobicContact CB-CD1 4.49Å; I114-I450 HydrophobicContact CG1-CD1 3.83Å; I114-I450 HydrophobicContact CG1-CG1 4.23Å
115	A	86.9	Confident	86	Confident	55 Å²	55	39.5 Å²	39.5	46%	0.455	23%	0.228	S	C	.	.	H	α-helix	trans	-63.9	-41.3	176.6	0	0	0	0	0	112.2	L111 L112 H113 L118 Y119	L111-A115 WeakPolarHBondContact O-CB 3.49Å; L111-A115 PolarHBondContact O-N 3.2Å; L112-A115 PolarHBondContact O-N 3.5Å; H113-A115 VanDerWaalsContact C-N 3.32Å; H113-A115 PolarHBondContact O-N 3.31Å; A115-L118 PolarHBondContact O-N 3.14Å; A115-Y119 WeakPolarHBondContact O-CB 3.46Å; A115-Y119 PolarHBondContact O-N 3.29Å
116	A	89.9	Confident	85.9	Confident	31 Å²	31	39.2 Å²	39.2	26%	0.256	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-45.2	175.4	0	0	0	0	0	111.2	L112 H113 Y119 M120 M446	L112-A116 WeakPolarHBondContact O-CB 3.48Å; L112-A116 PolarHBondContact O-N 3.27Å; H113-A116 WeakPolarHBondContact O-CB 3.49Å; H113-A116 PolarHBondContact O-N 3.19Å; A116-Y119 CarbonylContact O-C 3.47Å; A116-Y119 WeakPolarHBondContact O-CB 3.45Å; A116-Y119 PolarHBondContact O-N 3.48Å; A116-Y119 VanDerWaalsContact O-N 3.16Å; A116-M120 WeakPolarHBondContact O-CG 3.49Å; A116-M120 PolarHBondContact O-N 2.94Å; A116-M446 HydrophobicContact CB-CG 4.22Å; A116-M446 HydrophobicContact CB-SD 4.26Å
117	T	88.8	Confident	86.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-46.3	177	-61.3	0	0	0	0	112.6	H113 I114 Y119 M120 F121 M446 V447 I450 F465	H113-T117 WeakPolarHBondContact O-CB 3.32Å; H113-T117 PolarHBondContact O-N 3.22Å; H113-T117 PolarHBondContact O-OG1 3.46Å; I114-T117 PolarHBondContact O-N 3.15Å; T117-Y119 VanDerWaalsContact C-N 3.25Å; T117-Y119 PolarHBondContact O-N 2.73Å; T117-M120 PolarHBondContact O-N 3.17Å; T117-M120 VanDerWaalsContact O-N 3.13Å; T117-F121 HydrophobicContact CG2-CD2 4.1Å; T117-F121 HydrophobicContact CG2-CE2 3.68Å; T117-F121 HydrophobicContact CG2-CZ 4.44Å; T117-F121 WeakPolarHBondContact O-CD2 3.43Å; T117-F121 PolarHBondContact O-N 3.43Å; T117-M446 WeakPolarHBondContact OG1-CB 3.48Å; T117-V447 HydrophobicContact CG2-CG2 3.51Å; T117-I450 WeakPolarHBondContact OG1-CD1 3.46Å; T117-F465 HydrophobicContact CG2-CE1 3.32Å; T117-F465 HydrophobicContact CG2-CZ 3.57Å
118	L	85.8	Confident	86.7	Confident	27 Å²	27	28.7 Å²	28.7	14%	0.141	17%	0.171	C	C	.	.	H	α-helix	trans	-61.2	-36.2	175.1	-70.4	169.1	0	0	0	112	V34 I37 I114 A115 L122	V34-L118 HydrophobicContact CG1-CD1 4.32Å; V34-L118 HydrophobicContact CG2-CD1 4.11Å; V34-L118 HydrophobicContact CG2-CD2 4.04Å; I37-L118 HydrophobicContact CB-CD2 4.28Å; I37-L118 HydrophobicContact CD1-CD2 3.91Å; I37-L118 HydrophobicContact CG2-CD2 4.01Å; I114-L118 HydrophobicContact CG2-CD1 4.08Å; I114-L118 VanDerWaalsContact O-CG 3.31Å; I114-L118 WeakPolarHBondContact O-CG 3.37Å; I114-L118 PolarHBondContact O-N 3.3Å; A115-L118 PolarHBondContact O-N 3.14Å; L118-L122 PolarHBondContact O-N 3.02Å; L118-L122 VanDerWaalsContact O-N 3.17Å
119	Y	88	Confident	86.7	Confident	68 Å²	68	29 Å²	29	27%	0.267	16%	0.164	S	C	.	.	H	α-helix	trans	-67.8	-37.3	174.5	-175.8	-97	0	0	0	112.3	A115 A116 T117 L122 A123 I401 P404 L405	A115-Y119 WeakPolarHBondContact O-CB 3.46Å; A115-Y119 PolarHBondContact O-N 3.29Å; A116-Y119 CarbonylContact O-C 3.47Å; A116-Y119 WeakPolarHBondContact O-CB 3.45Å; A116-Y119 PolarHBondContact O-N 3.48Å; A116-Y119 VanDerWaalsContact O-N 3.16Å; T117-Y119 VanDerWaalsContact C-N 3.25Å; T117-Y119 PolarHBondContact O-N 2.73Å; Y119-L122 WeakPolarHBondContact O-CB 3.18Å; Y119-L122 PolarHBondContact O-N 2.85Å; Y119-A123 PolarHBondContact O-N 3.07Å; Y119-I401 HydrophobicContact CD2-CG2 4.39Å; Y119-I401 HydrophobicContact CE2-CG2 4.45Å; Y119-I401 WeakPolarHBondContact CE2-O 3.25Å; Y119-P404 WeakPolarHBondContact OH-CG 2.94Å; Y119-L405 WeakPolarHBondContact OH-CB 3.25Å; Y119-L405 PolarHBondContact OH-N 3.19Å
120	M	90.4	Very high	86.5	Confident	30 Å²	30	29 Å²	29	15%	0.148	16%	0.161	C	C	.	.	H	α-helix	trans	-69	-38	174.6	-65.1	-55.3	175	0	0	112.6	A116 T117 L122 A123 L124 F439 L442 M443	A116-M120 WeakPolarHBondContact O-CG 3.49Å; A116-M120 PolarHBondContact O-N 2.94Å; T117-M120 PolarHBondContact O-N 3.17Å; T117-M120 VanDerWaalsContact O-N 3.13Å; M120-L122 VanDerWaalsContact C-N 3.3Å; M120-L122 PolarHBondContact O-N 3.31Å; M120-A123 WeakPolarHBondContact O-CA 3.46Å; M120-A123 WeakPolarHBondContact O-CB 3.42Å; M120-A123 PolarHBondContact O-N 3.41Å; M120-L124 PolarHBondContact O-N 2.53Å; M120-F439 HydrophobicContact SD-CD1 4.07Å; M120-L442 HydrophobicContact CE-CB 3.8Å; M120-L442 HydrophobicContact CE-CD1 3.51Å; M120-L442 HydrophobicContact CE-CG 4.26Å; M120-L442 HydrophobicContact CG-CB 4.28Å; M120-L442 HydrophobicContact SD-CB 4.08Å; M120-L442 HydrophobicContact SD-CD1 4.17Å; M120-M443 HydrophobicContact CB-CB 4.07Å
121	F	88.4	Confident	86.6	Confident	5 Å²	5	28.5 Å²	28.5	2%	0.022	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-40.3	172	-76.6	-55.4	0	0	0	112.4	I37 T117 A123 L124 A125 M443 F465 L466 G469 T470	I37-F121 HydrophobicContact CD1-CD2 4Å; I37-F121 HydrophobicContact CD1-CE2 4.2Å; T117-F121 HydrophobicContact CG2-CD2 4.1Å; T117-F121 HydrophobicContact CG2-CE2 3.68Å; T117-F121 HydrophobicContact CG2-CZ 4.44Å; T117-F121 WeakPolarHBondContact O-CD2 3.43Å; T117-F121 PolarHBondContact O-N 3.43Å; F121-A123 VanDerWaalsContact C-N 3.29Å; F121-A123 PolarHBondContact O-N 3.42Å; F121-L124 PolarHBondContact O-N 2.97Å; F121-A125 WeakPolarHBondContact O-CB 3.25Å; F121-A125 PolarHBondContact O-N 3.33Å; F121-M443 HydrophobicContact CD1-CG 4.44Å; F121-M443 HydrophobicContact CD1-SD 3.62Å; F121-M443 HydrophobicContact CE1-CG 4.02Å; F121-M443 HydrophobicContact CE1-SD 3.19Å; F121-M443 WeakPolarHBondContact CE1-SD 3.42Å; F121-M443 HydrophobicContact CZ-CG 4.22Å; F121-M443 HydrophobicContact CZ-SD 3.93Å; F121-F465 HydrophobicContact CE2-CD1 4.29Å; F121-F465 AromaticContact CE2-CE1 3.46Å; F121-F465 HydrophobicContact CE2-CE1 3.46Å; F121-F465 VanDerWaalsContact CE2-CE1 3.46Å; F121-F465 AromaticContact CE2-CZ 3.83Å; F121-F465 HydrophobicContact CE2-CZ 3.83Å; F121-F465 HydrophobicContact CZ-CD1 4.29Å; F121-F465 AromaticContact CZ-CE1 3.85Å; F121-F465 HydrophobicContact CZ-CE1 3.85Å; F121-L466 HydrophobicContact CZ-CD1 4.38Å; F121-G469 VanDerWaalsContact CD1-C 3.48Å; F121-T470 HydrophobicContact CE1-CG2 4.18Å
122	L	84.9	Confident	86.8	Confident	13 Å²	13	23.2 Å²	23.2	7%	0.068	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-41.8	172.3	177.7	63.4	0	0	0	111.4	L30 L118 Y119 M120 A125 I126	L30-L122 HydrophobicContact CD1-CD1 3.72Å; L30-L122 HydrophobicContact CD1-CD2 3.77Å; L30-L122 HydrophobicContact CD1-CG 4.33Å; L30-L122 HydrophobicContact CD2-CB 4.08Å; L30-L122 HydrophobicContact CD2-CD1 3.93Å; L30-L122 HydrophobicContact CD2-CD2 4.02Å; L30-L122 HydrophobicContact CD2-CG 4.21Å; L30-L122 HydrophobicContact CG-CD1 3.68Å; L30-L122 HydrophobicContact CG-CD2 4.28Å; L30-L122 HydrophobicContact CG-CG 4.43Å; L118-L122 PolarHBondContact O-N 3.02Å; L118-L122 VanDerWaalsContact O-N 3.17Å; Y119-L122 WeakPolarHBondContact O-CB 3.18Å; Y119-L122 PolarHBondContact O-N 2.85Å; M120-L122 VanDerWaalsContact C-N 3.3Å; M120-L122 PolarHBondContact O-N 3.31Å; L122-A125 PolarHBondContact O-N 3.18Å; L122-I126 HydrophobicContact CD1-CD1 3.75Å; L122-I126 HydrophobicContact CD1-CG1 4.21Å; L122-I126 HydrophobicContact CG-CD1 3.85Å; L122-I126 WeakPolarHBondContact O-CG1 3.47Å; L122-I126 PolarHBondContact O-N 3.24Å
123	A	88.4	Confident	86.7	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.6	-45.8	178.1	0	0	0	0	0	112.8	Y119 M120 F121 I126 T127 L405 F439	Y119-A123 PolarHBondContact O-N 3.07Å; M120-A123 WeakPolarHBondContact O-CA 3.46Å; M120-A123 WeakPolarHBondContact O-CB 3.42Å; M120-A123 PolarHBondContact O-N 3.41Å; F121-A123 VanDerWaalsContact C-N 3.29Å; F121-A123 PolarHBondContact O-N 3.42Å; A123-I126 PolarHBondContact O-N 3.43Å; A123-T127 WeakPolarHBondContact O-CB 3.45Å; A123-T127 PolarHBondContact O-N 2.68Å; A123-T127 PolarHBondContact O-OG1 2.83Å; A123-L405 HydrophobicContact CB-CD1 3.47Å; A123-L405 VanDerWaalsContact CB-CD1 3.47Å; A123-L405 HydrophobicContact CB-CD2 3.87Å; A123-L405 HydrophobicContact CB-CG 4.3Å; A123-F439 HydrophobicContact CB-CD1 4.02Å; A123-F439 HydrophobicContact CB-CD2 3.89Å; A123-F439 HydrophobicContact CB-CE1 4.16Å; A123-F439 HydrophobicContact CB-CE2 4.03Å; A123-F439 HydrophobicContact CB-CG 3.9Å; A123-F439 HydrophobicContact CB-CZ 4.17Å
124	L	88.3	Confident	86.5	Confident	5 Å²	5	19.7 Å²	19.7	3%	0.026	11%	0.113	C	C	.	.	H	α-helix	trans	-62.1	-48.7	175.5	-74.9	168.3	0	0	0	111.5	M120 F121 I126 T127 C128 P162 I436 F439 M443	M120-L124 PolarHBondContact O-N 2.53Å; F121-L124 PolarHBondContact O-N 2.97Å; L124-I126 VanDerWaalsContact C-N 3.34Å; L124-I126 PolarHBondContact O-N 2.96Å; L124-T127 PolarHBondContact O-N 3.15Å; L124-C128 WeakPolarHBondContact O-CB 3.49Å; L124-C128 PolarHBondContact O-N 2.98Å; L124-C128 PolarHBondContact O-SG 3.34Å; L124-P162 HydrophobicContact CD1-CB 4.42Å; L124-P162 HydrophobicContact CD2-CB 4.36Å; L124-I436 HydrophobicContact CD2-CB 4.48Å; L124-I436 HydrophobicContact CD2-CG2 3.95Å; L124-F439 HydrophobicContact CD2-CB 3.67Å; L124-F439 HydrophobicContact CG-CB 3.83Å; L124-M443 HydrophobicContact CD1-CB 4.4Å; L124-M443 HydrophobicContact CD1-CE 4.07Å; L124-M443 HydrophobicContact CD1-CG 4.47Å; L124-M443 HydrophobicContact CD1-SD 3.38Å; L124-M443 WeakPolarHBondContact CD1-SD 3.15Å
125	A	84.3	Confident	86.5	Confident	10 Å²	10	18.1 Å²	18.1	8%	0.083	11%	0.105	C	C	.	.	H	α-helix	trans	-58.8	-44	179.8	0	0	0	0	0	112.2	F121 L122 D129 P473	F121-A125 WeakPolarHBondContact O-CB 3.25Å; F121-A125 PolarHBondContact O-N 3.33Å; L122-A125 PolarHBondContact O-N 3.18Å; A125-D129 WeakPolarHBondContact O-CB 2.86Å; A125-D129 PolarHBondContact O-N 2.85Å; A125-D129 VanDerWaalsContact O-N 3.11Å; A125-P473 HydrophobicContact CB-CG 3.81Å
126	I	82.4	Confident	86.5	Confident	16 Å²	16	15.9 Å²	15.9	8%	0.082	9%	0.085	C	C	.	.	H	α-helix	trans	-66.4	-46	177.6	-69.2	168.4	0	0	0	111	L122 A123 L124 E130 L405 L406 L409	L122-I126 HydrophobicContact CD1-CD1 3.75Å; L122-I126 HydrophobicContact CD1-CG1 4.21Å; L122-I126 HydrophobicContact CG-CD1 3.85Å; L122-I126 WeakPolarHBondContact O-CG1 3.47Å; L122-I126 PolarHBondContact O-N 3.24Å; A123-I126 PolarHBondContact O-N 3.43Å; L124-I126 VanDerWaalsContact C-N 3.34Å; L124-I126 PolarHBondContact O-N 2.96Å; I126-E130 HydrophobicContact CG2-CG 4.33Å; I126-E130 VanDerWaalsContact O-CB 3.25Å; I126-E130 WeakPolarHBondContact O-CB 3.39Å; I126-E130 WeakPolarHBondContact O-CG 3.37Å; I126-E130 PolarHBondContact O-N 3.27Å; I126-L405 HydrophobicContact CB-CD2 4.33Å; I126-L405 HydrophobicContact CD1-CD2 3.72Å; I126-L406 HydrophobicContact CG2-CD2 4.47Å; I126-L409 HydrophobicContact CG2-CD1 4.07Å
127	T	87.9	Confident	86.3	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66	-42.8	-176.3	-52.7	0	0	0	0	111.3	A123 L124 Y131 F132 L409 W435 I436 F439	A123-T127 WeakPolarHBondContact O-CB 3.45Å; A123-T127 PolarHBondContact O-N 2.68Å; A123-T127 PolarHBondContact O-OG1 2.83Å; L124-T127 PolarHBondContact O-N 3.15Å; T127-Y131 WeakPolarHBondContact O-CB 3.45Å; T127-Y131 PolarHBondContact O-N 2.98Å; T127-F132 PolarHBondContact O-N 2.84Å; T127-L409 HydrophobicContact CG2-CD2 4.44Å; T127-W435 HydrophobicContact CG2-CB 4.06Å; T127-I436 HydrophobicContact CG2-CD1 4.5Å; T127-I436 HydrophobicContact CG2-CG1 3.81Å; T127-F439 WeakPolarHBondContact OG1-CE2 3.31Å
128	C	86.7	Confident	86.2	Confident	7 Å²	7	18.6 Å²	18.6	5%	0.047	9%	0.092	C	C	.	.	I	π-helix	trans	-66.1	-52.9	179.5	-63.2	0	0	0	0	111.3	L124 F132 V133 P162 I436	L124-C128 WeakPolarHBondContact O-CB 3.49Å; L124-C128 PolarHBondContact O-N 2.98Å; L124-C128 PolarHBondContact O-SG 3.34Å; C128-F132 WeakPolarHBondContact O-CB 3.29Å; C128-F132 PolarHBondContact O-N 2.87Å; C128-V133 WeakPolarHBondContact O-CB 3.31Å; C128-V133 VanDerWaalsContact O-CG2 3.3Å; C128-V133 WeakPolarHBondContact O-CG2 3.41Å; C128-V133 PolarHBondContact O-N 3.27Å; C128-P162 WeakPolarHBondContact SG-CG 3.43Å; C128-I436 VanDerWaalsContact SG-CD1 3.55Å
129	D	81.3	Confident	86.2	Confident	42 Å²	42	18 Å²	18	23%	0.225	9%	0.089	C	C	.	.	I	π-helix	trans	-71.8	-41.9	-174.8	-81.1	-22.6	0	0	0	113.8	A125	A125-D129 WeakPolarHBondContact O-CB 2.86Å; A125-D129 PolarHBondContact O-N 2.85Å; A125-D129 VanDerWaalsContact O-N 3.11Å
130	E	80.3	Confident	86	Confident	13 Å²	13	15.3 Å²	15.3	6%	0.061	8%	0.08	C	C	.	.	I	π-helix	trans	-86.3	-36.1	-171.3	-63.8	-144.3	108.6	0	0	113.7	R26 I126 T134	R26-E130 IonicContact CZ-OE1 3Å; R26-E130 IonicContact NH1-OE1 2.76Å; R26-E130 PolarHBondContact NH1-OE1 3.12Å; R26-E130 IonicContact NH1-OE2 3.31Å; R26-E130 IonicContact NH2-OE1 3.19Å; R26-E130 PolarHBondContact NH2-OE1 2.65Å; I126-E130 HydrophobicContact CG2-CG 4.33Å; I126-E130 VanDerWaalsContact O-CB 3.25Å; I126-E130 WeakPolarHBondContact O-CB 3.39Å; I126-E130 WeakPolarHBondContact O-CG 3.37Å; I126-E130 PolarHBondContact O-N 3.27Å; E130-T134 WeakPolarHBondContact O-CB 3.48Å; E130-T134 WeakPolarHBondContact O-CG2 3.35Å; E130-T134 PolarHBondContact O-OG1 3.47Å
131	Y	86.6	Confident	85.8	Confident	7 Å²	7	19.4 Å²	19.4	3%	0.027	10%	0.098	C	C	.	.	I	π-helix	trans	-111.4	-49.5	-171.3	-61.3	-89.7	0	0	0	111.4	T127 T134 S135 L409 V413 N415	T127-Y131 WeakPolarHBondContact O-CB 3.45Å; T127-Y131 PolarHBondContact O-N 2.98Å; Y131-T134 PolarHBondContact O-OG1 3.46Å; Y131-T134 VanDerWaalsContact O-OG1 3.12Å; Y131-S135 VanDerWaalsContact O-CB 3.29Å; Y131-S135 WeakPolarHBondContact O-CB 3.19Å; Y131-S135 PolarHBondContact O-N 3.24Å; Y131-S135 VanDerWaalsContact O-N 3.11Å; Y131-S135 PolarHBondContact O-OG 2.82Å; Y131-L409 HydrophobicContact CE2-CB 4.09Å; Y131-L409 HydrophobicContact CE2-CD1 4.03Å; Y131-V413 HydrophobicContact CD1-CB 3.87Å; Y131-V413 HydrophobicContact CD1-CG1 3.49Å; Y131-V413 VanDerWaalsContact CD1-CG1 3.49Å; Y131-V413 HydrophobicContact CE1-CB 4.07Å; Y131-V413 HydrophobicContact CE1-CG1 4.18Å; Y131-V413 HydrophobicContact CG-CG1 4.07Å; Y131-N415 HydrophobicContact CE1-CB 4.11Å
132	F	89.4	Confident	85.7	Confident	14 Å²	14	26 Å²	26	6%	0.061	13%	0.127	C	C	.	.	I	π-helix	trans	-72.7	-57.4	-174.7	-173.8	-115.7	0	0	0	112.2	T127 C128 T134 S135 L136 A161 F429 T433 I436	T127-F132 PolarHBondContact O-N 2.84Å; C128-F132 WeakPolarHBondContact O-CB 3.29Å; C128-F132 PolarHBondContact O-N 2.87Å; F132-T134 VanDerWaalsContact C-N 3.31Å; F132-T134 PolarHBondContact O-N 3.22Å; F132-S135 PolarHBondContact O-N 3.22Å; F132-S135 VanDerWaalsContact O-N 3.1Å; F132-S135 PolarHBondContact O-OG 2.6Å; F132-L136 HydrophobicContact CD1-CD1 3.79Å; F132-L136 HydrophobicContact CE1-CD1 3.49Å; F132-L136 VanDerWaalsContact CE1-CD1 3.49Å; F132-L136 HydrophobicContact CE2-CD1 4.4Å; F132-L136 HydrophobicContact CG-CD1 4.37Å; F132-L136 HydrophobicContact CZ-CD1 3.82Å; F132-L136 HydrophobicContact CZ-CG 4.48Å; F132-L136 PolarHBondContact O-N 3.4Å; F132-A161 HydrophobicContact CD1-CB 3.92Å; F132-A161 HydrophobicContact CE1-CB 3.41Å; F132-A161 VanDerWaalsContact CE1-CB 3.41Å; F132-A161 HydrophobicContact CZ-CB 4.03Å; F132-F429 HydrophobicContact CD2-CD2 4.04Å; F132-F429 HydrophobicContact CD2-CE2 4.05Å; F132-F429 AromaticContact CE2-CD2 3.71Å; F132-F429 HydrophobicContact CE2-CD2 3.71Å; F132-F429 AromaticContact CE2-CE2 3.26Å; F132-F429 HydrophobicContact CE2-CE2 3.26Å; F132-F429 HydrophobicContact CE2-CZ 4Å; F132-F429 AromaticContact CZ-CE2 3.86Å; F132-F429 HydrophobicContact CZ-CE2 3.86Å; F132-T433 WeakPolarHBondContact CE2-OG1 3.37Å; F132-I436 HydrophobicContact CB-CD1 3.75Å; F132-I436 HydrophobicContact CD1-CD1 4.01Å; F132-I436 HydrophobicContact CD2-CD1 4.04Å; F132-I436 HydrophobicContact CG-CD1 3.68Å
133	V	85.6	Confident	85.6	Confident	12 Å²	12	30.2 Å²	30.2	7%	0.073	15%	0.149	C	C	.	.	H	α-helix	trans	-60.7	-39.2	179.5	172.7	0	0	0	0	111.4	C128 S135 L136 E137 M155	C128-V133 WeakPolarHBondContact O-CB 3.31Å; C128-V133 VanDerWaalsContact O-CG2 3.3Å; C128-V133 WeakPolarHBondContact O-CG2 3.41Å; C128-V133 PolarHBondContact O-N 3.27Å; V133-S135 VanDerWaalsContact C-N 3.34Å; V133-S135 PolarHBondContact O-N 2.73Å; V133-L136 WeakPolarHBondContact O-CB 3.41Å; V133-L136 PolarHBondContact O-N 3.44Å; V133-E137 WeakPolarHBondContact O-CG 3.31Å; V133-E137 PolarHBondContact O-N 3.01Å; V133-M155 HydrophobicContact CG1-CE 4.09Å; V133-M155 HydrophobicContact CG1-SD 4.32Å
134	T	84.6	Confident	85.3	Confident	26 Å²	26	37.6 Å²	37.6	16%	0.16	19%	0.188	C	C	.	.	H	α-helix	trans	-67.4	-34	177.1	61.7	0	0	0	0	112.6	E130 Y131 F132 K138	E130-T134 WeakPolarHBondContact O-CB 3.48Å; E130-T134 WeakPolarHBondContact O-CG2 3.35Å; E130-T134 PolarHBondContact O-OG1 3.47Å; Y131-T134 PolarHBondContact O-OG1 3.46Å; Y131-T134 VanDerWaalsContact O-OG1 3.12Å; F132-T134 VanDerWaalsContact C-N 3.31Å; F132-T134 PolarHBondContact O-N 3.22Å; T134-K138 PolarHBondContact O-N 3.3Å
135	S	88.6	Confident	84.6	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-38	172.8	72.5	0	0	0	0	111.7	Y131 F132 V133 K138 I139 F429	Y131-S135 VanDerWaalsContact O-CB 3.29Å; Y131-S135 WeakPolarHBondContact O-CB 3.19Å; Y131-S135 PolarHBondContact O-N 3.24Å; Y131-S135 VanDerWaalsContact O-N 3.11Å; Y131-S135 PolarHBondContact O-OG 2.82Å; F132-S135 PolarHBondContact O-N 3.22Å; F132-S135 VanDerWaalsContact O-N 3.1Å; F132-S135 PolarHBondContact O-OG 2.6Å; V133-S135 VanDerWaalsContact C-N 3.34Å; V133-S135 PolarHBondContact O-N 2.73Å; S135-K138 PolarHBondContact O-N 3.23Å; S135-I139 VanDerWaalsContact O-CG1 3.29Å; S135-I139 WeakPolarHBondContact O-CG1 3.44Å; S135-I139 PolarHBondContact O-N 3.35Å; S135-F429 WeakPolarHBondContact OG-CA 3.37Å
136	L	86.8	Confident	84	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-43.4	173.3	-77.2	166.7	0	0	0	112	F132 V133 K138 I139 C140 F154 G158 F429	F132-L136 HydrophobicContact CD1-CD1 3.79Å; F132-L136 HydrophobicContact CE1-CD1 3.49Å; F132-L136 VanDerWaalsContact CE1-CD1 3.49Å; F132-L136 HydrophobicContact CE2-CD1 4.4Å; F132-L136 HydrophobicContact CG-CD1 4.37Å; F132-L136 HydrophobicContact CZ-CD1 3.82Å; F132-L136 HydrophobicContact CZ-CG 4.48Å; F132-L136 PolarHBondContact O-N 3.4Å; V133-L136 WeakPolarHBondContact O-CB 3.41Å; V133-L136 PolarHBondContact O-N 3.44Å; L136-K138 VanDerWaalsContact C-N 3.27Å; L136-K138 PolarHBondContact O-N 2.94Å; L136-I139 PolarHBondContact O-N 2.65Å; L136-I139 VanDerWaalsContact O-N 3.13Å; L136-C140 PolarHBondContact O-N 2.96Å; L136-C140 PolarHBondContact O-SG 2.98Å; L136-F154 WeakPolarHBondContact CD1-O 3.33Å; L136-F154 HydrophobicContact CD2-CB 4.36Å; L136-F154 HydrophobicContact CD2-CD1 3.93Å; L136-G158 VanDerWaalsContact CD1-CA 3.47Å; L136-F429 HydrophobicContact CD2-CD2 4.23Å; L136-F429 HydrophobicContact CD2-CE2 3.65Å; L136-F429 HydrophobicContact CG-CD2 4.29Å; L136-F429 HydrophobicContact CG-CE2 4.03Å
137	E	85.2	Confident	83.4	Confident	45 Å²	45	50.4 Å²	50.4	21%	0.21	26%	0.255	C	S	.	.	H	α-helix	trans	-53.7	-46.3	173.2	-74.9	175.1	-170.9	0	0	110.9	K22 V133 C140 E141 M155	K22-E137 IonicContact NZ-OE1 3.48Å; V133-E137 WeakPolarHBondContact O-CG 3.31Å; V133-E137 PolarHBondContact O-N 3.01Å; E137-C140 PolarHBondContact O-N 3.08Å; E137-E141 WeakPolarHBondContact O-CG 3.43Å; E137-E141 PolarHBondContact O-N 3.46Å; E137-M155 HydrophobicContact CG-CE 3.35Å; E137-M155 HydrophobicContact CG-SD 3.84Å; E137-M155 WeakPolarHBondContact OE1-CE 3.29Å
138	K	85.6	Confident	82.3	Confident	43 Å²	43	55.1 Å²	55.1	19%	0.187	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-34.8	178.2	-70.2	-65.8	175.1	-174.3	0	113.6	T134 S135 L136 E141 K142 E422 F425	T134-K138 PolarHBondContact O-N 3.3Å; S135-K138 PolarHBondContact O-N 3.23Å; L136-K138 VanDerWaalsContact C-N 3.27Å; L136-K138 PolarHBondContact O-N 2.94Å; K138-E141 WeakPolarHBondContact CD-OE2 3.29Å; K138-E141 IonicContact NZ-OE1 3.94Å; K138-E141 IonicContact NZ-OE2 3.77Å; K138-E141 PolarHBondContact NZ-OE2 3.46Å; K138-K142 VanDerWaalsContact O-CG 3.32Å; K138-K142 WeakPolarHBondContact O-CG 3.42Å; K138-K142 PolarHBondContact O-N 3.08Å; K138-K142 VanDerWaalsContact O-N 3.07Å; K138-E422 IonicContact NZ-OE1 3.91Å; K138-E422 PolarHBondContact NZ-OE1 3.29Å; K138-F425 HydrophobicContact CB-CB 4.02Å; K138-F425 HydrophobicContact CB-CD2 4.47Å; K138-F425 HydrophobicContact CB-CG 4.38Å
139	I	87.3	Confident	81.4	Confident	16 Å²	16	56 Å²	56	8%	0.082	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-45.8	173.2	-67.7	167	0	0	0	109.8	S135 L136 E141 K142 L143 F425 M426 F429	S135-I139 VanDerWaalsContact O-CG1 3.29Å; S135-I139 WeakPolarHBondContact O-CG1 3.44Å; S135-I139 PolarHBondContact O-N 3.35Å; L136-I139 PolarHBondContact O-N 2.65Å; L136-I139 VanDerWaalsContact O-N 3.13Å; I139-E141 PolarHBondContact O-N 3.19Å; I139-K142 PolarHBondContact O-N 2.95Å; I139-L143 HydrophobicContact CG2-CD1 3.65Å; I139-L143 HydrophobicContact CG2-CG 4.31Å; I139-L143 WeakPolarHBondContact O-CB 3.4Å; I139-L143 WeakPolarHBondContact O-CG 3.36Å; I139-L143 PolarHBondContact O-N 3.48Å; I139-F425 HydrophobicContact CG1-CD2 3.69Å; I139-F425 HydrophobicContact CG1-CE2 3.85Å; I139-M426 HydrophobicContact CD1-CE 3.97Å; I139-M426 HydrophobicContact CD1-SD 4.22Å; I139-M426 HydrophobicContact CG1-CE 3.81Å; I139-F429 HydrophobicContact CD1-CB 4.11Å; I139-F429 HydrophobicContact CD1-CD1 4.39Å; I139-F429 HydrophobicContact CD1-CD2 3.78Å; I139-F429 HydrophobicContact CD1-CE2 4.3Å; I139-F429 HydrophobicContact CD1-CG 3.83Å
140	C	84.3	Confident	81	Confident	11 Å²	11	54.5 Å²	54.5	7%	0.074	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-43.6	177.2	-67.7	0	0	0	0	112.3	L136 E137 K142 L143 D144 L145 A150 F154	L136-C140 PolarHBondContact O-N 2.96Å; L136-C140 PolarHBondContact O-SG 2.98Å; E137-C140 PolarHBondContact O-N 3.08Å; C140-K142 VanDerWaalsContact C-N 3.3Å; C140-K142 PolarHBondContact O-N 3.34Å; C140-L143 PolarHBondContact O-N 3.21Å; C140-D144 PolarHBondContact O-N 3.1Å; C140-L145 PolarHBondContact O-N 3.42Å; C140-A150 HydrophobicContact CB-CB 4.02Å; C140-F154 VanDerWaalsContact SG-CB 3.56Å
141	E	84.8	Confident	80.4	Confident	115 Å²	115	55.3 Å²	55.3	54%	0.537	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-38.5	174.7	-74.9	176.4	-172	0	0	112	E137 K138 I139	E137-E141 WeakPolarHBondContact O-CG 3.43Å; E137-E141 PolarHBondContact O-N 3.46Å; K138-E141 WeakPolarHBondContact CD-OE2 3.29Å; K138-E141 IonicContact NZ-OE1 3.94Å; K138-E141 IonicContact NZ-OE2 3.77Å; K138-E141 PolarHBondContact NZ-OE2 3.46Å; I139-E141 PolarHBondContact O-N 3.19Å
142	K	86	Confident	79.3	Confident	144 Å²	144	55.9 Å²	55.9	63%	0.626	30%	0.297	S	S	*	.	H	α-helix	trans	-78.5	-26.2	-179.9	-70.9	-64	-178.5	-168	0	114	K138 I139 C140 D144 F425	K138-K142 VanDerWaalsContact O-CG 3.32Å; K138-K142 WeakPolarHBondContact O-CG 3.42Å; K138-K142 PolarHBondContact O-N 3.08Å; K138-K142 VanDerWaalsContact O-N 3.07Å; I139-K142 PolarHBondContact O-N 2.95Å; C140-K142 VanDerWaalsContact C-N 3.3Å; C140-K142 PolarHBondContact O-N 3.34Å; K142-D144 VanDerWaalsContact C-N 3.34Å; K142-F425 HydrophobicContact CG-CE1 4.42Å; K142-F425 HydrophobicContact CG-CE2 4.49Å; K142-F425 HydrophobicContact CG-CZ 4.1Å
143	L	84	Confident	78.6	Confident	102 Å²	102	55.6 Å²	55.6	53%	0.534	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-1.2	177.2	-69.5	175.4	0	0	0	113.3	I139 C140 L145	I139-L143 HydrophobicContact CG2-CD1 3.65Å; I139-L143 HydrophobicContact CG2-CG 4.31Å; I139-L143 WeakPolarHBondContact O-CB 3.4Å; I139-L143 WeakPolarHBondContact O-CG 3.36Å; I139-L143 PolarHBondContact O-N 3.48Å; C140-L143 PolarHBondContact O-N 3.21Å; L143-L145 HydrophobicContact CB-CD1 4.17Å; L143-L145 HydrophobicContact CB-CD2 4.47Å; L143-L145 HydrophobicContact CB-CG 3.85Å; L143-L145 HydrophobicContact CD1-CD1 4.33Å; L143-L145 PolarHBondContact O-N 3.29Å
144	D	81.6	Confident	78.4	Confident	154 Å²	154	58.5 Å²	58.5	82%	0.824	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	44.2	-178	-159.7	29.5	0	0	0	112.5	C140 K142	C140-D144 PolarHBondContact O-N 3.1Å; K142-D144 VanDerWaalsContact C-N 3.34Å
145	L	73.3	Confident	78.2	Confident	57 Å²	57	59.7 Å²	59.7	30%	0.298	31%	0.313	S	S	.	.			trans	-78.3	138.9	178.9	-65.2	175.3	0	0	0	110.3	C140 L143 E147 A150 F154	C140-L145 PolarHBondContact O-N 3.42Å; L143-L145 HydrophobicContact CB-CD1 4.17Å; L143-L145 HydrophobicContact CB-CD2 4.47Å; L143-L145 HydrophobicContact CB-CG 3.85Å; L143-L145 HydrophobicContact CD1-CD1 4.33Å; L143-L145 PolarHBondContact O-N 3.29Å; L145-E147 PolarHBondContact O-N 3.35Å; L145-A150 HydrophobicContact CB-CB 4.35Å; L145-F154 HydrophobicContact CD1-CD2 3.59Å; L145-F154 HydrophobicContact CD1-CE2 3.33Å; L145-F154 HydrophobicContact CD1-CZ 4.26Å
146	S	72.7	Confident	77.7	Confident	69 Å²	69	59.8 Å²	59.8	48%	0.483	31%	0.313	S	S	.	.			trans	-55.6	139.6	170.2	-179.1	0	0	0	0	110.5	D148 V149 A150	S146-D148 PolarHBondContact O-N 2.9Å; S146-D148 VanDerWaalsContact O-N 3.16Å; S146-V149 PolarHBondContact O-N 3.4Å; S146-A150 PolarHBondContact O-N 3.43Å
147	E	69.2	Low	77.4	Confident	175 Å²	175	60.4 Å²	60.4	82%	0.818	32%	0.319	S	S	*	.	H	α-helix	trans	-53.6	-37.1	180	-65	-170.8	166.2	0	0	112.1	L145 G151	L145-E147 PolarHBondContact O-N 3.35Å; E147-G151 PolarHBondContact O-N 2.89Å
148	D	64.1	Low	77.5	Confident	98 Å²	98	58.2 Å²	58.2	52%	0.524	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-41.8	177	-66.9	-24.4	0	0	0	112.3	S146 A152	S146-D148 PolarHBondContact O-N 2.9Å; S146-D148 VanDerWaalsContact O-N 3.16Å; D148-A152 WeakPolarHBondContact O-CB 3.3Å; D148-A152 PolarHBondContact O-N 2.92Å; D148-A152 VanDerWaalsContact O-N 3.12Å
149	V	69.1	Low	77.3	Confident	25 Å²	25	57 Å²	57	15%	0.152	31%	0.306	C	S	.	.	H	α-helix	trans	-75.1	-44.1	-179	178.3	0	0	0	0	109.9	S146 G151 A152 T153	S146-V149 PolarHBondContact O-N 3.4Å; V149-G151 VanDerWaalsContact C-N 3.34Å; V149-G151 PolarHBondContact O-N 2.94Å; V149-A152 PolarHBondContact O-N 2.73Å; V149-T153 WeakPolarHBondContact O-CB 3.45Å; V149-T153 PolarHBondContact O-N 2.91Å; V149-T153 VanDerWaalsContact O-N 3.09Å; V149-T153 PolarHBondContact O-OG1 3.21Å
150	A	72.9	Confident	77.4	Confident	11 Å²	11	56.2 Å²	56.2	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-59.6	-45.4	176.9	0	0	0	0	0	111.2	C140 L145 S146 F154 M155	C140-A150 HydrophobicContact CB-CB 4.02Å; L145-A150 HydrophobicContact CB-CB 4.35Å; S146-A150 PolarHBondContact O-N 3.43Å; A150-F154 PolarHBondContact O-N 3.13Å; A150-M155 VanDerWaalsContact O-CG 3.32Å; A150-M155 WeakPolarHBondContact O-CG 3.46Å; A150-M155 PolarHBondContact O-N 2.96Å
151	G	67.8	Low	77.7	Confident	31 Å²	31	55.9 Å²	55.9	32%	0.32	30%	0.3	S	S	.	.	I	π-helix	trans	-61.2	-49.4	177.2	0	0	0	0	0	112.9	E147 V149 T153 A156	E147-G151 PolarHBondContact O-N 2.89Å; V149-G151 VanDerWaalsContact C-N 3.34Å; V149-G151 PolarHBondContact O-N 2.94Å; G151-T153 VanDerWaalsContact C-N 3.35Å; G151-T153 PolarHBondContact O-N 2.66Å; G151-A156 PolarHBondContact O-N 3.29Å
152	A	62.8	Low	78	Confident	18 Å²	18	50.7 Å²	50.7	15%	0.149	28%	0.276	C	S	.	.	I	π-helix	trans	-79.3	-13.6	-173.4	0	0	0	0	0	115.1	D148 V149 M255	D148-A152 WeakPolarHBondContact O-CB 3.3Å; D148-A152 PolarHBondContact O-N 2.92Å; D148-A152 VanDerWaalsContact O-N 3.12Å; V149-A152 PolarHBondContact O-N 2.73Å; A152-M255 HydrophobicContact CB-CE 3.78Å; A152-M255 HydrophobicContact CB-SD 3.29Å; A152-M255 WeakPolarHBondContact CB-SD 3.46Å
153	T	75.5	Confident	78.3	Confident	8 Å²	8	43.9 Å²	43.9	5%	0.049	25%	0.247	C	C	.	.	I	π-helix	trans	-119.3	-72.9	-176.8	61.1	0	0	0	0	112.2	V149 G151 A157 I252	V149-T153 WeakPolarHBondContact O-CB 3.45Å; V149-T153 PolarHBondContact O-N 2.91Å; V149-T153 VanDerWaalsContact O-N 3.09Å; V149-T153 PolarHBondContact O-OG1 3.21Å; G151-T153 VanDerWaalsContact C-N 3.35Å; G151-T153 PolarHBondContact O-N 2.66Å; T153-A157 VanDerWaalsContact O-CB 3.23Å; T153-A157 WeakPolarHBondContact O-CB 3.39Å; T153-A157 PolarHBondContact O-N 2.9Å; T153-I252 HydrophobicContact CG2-CB 4.43Å; T153-I252 HydrophobicContact CG2-CD1 4.14Å; T153-I252 HydrophobicContact CG2-CG1 3.75Å; T153-I252 HydrophobicContact CG2-CG2 4.16Å
154	F	81.3	Confident	78.7	Confident	73 Å²	73	40.6 Å²	40.6	32%	0.32	23%	0.229	S	C	.	.	I	π-helix	trans	-67.5	-41.4	-174.9	-74.2	-81	0	0	0	112.5	L136 C140 L145 A150 G158	L136-F154 WeakPolarHBondContact CD1-O 3.33Å; L136-F154 HydrophobicContact CD2-CB 4.36Å; L136-F154 HydrophobicContact CD2-CD1 3.93Å; C140-F154 VanDerWaalsContact SG-CB 3.56Å; L145-F154 HydrophobicContact CD1-CD2 3.59Å; L145-F154 HydrophobicContact CD1-CE2 3.33Å; L145-F154 HydrophobicContact CD1-CZ 4.26Å; A150-F154 PolarHBondContact O-N 3.13Å; F154-G158 PolarHBondContact O-N 3.3Å
155	M	79.1	Confident	79.2	Confident	52 Å²	52	35 Å²	35	26%	0.256	20%	0.198	S	C	.	.	I	π-helix	trans	-73.2	-37.4	179.9	-58.8	-64.6	-94.9	0	0	111.6	V133 E137 A150 G158 S159	V133-M155 HydrophobicContact CG1-CE 4.09Å; V133-M155 HydrophobicContact CG1-SD 4.32Å; E137-M155 HydrophobicContact CG-CE 3.35Å; E137-M155 HydrophobicContact CG-SD 3.84Å; E137-M155 WeakPolarHBondContact OE1-CE 3.29Å; A150-M155 VanDerWaalsContact O-CG 3.32Å; A150-M155 WeakPolarHBondContact O-CG 3.46Å; A150-M155 PolarHBondContact O-N 2.96Å; M155-G158 VanDerWaalsContact O-CA 3.31Å; M155-G158 WeakPolarHBondContact O-CA 3.34Å; M155-G158 PolarHBondContact O-N 3.5Å; M155-G158 VanDerWaalsContact O-N 3.12Å; M155-S159 PolarHBondContact O-N 2.81Å
156	A	77.9	Confident	80	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-43.2	171.7	0	0	0	0	0	112.2	G151 G158 S159 S160	G151-A156 PolarHBondContact O-N 3.29Å; A156-G158 PolarHBondContact O-N 3.37Å; A156-S159 PolarHBondContact O-N 2.94Å; A156-S159 PolarHBondContact O-OG 3.1Å; A156-S160 WeakPolarHBondContact O-CB 3.37Å; A156-S160 PolarHBondContact O-N 3.33Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.02Å
157	A	82.2	Confident	81	Confident	20 Å²	20	29 Å²	29	17%	0.165	16%	0.161	C	C	.	.	H	α-helix	trans	-62.6	-30.3	171.2	0	0	0	0	0	112.1	T153 A161 F500	T153-A157 VanDerWaalsContact O-CB 3.23Å; T153-A157 WeakPolarHBondContact O-CB 3.39Å; T153-A157 PolarHBondContact O-N 2.9Å; A157-A161 PolarHBondContact O-N 2.95Å; A157-F500 HydrophobicContact CB-CD2 3.93Å; A157-F500 HydrophobicContact CB-CE1 4.22Å; A157-F500 HydrophobicContact CB-CE2 3.42Å; A157-F500 VanDerWaalsContact CB-CE2 3.42Å; A157-F500 HydrophobicContact CB-CZ 3.58Å
158	G	85.6	Confident	82.1	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-54.9	-55	172.1	0	0	0	0	0	113.4	L136 F154 M155 A156	L136-G158 VanDerWaalsContact CD1-CA 3.47Å; F154-G158 PolarHBondContact O-N 3.3Å; M155-G158 VanDerWaalsContact O-CA 3.31Å; M155-G158 WeakPolarHBondContact O-CA 3.34Å; M155-G158 PolarHBondContact O-N 3.5Å; M155-G158 VanDerWaalsContact O-N 3.12Å; A156-G158 PolarHBondContact O-N 3.37Å
159	S	82.5	Confident	83.4	Confident	17 Å²	17	18.3 Å²	18.3	12%	0.119	11%	0.11	C	C	.	.	H	α-helix	trans	-67.1	-39.6	178.5	41.4	0	0	0	0	112.5	M155 A156 A161 P162 D474	M155-S159 PolarHBondContact O-N 2.81Å; A156-S159 PolarHBondContact O-N 2.94Å; A156-S159 PolarHBondContact O-OG 3.1Å; S159-A161 VanDerWaalsContact C-N 3.31Å; S159-A161 PolarHBondContact O-N 2.88Å; S159-P162 VanDerWaalsContact O-CD 3.32Å; S159-P162 WeakPolarHBondContact O-CD 3.43Å; S159-D474 WeakPolarHBondContact CB-OD1 3.4Å
160	S	89.6	Confident	84.3	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	0.3	-175.6	-70.2	0	0	0	0	115.4	A156 E163 L164 S497 F500 D501	A156-S160 WeakPolarHBondContact O-CB 3.37Å; A156-S160 PolarHBondContact O-N 3.33Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.02Å; S160-E163 WeakPolarHBondContact O-CB 3.39Å; S160-E163 PolarHBondContact O-N 2.86Å; S160-E163 VanDerWaalsContact O-N 3.16Å; S160-L164 PolarHBondContact O-N 3.36Å; S160-S497 WeakPolarHBondContact OG-CB 3.46Å; S160-F500 VanDerWaalsContact CB-CD1 3.44Å; S160-D501 WeakPolarHBondContact CB-OD1 3.37Å; S160-D501 PolarHBondContact OG-OD1 3.11Å
161	A	90.3	Very high	85	Confident	3 Å²	3	17.1 Å²	17.1	3%	0.025	10%	0.102	C	C	.	.	H	α-helix	trans	-58.5	-44.1	-177.1	0	0	0	0	0	114.2	F132 A157 S159 E163 L164 F165 I436	F132-A161 HydrophobicContact CD1-CB 3.92Å; F132-A161 HydrophobicContact CE1-CB 3.41Å; F132-A161 VanDerWaalsContact CE1-CB 3.41Å; F132-A161 HydrophobicContact CZ-CB 4.03Å; A157-A161 PolarHBondContact O-N 2.95Å; S159-A161 VanDerWaalsContact C-N 3.31Å; S159-A161 PolarHBondContact O-N 2.88Å; A161-E163 PolarHBondContact O-N 2.73Å; A161-L164 PolarHBondContact O-N 3.24Å; A161-F165 WeakPolarHBondContact O-CD2 3.41Å; A161-F165 PolarHBondContact O-N 3Å; A161-I436 HydrophobicContact CB-CD1 4.22Å; A161-I436 HydrophobicContact CB-CG2 4.47Å
162	P	90.5	Very high	86	Confident	7 Å²	7	18.3 Å²	18.3	5%	0.045	10%	0.099	C	C	.	.	H	α-helix	trans	-56.1	-37.7	175.7	-26.7	36.8	0	0	0	113.3	L124 C128 S159 F165 A166 S440 T470	L124-P162 HydrophobicContact CD1-CB 4.42Å; L124-P162 HydrophobicContact CD2-CB 4.36Å; C128-P162 WeakPolarHBondContact SG-CG 3.43Å; S159-P162 VanDerWaalsContact O-CD 3.32Å; S159-P162 WeakPolarHBondContact O-CD 3.43Å; P162-F165 PolarHBondContact O-N 3.5Å; P162-A166 WeakPolarHBondContact O-CB 3.33Å; P162-A166 PolarHBondContact O-N 3.45Å; P162-S440 PolarHBondContact O-OG 3.11Å; P162-T470 HydrophobicContact CB-CG2 3.96Å
163	E	91.8	Very high	87.2	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-74.2	-44.2	-176.3	-61.7	167.5	161.4	0	0	110.7	S160 A161 F165 A166 S167 I183 S186 T470 S471	S160-E163 WeakPolarHBondContact O-CB 3.39Å; S160-E163 PolarHBondContact O-N 2.86Å; S160-E163 VanDerWaalsContact O-N 3.16Å; A161-E163 PolarHBondContact O-N 2.73Å; E163-F165 VanDerWaalsContact C-N 3.31Å; E163-F165 PolarHBondContact O-N 3.11Å; E163-A166 PolarHBondContact O-N 3.06Å; E163-S167 WeakPolarHBondContact O-CB 3.22Å; E163-S167 PolarHBondContact O-N 3.37Å; E163-I183 HydrophobicContact CB-CD1 4.01Å; E163-S186 VanDerWaalsContact OE1-CB 3.32Å; E163-S186 WeakPolarHBondContact OE1-CB 3.43Å; E163-S186 PolarHBondContact OE1-OG 2.96Å; E163-S186 PolarHBondContact OE2-OG 2.88Å; E163-T470 HydrophobicContact CG-CG2 4.38Å; E163-T470 WeakPolarHBondContact CG-OG1 3.25Å; E163-T470 PolarHBondContact OE1-OG1 2.93Å; E163-S471 PolarHBondContact OE1-OG 3.46Å
164	L	92.4	Very high	87.4	Confident	33 Å²	33	19.9 Å²	19.9	17%	0.173	10%	0.104	C	C	.	.	H	α-helix	trans	-53.8	-48.7	169.5	172.9	66.2	0	0	0	110.8	S160 A161 S167 V168 F500 P509	S160-L164 PolarHBondContact O-N 3.36Å; A161-L164 PolarHBondContact O-N 3.24Å; L164-S167 WeakPolarHBondContact O-CB 3.48Å; L164-S167 PolarHBondContact O-N 3.24Å; L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.2Å; L164-V168 PolarHBondContact O-N 3.41Å; L164-F500 HydrophobicContact CD2-CZ 4.36Å; L164-P509 HydrophobicContact CD1-CG 4.42Å
165	F	92.8	Very high	87.3	Confident	37 Å²	37	21.9 Å²	21.9	16%	0.162	11%	0.114	C	C	.	.	H	α-helix	trans	-69	-37.8	179.7	-79.6	-68	0	0	0	113	A161 P162 E163 S167 V168 I169 T433 I436 A437	A161-F165 WeakPolarHBondContact O-CD2 3.41Å; A161-F165 PolarHBondContact O-N 3Å; P162-F165 PolarHBondContact O-N 3.5Å; E163-F165 VanDerWaalsContact C-N 3.31Å; E163-F165 PolarHBondContact O-N 3.11Å; F165-S167 VanDerWaalsContact C-N 3.26Å; F165-S167 PolarHBondContact O-N 3.49Å; F165-V168 WeakPolarHBondContact O-CB 3.38Å; F165-V168 PolarHBondContact O-N 2.99Å; F165-I169 VanDerWaalsContact O-CD1 3.26Å; F165-I169 WeakPolarHBondContact O-CD1 3.49Å; F165-I169 VanDerWaalsContact O-CG1 3.29Å; F165-I169 WeakPolarHBondContact O-CG1 3.11Å; F165-I169 PolarHBondContact O-N 3.08Å; F165-T433 HydrophobicContact CE2-CG2 3.84Å; F165-T433 HydrophobicContact CZ-CG2 3.42Å; F165-T433 VanDerWaalsContact CZ-CG2 3.42Å; F165-I436 HydrophobicContact CD2-CB 4.17Å; F165-I436 HydrophobicContact CD2-CG2 3.45Å; F165-I436 VanDerWaalsContact CD2-CG2 3.45Å; F165-I436 HydrophobicContact CE2-CB 4.36Å; F165-I436 HydrophobicContact CE2-CG2 4.05Å; F165-I436 HydrophobicContact CG-CG2 4.28Å; F165-A437 HydrophobicContact CD1-CB 3.58Å; F165-A437 HydrophobicContact CE1-CB 3.66Å; F165-A437 HydrophobicContact CG-CB 4.16Å; F165-A437 HydrophobicContact CZ-CB 4.3Å
166	A	90.9	Very high	87.1	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-59.7	-39	173.3	0	0	0	0	0	111.5	P162 E163 I169 G170 T182 M443 V444 L466	P162-A166 WeakPolarHBondContact O-CB 3.33Å; P162-A166 PolarHBondContact O-N 3.45Å; E163-A166 PolarHBondContact O-N 3.06Å; A166-I169 PolarHBondContact O-N 3.29Å; A166-G170 PolarHBondContact O-N 3.47Å; A166-T182 HydrophobicContact CB-CG2 4.13Å; A166-M443 HydrophobicContact CB-CE 4.26Å; A166-V444 HydrophobicContact CB-CG2 4.31Å; A166-L466 HydrophobicContact CB-CD2 4.26Å
167	S	91.9	Very high	87.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.5	-45.5	173.2	177.8	0	0	0	0	112.7	E163 L164 F165 I169 G170 V171 G505	E163-S167 WeakPolarHBondContact O-CB 3.22Å; E163-S167 PolarHBondContact O-N 3.37Å; L164-S167 WeakPolarHBondContact O-CB 3.48Å; L164-S167 PolarHBondContact O-N 3.24Å; F165-S167 VanDerWaalsContact C-N 3.26Å; F165-S167 PolarHBondContact O-N 3.49Å; S167-I169 VanDerWaalsContact C-N 3.32Å; S167-I169 PolarHBondContact O-N 3.42Å; S167-G170 WeakPolarHBondContact O-CA 3.03Å; S167-G170 PolarHBondContact O-N 3.03Å; S167-G170 VanDerWaalsContact O-N 3.1Å; S167-V171 WeakPolarHBondContact O-CG2 3.29Å; S167-V171 PolarHBondContact O-N 2.99Å; S167-G505 WeakPolarHBondContact CB-O 3.12Å; S167-G505 PolarHBondContact OG-O 3.45Å
168	V	92.8	Very high	87.7	Confident	37 Å²	37	20 Å²	20	22%	0.224	11%	0.106	C	C	.	.	H	α-helix	trans	-55.4	-48.5	174.2	171.3	0	0	0	0	110.4	L164 F165 G170 V171 F172 P509	L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.2Å; L164-V168 PolarHBondContact O-N 3.41Å; F165-V168 WeakPolarHBondContact O-CB 3.38Å; F165-V168 PolarHBondContact O-N 2.99Å; V168-G170 VanDerWaalsContact C-N 3.3Å; V168-G170 PolarHBondContact O-N 3.01Å; V168-V171 PolarHBondContact O-N 3.39Å; V168-F172 HydrophobicContact CG1-CD2 3.72Å; V168-F172 HydrophobicContact CG1-CE2 4.2Å; V168-F172 WeakPolarHBondContact O-CB 3.24Å; V168-F172 VanDerWaalsContact O-CD2 3.3Å; V168-F172 WeakPolarHBondContact O-CD2 3.36Å; V168-F172 PolarHBondContact O-N 3.46Å; V168-P509 HydrophobicContact CG2-CB 4.32Å; V168-P509 HydrophobicContact CG2-CG 3.67Å
169	I	91.1	Very high	87.8	Confident	10 Å²	10	20 Å²	20	5%	0.051	11%	0.106	C	C	.	.	H	α-helix	trans	-62.4	-40.5	178.2	-67.5	153.1	0	0	0	110.6	F95 F165 A166 S167 V171 I173 T174 Y441 V444	F95-I169 HydrophobicContact CZ-CG2 4.46Å; F165-I169 VanDerWaalsContact O-CD1 3.26Å; F165-I169 WeakPolarHBondContact O-CD1 3.49Å; F165-I169 VanDerWaalsContact O-CG1 3.29Å; F165-I169 WeakPolarHBondContact O-CG1 3.11Å; F165-I169 PolarHBondContact O-N 3.08Å; A166-I169 PolarHBondContact O-N 3.29Å; S167-I169 VanDerWaalsContact C-N 3.32Å; S167-I169 PolarHBondContact O-N 3.42Å; I169-V171 VanDerWaalsContact C-N 3.32Å; I169-V171 PolarHBondContact O-N 3.38Å; I169-I173 HydrophobicContact CG1-CD1 4.3Å; I169-I173 HydrophobicContact CG2-CB 4.23Å; I169-I173 HydrophobicContact CG2-CD1 4.12Å; I169-I173 WeakPolarHBondContact O-CA 3.49Å; I169-I173 WeakPolarHBondContact O-CB 3.42Å; I169-I173 PolarHBondContact O-N 3.34Å; I169-T174 PolarHBondContact O-N 2.84Å; I169-Y441 HydrophobicContact CG2-CD2 4.41Å; I169-V444 HydrophobicContact CB-CG2 4.47Å; I169-V444 HydrophobicContact CD1-CG2 4.38Å; I169-V444 HydrophobicContact CG2-CB 4.09Å; I169-V444 HydrophobicContact CG2-CG1 4.06Å; I169-V444 HydrophobicContact CG2-CG2 4.12Å
170	G	88.1	Confident	88.2	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-55.3	-44	175.4	0	0	0	0	0	113.9	A166 S167 V168 T174 H175 G176	A166-G170 PolarHBondContact O-N 3.47Å; S167-G170 WeakPolarHBondContact O-CA 3.03Å; S167-G170 PolarHBondContact O-N 3.03Å; S167-G170 VanDerWaalsContact O-N 3.1Å; V168-G170 VanDerWaalsContact C-N 3.3Å; V168-G170 PolarHBondContact O-N 3.01Å; G170-T174 VanDerWaalsContact CA-OG1 3.27Å; G170-T174 WeakPolarHBondContact CA-OG1 3.39Å; G170-T174 PolarHBondContact O-OG1 3.38Å; G170-H175 PolarHBondContact O-N 3.44Å; G170-G176 PolarHBondContact O-N 3.17Å
171	V	89.1	Confident	88.2	Confident	11 Å²	11	19.5 Å²	19.5	7%	0.067	10%	0.103	C	C	.	.	H	α-helix	trans	-80.2	-42.5	-176.7	174.8	0	0	0	0	112.5	S167 V168 I169 H175 P509 Q513	S167-V171 WeakPolarHBondContact O-CG2 3.29Å; S167-V171 PolarHBondContact O-N 2.99Å; V168-V171 PolarHBondContact O-N 3.39Å; I169-V171 VanDerWaalsContact C-N 3.32Å; I169-V171 PolarHBondContact O-N 3.38Å; V171-H175 PolarHBondContact O-ND1 2.91Å; V171-P509 HydrophobicContact CB-CB 4.25Å; V171-P509 HydrophobicContact CG2-CB 3.96Å; V171-Q513 HydrophobicContact CG1-CB 3.81Å; V171-Q513 HydrophobicContact CG1-CG 4.05Å
172	F	88.8	Confident	88.3	Confident	57 Å²	57	19.4 Å²	19.4	25%	0.25	10%	0.101	C	C	.	.	H	α-helix	trans	-92.3	-25.7	-171.6	-76.3	-73.1	0	0	0	115	V168 L512 Q513 V517	V168-F172 HydrophobicContact CG1-CD2 3.72Å; V168-F172 HydrophobicContact CG1-CE2 4.2Å; V168-F172 WeakPolarHBondContact O-CB 3.24Å; V168-F172 VanDerWaalsContact O-CD2 3.3Å; V168-F172 WeakPolarHBondContact O-CD2 3.36Å; V168-F172 PolarHBondContact O-N 3.46Å; F172-L512 HydrophobicContact CE2-CB 4.19Å; F172-L512 HydrophobicContact CZ-CB 3.69Å; F172-Q513 HydrophobicContact CE1-CB 4.09Å; F172-Q513 HydrophobicContact CZ-CB 4.08Å; F172-V517 HydrophobicContact CE1-CB 4.31Å; F172-V517 HydrophobicContact CE1-CG2 3.6Å; F172-V517 HydrophobicContact CZ-CG2 4.32Å
173	I	86.8	Confident	88.4	Confident	57 Å²	57	19 Å²	19	29%	0.292	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-47	-171.1	-66.3	168.5	0	0	0	111.8	E94 F95 I169 Y441	E94-I173 WeakPolarHBondContact CB-O 3.37Å; F95-I173 HydrophobicContact CD1-CG2 4.38Å; F95-I173 HydrophobicContact CE1-CG2 3.93Å; F95-I173 HydrophobicContact CZ-CG2 4.29Å; I169-I173 HydrophobicContact CG1-CD1 4.3Å; I169-I173 HydrophobicContact CG2-CB 4.23Å; I169-I173 HydrophobicContact CG2-CD1 4.12Å; I169-I173 WeakPolarHBondContact O-CA 3.49Å; I169-I173 WeakPolarHBondContact O-CB 3.42Å; I169-I173 PolarHBondContact O-N 3.34Å; I173-Y441 HydrophobicContact CD1-CD2 3.62Å; I173-Y441 HydrophobicContact CD1-CE2 3.77Å; I173-Y441 HydrophobicContact CG2-CE2 4.18Å
174	T	80.3	Confident	88.4	Confident	2 Å²	2	19.1 Å²	19.1	1%	0.012	10%	0.1	C	C	.	.	S	Bend	trans	-97	-1.1	-174.7	64.3	0	0	0	0	114	E94 F95 I169 G170 G176 V444	E94-T174 VanDerWaalsContact CD-C 3.47Å; E94-T174 WeakPolarHBondContact OE2-CA 3.28Å; F95-T174 HydrophobicContact CD2-CG2 4.38Å; F95-T174 HydrophobicContact CE1-CG2 4.37Å; F95-T174 HydrophobicContact CE2-CG2 3.29Å; F95-T174 HydrophobicContact CZ-CG2 3.27Å; I169-T174 PolarHBondContact O-N 2.84Å; G170-T174 VanDerWaalsContact CA-OG1 3.27Å; G170-T174 WeakPolarHBondContact CA-OG1 3.39Å; G170-T174 PolarHBondContact O-OG1 3.38Å; T174-G176 VanDerWaalsContact O-CA 3.28Å; T174-G176 WeakPolarHBondContact O-CA 3.44Å; T174-G176 PolarHBondContact O-N 3.43Å; T174-V444 HydrophobicContact CG2-CG1 4.39Å
175	H	78.9	Confident	88.4	Confident	114 Å²	114	17.6 Å²	17.6	53%	0.528	9%	0.092	S	C	.	.			trans	35.2	41.7	-176.5	-66.1	-59.3	0	0	0	114.2	E94 G170 V171 N526	E94-H175 IonicContact OE2-CD2 2.82Å; E94-H175 IonicContact OE2-CG 2.6Å; E94-H175 PolarHBondContact OE2-N 2.76Å; G170-H175 PolarHBondContact O-N 3.44Å; V171-H175 PolarHBondContact O-ND1 2.91Å; H175-N526 PolarHBondContact O-ND2 3.47Å
176	G	75	Confident	88.4	Confident	17 Å²	17	15.8 Å²	15.8	18%	0.175	8%	0.084	C	C	.	.	S	Bend	trans	-148.7	162.4	-157.2	0	0	0	0	0	111.8	G170 T174 V178	G170-G176 PolarHBondContact O-N 3.17Å; T174-G176 VanDerWaalsContact O-CA 3.28Å; T174-G176 WeakPolarHBondContact O-CA 3.44Å; T174-G176 PolarHBondContact O-N 3.43Å; G176-V178 PolarHBondContact O-N 2.76Å
177	D	85.6	Confident	88.5	Confident	13 Å²	13	15.8 Å²	15.8	7%	0.07	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	3	-169.3	-62.4	-28.5	0	0	0	113.6	G179 V180 G181 V459 N526 S527	D177-G179 VanDerWaalsContact C-N 3.3Å; D177-G179 PolarHBondContact O-N 2.96Å; D177-V180 PolarHBondContact O-N 3.02Å; D177-G181 PolarHBondContact O-N 2.96Å; D177-V459 HydrophobicContact CB-CG2 3.57Å; D177-N526 PolarHBondContact OD1-N 3.42Å; D177-N526 VanDerWaalsContact OD1-N 3.15Å; D177-N526 WeakPolarHBondContact OD2-CA 3.32Å; D177-N526 WeakPolarHBondContact OD2-CB 3.48Å; D177-N526 PolarHBondContact OD2-N 3.43Å; D177-S527 WeakPolarHBondContact OD2-CB 3.43Å; D177-S527 PolarHBondContact OD2-N 3.43Å
178	V	87.1	Confident	88.5	Confident	4 Å²	4	15.8 Å²	15.8	2%	0.024	8%	0.084	C	C	.	.	H	α-helix	trans	-57.1	-44.4	177	-179.8	0	0	0	0	111.2	G176 T182 V444 T448 D458 L466	G176-V178 PolarHBondContact O-N 2.76Å; V178-T182 WeakPolarHBondContact O-CB 3.26Å; V178-T182 PolarHBondContact O-N 3.37Å; V178-T182 PolarHBondContact O-OG1 3.02Å; V178-V444 HydrophobicContact CG1-CG1 4.19Å; V178-T448 HydrophobicContact CG2-CG2 4.43Å; V178-D458 HydrophobicContact CG2-CB 3.55Å; V178-L466 HydrophobicContact CG1-CD2 4.21Å
179	G	88.3	Confident	88.5	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.01	7%	0.074	C	C	.	.	H	α-helix	trans	-62.8	-50.4	-179.1	0	0	0	0	0	111.5	D177 T182 I183	D177-G179 VanDerWaalsContact C-N 3.3Å; D177-G179 PolarHBondContact O-N 2.96Å; G179-T182 WeakPolarHBondContact O-CB 3.12Å; G179-T182 PolarHBondContact O-N 3.19Å; G179-I183 PolarHBondContact O-N 2.99Å
180	V	89.6	Confident	88.5	Confident	6 Å²	6	13.7 Å²	13.7	4%	0.036	7%	0.071	C	C	.	.	H	α-helix	trans	-66.8	-41.4	179.7	-164.1	0	0	0	0	111.5	D177 T182 I183 V184 I231 L506 W510 L530	D177-V180 PolarHBondContact O-N 3.02Å; V180-T182 VanDerWaalsContact C-N 3.28Å; V180-T182 PolarHBondContact O-N 3.21Å; V180-I183 PolarHBondContact O-N 3.42Å; V180-V184 HydrophobicContact CG1-CG2 4.31Å; V180-V184 WeakPolarHBondContact O-CG2 3.32Å; V180-V184 PolarHBondContact O-N 3.31Å; V180-I231 HydrophobicContact CG1-CD1 4.44Å; V180-L506 HydrophobicContact CB-CD2 4.14Å; V180-L506 HydrophobicContact CG1-CD1 4.02Å; V180-L506 HydrophobicContact CG1-CD2 3.85Å; V180-L506 HydrophobicContact CG2-CD2 4.07Å; V180-W510 HydrophobicContact CG1-CZ2 4.24Å; V180-W510 HydrophobicContact CG2-CZ2 3.78Å; V180-L530 HydrophobicContact CB-CD1 4.36Å; V180-L530 HydrophobicContact CB-CD2 3.8Å; V180-L530 HydrophobicContact CG1-CD1 4.2Å; V180-L530 HydrophobicContact CG1-CD2 3.63Å; V180-L530 HydrophobicContact CG1-CG 4.32Å; V180-L530 HydrophobicContact CG2-CD2 4.45Å
181	G	90.1	Very high	88.7	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-57.8	-40	173.8	0	0	0	0	0	112.3	D177 V184 G185 I463	D177-G181 PolarHBondContact O-N 2.96Å; G181-V184 PolarHBondContact O-N 2.9Å; G181-G185 PolarHBondContact O-N 2.84Å; G181-I463 VanDerWaalsContact O-CA 3.3Å; G181-I463 WeakPolarHBondContact O-CA 3.47Å; G181-I463 VanDerWaalsContact O-CG2 3.28Å; G181-I463 WeakPolarHBondContact O-CG2 3.46Å
182	T	92.3	Very high	88.9	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.9	-44.1	177.2	-56.4	0	0	0	0	112	A166 V178 G179 V180 S186 L466	A166-T182 HydrophobicContact CB-CG2 4.13Å; V178-T182 WeakPolarHBondContact O-CB 3.26Å; V178-T182 PolarHBondContact O-N 3.37Å; V178-T182 PolarHBondContact O-OG1 3.02Å; G179-T182 WeakPolarHBondContact O-CB 3.12Å; G179-T182 PolarHBondContact O-N 3.19Å; V180-T182 VanDerWaalsContact C-N 3.28Å; V180-T182 PolarHBondContact O-N 3.21Å; T182-S186 WeakPolarHBondContact O-CB 3.32Å; T182-S186 PolarHBondContact O-N 3.25Å; T182-L466 HydrophobicContact CG2-CB 4.04Å; T182-L466 HydrophobicContact CG2-CD2 3.94Å; T182-L466 HydrophobicContact CG2-CG 4.13Å; T182-L466 WeakPolarHBondContact OG1-CD2 3.47Å
183	I	92.9	Very high	89	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-63.9	-49.3	176.9	-63.8	-61.4	0	0	0	111.3	E163 G179 V180 G185 S186 A187 D501 I502 L506	E163-I183 HydrophobicContact CB-CD1 4.01Å; G179-I183 PolarHBondContact O-N 2.99Å; V180-I183 PolarHBondContact O-N 3.42Å; I183-G185 VanDerWaalsContact C-N 3.35Å; I183-G185 PolarHBondContact O-N 2.99Å; I183-S186 PolarHBondContact O-N 3.04Å; I183-A187 WeakPolarHBondContact O-CB 3.31Å; I183-A187 PolarHBondContact O-N 3.21Å; I183-D501 HydrophobicContact CD1-CB 4.17Å; I183-D501 HydrophobicContact CG2-CB 3.93Å; I183-D501 WeakPolarHBondContact CG2-O 3.17Å; I183-I502 HydrophobicContact CG2-CG1 4.33Å; I183-L506 HydrophobicContact CB-CD1 4.41Å; I183-L506 HydrophobicContact CB-CD2 3.95Å; I183-L506 HydrophobicContact CB-CG 4.17Å; I183-L506 HydrophobicContact CG1-CD2 3.67Å; I183-L506 HydrophobicContact CG1-CG 4.09Å; I183-L506 HydrophobicContact CG2-CD1 3.94Å; I183-L506 HydrophobicContact CG2-CD2 4.26Å; I183-L506 HydrophobicContact CG2-CG 3.9Å
184	V	92.3	Very high	89.2	Confident	1 Å²	1	8.2 Å²	8.2	1%	0.006	5%	0.045	C	C	.	.	H	α-helix	trans	-63.2	-43.7	-179.7	175.8	0	0	0	0	110.6	V180 G181 A187 V188 L530 V534 L537	V180-V184 HydrophobicContact CG1-CG2 4.31Å; V180-V184 WeakPolarHBondContact O-CG2 3.32Å; V180-V184 PolarHBondContact O-N 3.31Å; G181-V184 PolarHBondContact O-N 2.9Å; V184-A187 PolarHBondContact O-N 2.89Å; V184-V188 VanDerWaalsContact O-CG2 3.32Å; V184-V188 WeakPolarHBondContact O-CG2 3.47Å; V184-V188 PolarHBondContact O-N 3.32Å; V184-V188 VanDerWaalsContact O-N 3.14Å; V184-L530 HydrophobicContact CG2-CD1 4.49Å; V184-V534 HydrophobicContact CG1-CG2 4.12Å; V184-V534 HydrophobicContact CG2-CG2 3.65Å; V184-L537 HydrophobicContact CG1-CD2 4.33Å
185	G	92.4	Very high	89.7	Confident	1 Å²	1	8.3 Å²	8.3	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-62.2	-44.4	176.8	0	0	0	0	0	112.9	G181 I183 A187 V188 F189 I463	G181-G185 PolarHBondContact O-N 2.84Å; I183-G185 VanDerWaalsContact C-N 3.35Å; I183-G185 PolarHBondContact O-N 2.99Å; G185-A187 VanDerWaalsContact C-N 3.32Å; G185-A187 PolarHBondContact O-N 3.32Å; G185-V188 PolarHBondContact O-N 3.42Å; G185-F189 WeakPolarHBondContact O-CB 3.31Å; G185-F189 PolarHBondContact O-N 2.92Å; G185-I463 WeakPolarHBondContact CA-O 3.26Å
186	S	92.1	Very high	90.3	Very high	0 Å²	0	2.9 Å²	2.9	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-61.5	-43.6	176.5	171	0	0	0	0	110.4	E163 T182 I183 V188 F189 N190 A467 S471	E163-S186 VanDerWaalsContact OE1-CB 3.32Å; E163-S186 WeakPolarHBondContact OE1-CB 3.43Å; E163-S186 PolarHBondContact OE1-OG 2.96Å; E163-S186 PolarHBondContact OE2-OG 2.88Å; T182-S186 WeakPolarHBondContact O-CB 3.32Å; T182-S186 PolarHBondContact O-N 3.25Å; I183-S186 PolarHBondContact O-N 3.04Å; S186-V188 VanDerWaalsContact C-N 3.28Å; S186-V188 PolarHBondContact O-N 3.37Å; S186-F189 CarbonylContact O-C 3.46Å; S186-F189 WeakPolarHBondContact O-CA 3.43Å; S186-F189 WeakPolarHBondContact O-CB 3.41Å; S186-F189 PolarHBondContact O-N 3.2Å; S186-N190 VanDerWaalsContact O-CB 3.28Å; S186-N190 WeakPolarHBondContact O-CB 3.39Å; S186-N190 VanDerWaalsContact O-CG 3.25Å; S186-N190 PolarHBondContact O-N 3.48Å; S186-N190 PolarHBondContact OG-ND2 2.87Å; S186-A467 VanDerWaalsContact N-CB 3.28Å; S186-S471 PolarHBondContact OG-OG 3.14Å
187	A	92.8	Very high	91	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-60.6	-39	179.9	0	0	0	0	0	112.5	I183 V184 G185 I191 Y220 N498 L537	I183-A187 WeakPolarHBondContact O-CB 3.31Å; I183-A187 PolarHBondContact O-N 3.21Å; V184-A187 PolarHBondContact O-N 2.89Å; G185-A187 VanDerWaalsContact C-N 3.32Å; G185-A187 PolarHBondContact O-N 3.32Å; A187-I191 WeakPolarHBondContact O-CG1 3.47Å; A187-I191 PolarHBondContact O-N 2.89Å; A187-I191 VanDerWaalsContact O-N 3.08Å; A187-Y220 VanDerWaalsContact CB-OH 3.27Å; A187-Y220 WeakPolarHBondContact CB-OH 3.47Å; A187-N498 HydrophobicContact CB-CB 4.41Å; A187-N498 PolarHBondContact O-ND2 3.25Å; A187-N498 VanDerWaalsContact O-ND2 3.09Å; A187-L537 HydrophobicContact CB-CD1 4.39Å; A187-L537 HydrophobicContact CB-CD2 4.16Å
188	V	92.8	Very high	91.1	Very high	1 Å²	1	2.9 Å²	2.9	1%	0.006	2%	0.017	C	C	.	.	H	α-helix	trans	-68.7	-44.2	172.9	178.2	0	0	0	0	111.5	V184 G185 S186 N190 I191 L192 L537 Y567 F570	V184-V188 VanDerWaalsContact O-CG2 3.32Å; V184-V188 WeakPolarHBondContact O-CG2 3.47Å; V184-V188 PolarHBondContact O-N 3.32Å; V184-V188 VanDerWaalsContact O-N 3.14Å; G185-V188 PolarHBondContact O-N 3.42Å; S186-V188 VanDerWaalsContact C-N 3.28Å; S186-V188 PolarHBondContact O-N 3.37Å; V188-N190 VanDerWaalsContact C-N 3.27Å; V188-N190 PolarHBondContact O-N 2.88Å; V188-I191 PolarHBondContact O-N 3.09Å; V188-L192 HydrophobicContact CG1-CD1 3.6Å; V188-L192 HydrophobicContact CG1-CG 4.23Å; V188-L192 WeakPolarHBondContact O-CB 3.35Å; V188-L192 PolarHBondContact O-N 3.12Å; V188-L537 HydrophobicContact CB-CD1 4.37Å; V188-L537 HydrophobicContact CG2-CB 4.05Å; V188-L537 HydrophobicContact CG2-CD1 3.45Å; V188-L537 VanDerWaalsContact CG2-CD1 3.45Å; V188-L537 HydrophobicContact CG2-CG 4.24Å; V188-Y567 HydrophobicContact CG1-CD2 3.98Å; V188-Y567 HydrophobicContact CG1-CE2 4.14Å; V188-F570 HydrophobicContact CB-CD1 4.4Å; V188-F570 HydrophobicContact CB-CE1 4.08Å; V188-F570 HydrophobicContact CB-CZ 4.3Å; V188-F570 HydrophobicContact CG1-CD1 3.52Å; V188-F570 HydrophobicContact CG1-CD2 4.29Å; V188-F570 HydrophobicContact CG1-CE1 3.69Å; V188-F570 HydrophobicContact CG1-CE2 4.42Å; V188-F570 HydrophobicContact CG1-CG 3.86Å; V188-F570 HydrophobicContact CG1-CZ 4.16Å; V188-F570 HydrophobicContact CG2-CD1 4.33Å; V188-F570 HydrophobicContact CG2-CD2 4.42Å; V188-F570 HydrophobicContact CG2-CE1 3.72Å; V188-F570 HydrophobicContact CG2-CE2 3.8Å; V188-F570 HydrophobicContact CG2-CZ 3.44Å; V188-F570 VanDerWaalsContact CG2-CZ 3.44Å
189	F	92.5	Very high	91.2	Very high	2 Å²	2	3 Å²	3	1%	0.009	2%	0.02	C	C	.	.	I	π-helix	trans	-58	-43.6	177.6	-172.3	-86.8	0	0	0	111.2	F36 G185 S186 C193 I194 A468 V472 C475 Y567	F36-F189 HydrophobicContact CD1-CE2 4.49Å; F36-F189 AromaticContact CE1-CE2 3.46Å; F36-F189 HydrophobicContact CE1-CE2 3.46Å; F36-F189 VanDerWaalsContact CE1-CE2 3.46Å; F36-F189 HydrophobicContact CE1-CZ 4Å; F36-F189 AromaticContact CZ-CE2 3.57Å; F36-F189 HydrophobicContact CZ-CE2 3.57Å; F36-F189 HydrophobicContact CZ-CZ 4.16Å; G185-F189 WeakPolarHBondContact O-CB 3.31Å; G185-F189 PolarHBondContact O-N 2.92Å; S186-F189 CarbonylContact O-C 3.46Å; S186-F189 WeakPolarHBondContact O-CA 3.43Å; S186-F189 WeakPolarHBondContact O-CB 3.41Å; S186-F189 PolarHBondContact O-N 3.2Å; F189-C193 HydrophobicContact CD1-CB 4.14Å; F189-C193 HydrophobicContact CD2-CB 3.78Å; F189-C193 HydrophobicContact CE1-CB 4.15Å; F189-C193 HydrophobicContact CE2-CB 3.75Å; F189-C193 HydrophobicContact CG-CB 3.97Å; F189-C193 HydrophobicContact CZ-CB 3.96Å; F189-C193 VanDerWaalsContact O-CA 3.25Å; F189-C193 WeakPolarHBondContact O-CA 3.33Å; F189-C193 WeakPolarHBondContact O-CB 3.13Å; F189-C193 PolarHBondContact O-N 3.44Å; F189-I194 HydrophobicContact CD1-CG1 4.15Å; F189-I194 HydrophobicContact CE1-CG1 4.13Å; F189-I194 PolarHBondContact O-N 3.12Å; F189-A468 HydrophobicContact CD2-CB 4.15Å; F189-A468 HydrophobicContact CE2-CB 3.96Å; F189-V472 HydrophobicContact CZ-CG2 4.22Å; F189-C475 HydrophobicContact CE1-CB 4.1Å; F189-Y567 HydrophobicContact CD2-CE2 4.36Å; F189-Y567 AromaticContact CD2-CZ 3.94Å; F189-Y567 WeakPolarHBondContact CD2-OH 3.48Å
190	N	91.6	Very high	91.3	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.03	C	C	.	.	I	π-helix	trans	-65	-50.7	178.7	-75.2	-7.4	0	0	0	111.3	S186 V188 I194 S471 T494 N498	S186-N190 VanDerWaalsContact O-CB 3.28Å; S186-N190 WeakPolarHBondContact O-CB 3.39Å; S186-N190 VanDerWaalsContact O-CG 3.25Å; S186-N190 PolarHBondContact O-N 3.48Å; S186-N190 PolarHBondContact OG-ND2 2.87Å; V188-N190 VanDerWaalsContact C-N 3.27Å; V188-N190 PolarHBondContact O-N 2.88Å; N190-I194 HydrophobicContact CB-CD1 4.32Å; N190-I194 WeakPolarHBondContact O-CB 3.45Å; N190-I194 WeakPolarHBondContact OD1-CD1 3.39Å; N190-S471 WeakPolarHBondContact OD1-CB 3.27Å; N190-T494 VanDerWaalsContact C-CG2 3.41Å; N190-T494 HydrophobicContact CB-CG2 3.52Å; N190-T494 WeakPolarHBondContact O-CG2 3.49Å; N190-N498 WeakPolarHBondContact CB-OD1 3.14Å; N190-N498 PolarHBondContact ND2-OD1 2.95Å
191	I	91.1	Very high	91.2	Very high	6 Å²	6	10.2 Å²	10.2	3%	0.031	5%	0.052	C	C	.	.	I	π-helix	trans	-68.2	-40.9	179.3	-68.7	-61	0	0	0	112.7	A187 V188 I195 Y220 I495 N498 V541 T544	A187-I191 WeakPolarHBondContact O-CG1 3.47Å; A187-I191 PolarHBondContact O-N 2.89Å; A187-I191 VanDerWaalsContact O-N 3.08Å; V188-I191 PolarHBondContact O-N 3.09Å; I191-I195 VanDerWaalsContact O-CB 3.31Å; I191-I195 WeakPolarHBondContact O-CB 3.49Å; I191-I195 VanDerWaalsContact O-CD1 3.23Å; I191-I195 WeakPolarHBondContact O-CD1 3.36Å; I191-I195 VanDerWaalsContact O-CG1 3.25Å; I191-I195 WeakPolarHBondContact O-CG1 3.31Å; I191-Y220 HydrophobicContact CD1-CD1 4.4Å; I191-Y220 HydrophobicContact CD1-CE1 4.06Å; I191-Y220 HydrophobicContact CG1-CE1 3.82Å; I191-I495 HydrophobicContact CD1-CG1 3.85Å; I191-N498 WeakPolarHBondContact CG1-ND2 3.39Å; I191-V541 HydrophobicContact CG1-CG2 4.38Å; I191-T544 HydrophobicContact CG2-CG2 4.01Å
192	L	92.8	Very high	91	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.055	C	C	.	.	I	π-helix	trans	-97.1	-55	-171.3	-57	177.7	0	0	0	112.4	V188 G196 T544 V563 L566 Y567 F570	V188-L192 HydrophobicContact CG1-CD1 3.6Å; V188-L192 HydrophobicContact CG1-CG 4.23Å; V188-L192 WeakPolarHBondContact O-CB 3.35Å; V188-L192 PolarHBondContact O-N 3.12Å; L192-G196 WeakPolarHBondContact O-CA 3.25Å; L192-G196 PolarHBondContact O-N 3.14Å; L192-T544 WeakPolarHBondContact CD2-OG1 3.29Å; L192-V563 VanDerWaalsContact CA-CG1 3.43Å; L192-V563 HydrophobicContact CB-CG1 3.97Å; L192-V563 HydrophobicContact CD2-CG1 3.71Å; L192-V563 HydrophobicContact CG-CG1 4.49Å; L192-V563 WeakPolarHBondContact O-CG1 3.36Å; L192-L566 HydrophobicContact CD1-CG 4.35Å; L192-L566 HydrophobicContact CD2-CB 4.41Å; L192-L566 HydrophobicContact CD2-CD2 3.71Å; L192-L566 HydrophobicContact CD2-CG 4.07Å; L192-Y567 HydrophobicContact CB-CD2 4.02Å; L192-Y567 HydrophobicContact CB-CG 4.26Å; L192-Y567 HydrophobicContact CD1-CD2 4.21Å; L192-F570 HydrophobicContact CD1-CB 4.35Å
193	C	92.2	Very high	90.4	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.014	9%	0.094	C	C	.	.	I	π-helix	trans	-69.7	-50.1	-174.6	-164.7	0	0	0	0	111.7	F189 G196 V197	F189-C193 HydrophobicContact CD1-CB 4.14Å; F189-C193 HydrophobicContact CD2-CB 3.78Å; F189-C193 HydrophobicContact CE1-CB 4.15Å; F189-C193 HydrophobicContact CE2-CB 3.75Å; F189-C193 HydrophobicContact CG-CB 3.97Å; F189-C193 HydrophobicContact CZ-CB 3.96Å; F189-C193 VanDerWaalsContact O-CA 3.25Å; F189-C193 WeakPolarHBondContact O-CA 3.33Å; F189-C193 WeakPolarHBondContact O-CB 3.13Å; F189-C193 PolarHBondContact O-N 3.44Å; C193-G196 PolarHBondContact O-N 2.95Å; C193-V197 WeakPolarHBondContact O-CB 3.36Å; C193-V197 VanDerWaalsContact O-CG2 3.26Å; C193-V197 WeakPolarHBondContact O-CG2 3.5Å; C193-V197 PolarHBondContact O-N 3.16Å
194	I	90.3	Very high	89.9	Confident	2 Å²	2	18.5 Å²	18.5	1%	0.01	11%	0.114	C	C	.	.	I	π-helix	trans	-63.1	-48.4	-177.6	-59.3	-171.9	0	0	0	111.1	F189 N190 G196 V197 C198 D474 C475 S478 T494	F189-I194 HydrophobicContact CD1-CG1 4.15Å; F189-I194 HydrophobicContact CE1-CG1 4.13Å; F189-I194 PolarHBondContact O-N 3.12Å; N190-I194 HydrophobicContact CB-CD1 4.32Å; N190-I194 WeakPolarHBondContact O-CB 3.45Å; N190-I194 WeakPolarHBondContact OD1-CD1 3.39Å; I194-G196 VanDerWaalsContact C-N 3.32Å; I194-G196 PolarHBondContact O-N 3.36Å; I194-V197 PolarHBondContact O-N 3.14Å; I194-C198 WeakPolarHBondContact O-CB 3.24Å; I194-C198 PolarHBondContact O-N 3.34Å; I194-C198 PolarHBondContact O-SG 3.43Å; I194-D474 HydrophobicContact CD1-CB 4.14Å; I194-C475 HydrophobicContact CD1-CB 4.1Å; I194-C475 HydrophobicContact CG1-CB 3.74Å; I194-S478 VanDerWaalsContact CG2-CB 3.46Å; I194-T494 HydrophobicContact CB-CG2 4.16Å; I194-T494 HydrophobicContact CD1-CG2 4.06Å; I194-T494 HydrophobicContact CG2-CG2 4.27Å
195	I	90.4	Very high	89.6	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-41.9	177.5	-60	-172.2	0	0	0	110.6	I191 C198 G199 V491 T544 L555	I191-I195 VanDerWaalsContact O-CB 3.31Å; I191-I195 WeakPolarHBondContact O-CB 3.49Å; I191-I195 VanDerWaalsContact O-CD1 3.23Å; I191-I195 WeakPolarHBondContact O-CD1 3.36Å; I191-I195 VanDerWaalsContact O-CG1 3.25Å; I191-I195 WeakPolarHBondContact O-CG1 3.31Å; I195-C198 PolarHBondContact O-N 3.37Å; I195-G199 PolarHBondContact O-N 2.83Å; I195-V491 HydrophobicContact CD1-CG1 4.49Å; I195-T544 HydrophobicContact CD1-CG2 4.36Å; I195-L555 HydrophobicContact CG2-CD1 3.53Å
196	G	91.4	Very high	89.3	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.5	-49.6	176.5	0	0	0	0	0	113.3	L192 C193 I194 G199 I200 G560	L192-G196 WeakPolarHBondContact O-CA 3.25Å; L192-G196 PolarHBondContact O-N 3.14Å; C193-G196 PolarHBondContact O-N 2.95Å; I194-G196 VanDerWaalsContact C-N 3.32Å; I194-G196 PolarHBondContact O-N 3.36Å; G196-G199 PolarHBondContact O-N 2.97Å; G196-I200 WeakPolarHBondContact O-CG1 3.49Å; G196-I200 PolarHBondContact O-N 3.13Å; G196-I200 VanDerWaalsContact O-N 3.1Å; G196-G560 WeakPolarHBondContact CA-O 3.15Å
197	V	90.3	Very high	88.8	Confident	23 Å²	23	26.8 Å²	26.8	14%	0.139	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-42	176.7	168.9	0	0	0	0	110.8	C193 I194 G199 I200 F201 L479	C193-V197 WeakPolarHBondContact O-CB 3.36Å; C193-V197 VanDerWaalsContact O-CG2 3.26Å; C193-V197 WeakPolarHBondContact O-CG2 3.5Å; C193-V197 PolarHBondContact O-N 3.16Å; I194-V197 PolarHBondContact O-N 3.14Å; V197-G199 PolarHBondContact O-N 3.36Å; V197-I200 PolarHBondContact O-N 3.18Å; V197-F201 HydrophobicContact CG1-CD2 3.93Å; V197-F201 WeakPolarHBondContact O-CB 3.46Å; V197-F201 PolarHBondContact O-N 2.88Å; V197-L479 HydrophobicContact CG1-CD1 4.45Å; V197-L479 HydrophobicContact CG1-CD2 4.04Å
198	C	88.6	Confident	88.4	Confident	6 Å²	6	27 Å²	27	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-59.5	-46.1	174	-70.7	0	0	0	0	111.2	I194 I195 I200 A202 A482 L555	I194-C198 WeakPolarHBondContact O-CB 3.24Å; I194-C198 PolarHBondContact O-N 3.34Å; I194-C198 PolarHBondContact O-SG 3.43Å; I195-C198 PolarHBondContact O-N 3.37Å; C198-I200 VanDerWaalsContact C-N 3.3Å; C198-I200 PolarHBondContact O-N 2.89Å; C198-A202 WeakPolarHBondContact O-CB 3.35Å; C198-A202 PolarHBondContact O-N 2.96Å; C198-A482 HydrophobicContact CB-CB 4.07Å; C198-L555 HydrophobicContact CB-CD2 3.88Å
199	G	88.8	Confident	88	Confident	7 Å²	7	30.3 Å²	30.3	7%	0.072	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-33.3	179.2	0	0	0	0	0	114	I195 G196 V197 L557	I195-G199 PolarHBondContact O-N 2.83Å; G196-G199 PolarHBondContact O-N 2.97Å; V197-G199 PolarHBondContact O-N 3.36Å; G199-L557 WeakPolarHBondContact O-CA 3.37Å; G199-L557 PolarHBondContact O-N 3.41Å
200	I	90	Very high	87.6	Confident	46 Å²	46	36 Å²	36	24%	0.236	21%	0.206	C	C	.	.	H	α-helix	trans	-83.9	-45.6	-179.9	-63	174	0	0	0	112.1	G196 V197 C198 L557 I561 L564	G196-I200 WeakPolarHBondContact O-CG1 3.49Å; G196-I200 PolarHBondContact O-N 3.13Å; G196-I200 VanDerWaalsContact O-N 3.1Å; V197-I200 PolarHBondContact O-N 3.18Å; C198-I200 VanDerWaalsContact C-N 3.3Å; C198-I200 PolarHBondContact O-N 2.89Å; I200-L557 HydrophobicContact CB-CD1 4.05Å; I200-L557 HydrophobicContact CG1-CD1 3.96Å; I200-L557 HydrophobicContact CG2-CD1 3.88Å; I200-I561 HydrophobicContact CD1-CG1 3.97Å; I200-I561 HydrophobicContact CG1-CG1 4.18Å; I200-L564 HydrophobicContact CD1-CD1 3.41Å; I200-L564 VanDerWaalsContact CD1-CD1 3.41Å; I200-L564 HydrophobicContact CD1-CG 4.36Å
201	F	88.1	Confident	87.2	Confident	112 Å²	112	37.4 Å²	37.4	49%	0.491	21%	0.212	S	C	.	.	H	α-helix	trans	-105.2	-0.9	-166.7	-65.8	-75.9	0	0	0	114.4	V197 G203 L479 R483	V197-F201 HydrophobicContact CG1-CD2 3.93Å; V197-F201 WeakPolarHBondContact O-CB 3.46Å; V197-F201 PolarHBondContact O-N 2.88Å; F201-G203 PolarHBondContact O-N 2.96Å; F201-L479 HydrophobicContact CB-CD1 3.71Å; F201-L479 HydrophobicContact CB-CD2 4.06Å; F201-R483 VanDerWaalsContact O-CZ 3.29Å; F201-R483 PolarHBondContact O-NE 2.93Å; F201-R483 PolarHBondContact O-NH2 3.2Å
202	A	84.8	Confident	86.7	Confident	8 Å²	8	37.9 Å²	37.9	7%	0.066	22%	0.216	C	C	.	.	S	Bend	trans	-64.1	-26.5	173.7	0	0	0	0	0	112.6	C198 Q204 V206 A482 R483	C198-A202 WeakPolarHBondContact O-CB 3.35Å; C198-A202 PolarHBondContact O-N 2.96Å; A202-Q204 PolarHBondContact O-N 3.27Å; A202-V206 HydrophobicContact CB-CG2 4.07Å; A202-A482 HydrophobicContact CB-CB 4.27Å; A202-R483 WeakPolarHBondContact O-CG 3.11Å
203	G	80.3	Confident	86.2	Confident	80 Å²	80	38 Å²	38	83%	0.825	22%	0.217	S	C	*	.	S	Bend	trans	69.8	7.9	178.7	0	0	0	0	0	114.6	F201	F201-G203 PolarHBondContact O-N 2.96Å
204	Q	83.5	Confident	85.8	Confident	87 Å²	87	42.6 Å²	42.6	41%	0.407	24%	0.237	S	C	.	.	S	Bend	trans	-151	158.2	176.1	65.4	-172.2	-11.8	0	0	109.7	A202 V206 A482 R483 G485	A202-Q204 PolarHBondContact O-N 3.27Å; Q204-V206 HydrophobicContact CG-CG2 4.21Å; Q204-V206 PolarHBondContact O-N 3.24Å; Q204-A482 PolarHBondContact NE2-O 3.45Å; Q204-R483 PolarHBondContact NE2-O 2.73Å; Q204-G485 VanDerWaalsContact NE2-CA 3.28Å
205	V	85.8	Confident	85.5	Confident	79 Å²	79	43.8 Å²	43.8	48%	0.479	24%	0.242	S	C	.	.			trans	-75.3	118.6	173.4	180	0	0	0	0	108.5	Q554 D556	V205-Q554 HydrophobicContact CG1-CB 3.92Å; V205-Q554 HydrophobicContact CG1-CG 4.28Å; V205-D556 VanDerWaalsContact CG1-OD1 3.25Å; V205-D556 WeakPolarHBondContact CG1-OD1 3.24Å; V205-D556 VanDerWaalsContact CG2-OD1 3.27Å; V205-D556 WeakPolarHBondContact CG2-OD1 3.4Å
206	V	84.6	Confident	85.1	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115	-179.5	175.2	0	0	0	0	108.3	A202 Q204 L555	A202-V206 HydrophobicContact CB-CG2 4.07Å; Q204-V206 HydrophobicContact CG-CG2 4.21Å; Q204-V206 PolarHBondContact O-N 3.24Å; V206-L555 HydrophobicContact CB-CB 4.1Å; V206-L555 HydrophobicContact CB-CD2 4.42Å; V206-L555 PolarHBondContact N-O 3.3Å; V206-L555 WeakPolarHBondContact O-CB 3.19Å; V206-L555 PolarHBondContact O-N 3.22Å
207	V	81.9	Confident	84.8	Confident	93 Å²	93	44 Å²	44	56%	0.564	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.8	179.4	-175	0	0	0	0	108.8
208	L	85	Confident	84.8	Confident	5 Å²	5	48 Å²	48	3%	0.026	26%	0.259	C	S	.	.			trans	-106.1	142.8	177.6	-65.6	167	0	0	0	110.4	V213 D488 V491 I548 W553 L555	L208-V213 HydrophobicContact CB-CG2 4.18Å; L208-V213 HydrophobicContact CD1-CG2 4.44Å; L208-D488 WeakPolarHBondContact CA-OD1 3.44Å; L208-D488 WeakPolarHBondContact CD2-OD1 3.43Å; L208-V491 HydrophobicContact CD1-CG2 4.27Å; L208-V491 HydrophobicContact CD2-CB 4.08Å; L208-V491 HydrophobicContact CD2-CG2 3.63Å; L208-I548 HydrophobicContact CD1-CG2 4.07Å; L208-W553 PolarHBondContact N-O 2.84Å; L208-W553 WeakPolarHBondContact O-CB 3.09Å; L208-L555 HydrophobicContact CD1-CB 4.49Å
209	T	85.3	Confident	84.7	Confident	69 Å²	69	50.3 Å²	50.3	42%	0.423	27%	0.267	S	S	.	.			trans	-81.6	128.8	171.7	52	0	0	0	0	110.9	W211 A212 V213 D488	T209-W211 PolarHBondContact O-N 3.46Å; T209-A212 PolarHBondContact O-N 3.39Å; T209-A212 WeakPolarHBondContact OG1-CB 3.07Å; T209-V213 PolarHBondContact O-N 3.17Å; T209-D488 WeakPolarHBondContact CB-OD2 3.42Å; T209-D488 WeakPolarHBondContact CG2-OD2 3.33Å; T209-D488 PolarHBondContact N-OD1 3.48Å; T209-D488 PolarHBondContact N-OD2 3.26Å; T209-D488 VanDerWaalsContact OG1-CG 3.28Å; T209-D488 PolarHBondContact OG1-OD1 3.16Å; T209-D488 PolarHBondContact OG1-OD2 3Å
210	W	83.8	Confident	84.8	Confident	122 Å²	122	50 Å²	50	46%	0.462	26%	0.264	S	S	.	.	H	α-helix	trans	-51.1	-42.8	177.6	-179.6	106.3	0	0	0	112.4	F214 W553	W210-F214 HydrophobicContact CH2-CD1 4.2Å; W210-F214 HydrophobicContact CH2-CD2 4.49Å; W210-F214 HydrophobicContact CH2-CG 4.14Å; W210-F214 HydrophobicContact CZ2-CB 4.47Å; W210-F214 HydrophobicContact CZ2-CD2 4.25Å; W210-F214 HydrophobicContact CZ2-CG 4.22Å; W210-F214 VanDerWaalsContact O-CB 3.25Å; W210-F214 WeakPolarHBondContact O-CB 3.12Å; W210-F214 PolarHBondContact O-N 3.35Å; W210-W553 HydrophobicContact CB-CD2 4.03Å; W210-W553 HydrophobicContact CB-CE3 4.22Å; W210-W553 HydrophobicContact CB-CH2 4.36Å; W210-W553 HydrophobicContact CB-CZ2 4.25Å; W210-W553 HydrophobicContact CB-CZ3 4.37Å; W210-W553 AromaticContact CD1-CE2 3.17Å; W210-W553 AromaticContact CD1-CH2 3.39Å; W210-W553 AromaticContact CD1-CZ2 2.83Å; W210-W553 AromaticContact CD1-NE1 3.56Å; W210-W553 HydrophobicContact CG-CD2 4.38Å; W210-W553 AromaticContact CG-CE2 3.92Å; W210-W553 AromaticContact CG-CH2 3.89Å; W210-W553 HydrophobicContact CG-CH2 3.89Å; W210-W553 AromaticContact CG-CZ2 3.7Å; W210-W553 HydrophobicContact CG-CZ2 3.7Å; W210-W553 HydrophobicContact CG-CZ3 4.35Å; W210-W553 AromaticContact NE1-CH2 3.67Å; W210-W553 AromaticContact NE1-CZ2 3.26Å; W210-W553 VanDerWaalsContact NE1-CZ2 3.26Å
211	W	82.3	Confident	84.9	Confident	30 Å²	30	50.8 Å²	50.8	11%	0.114	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-46.6	-175.8	-178.9	-106.7	0	0	0	113.2	T209 R215 M261 F265	T209-W211 PolarHBondContact O-N 3.46Å; W211-R215 VanDerWaalsContact O-CB 3.27Å; W211-R215 WeakPolarHBondContact O-CB 3.1Å; W211-R215 PolarHBondContact O-N 2.99Å; W211-M261 HydrophobicContact CH2-CG 4.23Å; W211-M261 HydrophobicContact CZ2-CE 3.92Å; W211-M261 HydrophobicContact CZ2-CG 3.83Å; W211-M261 HydrophobicContact CZ2-SD 4.24Å; W211-F265 HydrophobicContact CE3-CB 4.41Å; W211-F265 HydrophobicContact CH2-CB 3.68Å; W211-F265 AromaticContact CH2-CD1 3.87Å; W211-F265 HydrophobicContact CH2-CD1 3.87Å; W211-F265 AromaticContact CH2-CD2 3.39Å; W211-F265 HydrophobicContact CH2-CD2 3.39Å; W211-F265 HydrophobicContact CH2-CE1 4.34Å; W211-F265 AromaticContact CH2-CE2 3.91Å; W211-F265 HydrophobicContact CH2-CE2 3.91Å; W211-F265 AromaticContact CH2-CG 3.36Å; W211-F265 HydrophobicContact CH2-CG 3.36Å; W211-F265 HydrophobicContact CH2-CZ 4.35Å; W211-F265 HydrophobicContact CZ2-CB 4.23Å; W211-F265 HydrophobicContact CZ2-CD2 4.09Å; W211-F265 HydrophobicContact CZ2-CG 4.24Å; W211-F265 HydrophobicContact CZ3-CB 3.78Å; W211-F265 AromaticContact CZ3-CD1 3.77Å; W211-F265 HydrophobicContact CZ3-CD1 3.77Å; W211-F265 HydrophobicContact CZ3-CD2 4.14Å; W211-F265 HydrophobicContact CZ3-CE1 4.37Å; W211-F265 AromaticContact CZ3-CG 3.63Å; W211-F265 HydrophobicContact CZ3-CG 3.63Å
212	A	79.9	Confident	85.1	Confident	15 Å²	15	49.1 Å²	49.1	12%	0.124	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-48.8	-177.6	0	0	0	0	0	111.1	T209 F214 R215 D216	T209-A212 PolarHBondContact O-N 3.39Å; T209-A212 WeakPolarHBondContact OG1-CB 3.07Å; A212-F214 PolarHBondContact O-N 2.85Å; A212-R215 PolarHBondContact O-N 3.21Å; A212-D216 WeakPolarHBondContact O-CB 3.41Å; A212-D216 PolarHBondContact O-N 3.35Å
213	V	83.1	Confident	85.5	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.024	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-44.1	179.6	176.7	0	0	0	0	111.2	L208 T209 S217 V491 W553	L208-V213 HydrophobicContact CB-CG2 4.18Å; L208-V213 HydrophobicContact CD1-CG2 4.44Å; T209-V213 PolarHBondContact O-N 3.17Å; V213-S217 WeakPolarHBondContact O-CB 3.27Å; V213-S217 PolarHBondContact O-N 2.94Å; V213-S217 PolarHBondContact O-OG 3.24Å; V213-V491 HydrophobicContact CG2-CG1 4.46Å; V213-W553 HydrophobicContact CB-CE3 4.44Å; V213-W553 HydrophobicContact CB-CZ3 3.82Å; V213-W553 HydrophobicContact CG1-CZ3 3.89Å; V213-W553 HydrophobicContact CG2-CZ3 4.38Å
214	F	84.6	Confident	86.1	Confident	98 Å²	98	45 Å²	45	43%	0.43	22%	0.222	S	C	.	.	H	α-helix	trans	-63.5	-47.3	179	178	-98.7	0	0	0	112.1	W210 A212 F218	W210-F214 HydrophobicContact CH2-CD1 4.2Å; W210-F214 HydrophobicContact CH2-CD2 4.49Å; W210-F214 HydrophobicContact CH2-CG 4.14Å; W210-F214 HydrophobicContact CZ2-CB 4.47Å; W210-F214 HydrophobicContact CZ2-CD2 4.25Å; W210-F214 HydrophobicContact CZ2-CG 4.22Å; W210-F214 VanDerWaalsContact O-CB 3.25Å; W210-F214 WeakPolarHBondContact O-CB 3.12Å; W210-F214 PolarHBondContact O-N 3.35Å; A212-F214 PolarHBondContact O-N 2.85Å; F214-F218 VanDerWaalsContact O-CB 3.25Å; F214-F218 WeakPolarHBondContact O-CB 3.23Å; F214-F218 PolarHBondContact O-N 2.94Å
215	R	82.8	Confident	86.6	Confident	27 Å²	27	44.2 Å²	44.2	10%	0.102	22%	0.223	C	C	.	.	H	α-helix	trans	-57.4	-53.5	178.2	179.7	-160.9	68.7	-154.1	-3.3	110.9	W211 A212 F218 Y219 N258 M261	W211-R215 VanDerWaalsContact O-CB 3.27Å; W211-R215 WeakPolarHBondContact O-CB 3.1Å; W211-R215 PolarHBondContact O-N 2.99Å; A212-R215 PolarHBondContact O-N 3.21Å; R215-F218 PolarHBondContact O-N 3.28Å; R215-Y219 HydrophobicContact CG-CD2 4.47Å; R215-Y219 HydrophobicContact CG-CE2 4.41Å; R215-Y219 VanDerWaalsContact O-CD2 3.28Å; R215-Y219 WeakPolarHBondContact O-CD2 3.08Å; R215-Y219 PolarHBondContact O-N 3.29Å; R215-N258 WeakPolarHBondContact CD-OD1 3.23Å; R215-N258 PolarHBondContact NH1-ND2 3.07Å; R215-N258 PolarHBondContact NH1-OD1 3.22Å; R215-M261 HydrophobicContact CG-CE 4.19Å
216	D	82.6	Confident	87	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-69.7	-39.3	-174.5	-66.2	-11.1	0	0	0	111.1	A212 F218 Y219 Y220 S492 I495	A212-D216 WeakPolarHBondContact O-CB 3.41Å; A212-D216 PolarHBondContact O-N 3.35Å; D216-F218 VanDerWaalsContact C-N 3.34Å; D216-F218 PolarHBondContact O-N 3.19Å; D216-Y219 PolarHBondContact O-N 2.82Å; D216-Y220 WeakPolarHBondContact O-CB 2.96Å; D216-Y220 PolarHBondContact O-N 3.44Å; D216-S492 WeakPolarHBondContact OD2-CB 3.44Å; D216-S492 PolarHBondContact OD2-OG 3.49Å; D216-I495 HydrophobicContact CB-CB 4.12Å; D216-I495 HydrophobicContact CB-CD1 4.16Å; D216-I495 HydrophobicContact CB-CG2 3.68Å
217	S	86	Confident	87.4	Confident	8 Å²	8	41.1 Å²	41.1	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-34.5	176.1	-56.7	0	0	0	0	112.7	V213 Y220 I221 V545	V213-S217 WeakPolarHBondContact O-CB 3.27Å; V213-S217 PolarHBondContact O-N 2.94Å; V213-S217 PolarHBondContact O-OG 3.24Å; S217-Y220 PolarHBondContact O-N 2.86Å; S217-I221 WeakPolarHBondContact O-CB 3.43Å; S217-I221 WeakPolarHBondContact O-CD1 3.45Å; S217-I221 VanDerWaalsContact O-CG1 3.23Å; S217-I221 WeakPolarHBondContact O-CG1 3.47Å; S217-I221 PolarHBondContact O-N 3.3Å; S217-V545 WeakPolarHBondContact OG-CG2 3.21Å
218	F	88.6	Confident	87.9	Confident	107 Å²	107	38.2 Å²	38.2	47%	0.469	19%	0.187	S	C	.	.	H	α-helix	trans	-64.2	-47.4	177.9	176.3	-98.6	0	0	0	111.7	F214 R215 D216 Y220 I221 L222	F214-F218 VanDerWaalsContact O-CB 3.25Å; F214-F218 WeakPolarHBondContact O-CB 3.23Å; F214-F218 PolarHBondContact O-N 2.94Å; R215-F218 PolarHBondContact O-N 3.28Å; D216-F218 VanDerWaalsContact C-N 3.34Å; D216-F218 PolarHBondContact O-N 3.19Å; F218-Y220 VanDerWaalsContact C-N 3.3Å; F218-Y220 PolarHBondContact O-N 3.2Å; F218-I221 PolarHBondContact O-N 2.97Å; F218-L222 PolarHBondContact O-N 3.42Å
219	Y	88.1	Confident	88.2	Confident	54 Å²	54	40.9 Å²	40.9	21%	0.212	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-38.6	175.4	-79.8	-71.3	0	0	0	112	R215 D216 L222 S223 Y251 V254	R215-Y219 HydrophobicContact CG-CD2 4.47Å; R215-Y219 HydrophobicContact CG-CE2 4.41Å; R215-Y219 VanDerWaalsContact O-CD2 3.28Å; R215-Y219 WeakPolarHBondContact O-CD2 3.08Å; R215-Y219 PolarHBondContact O-N 3.29Å; D216-Y219 PolarHBondContact O-N 2.82Å; Y219-L222 WeakPolarHBondContact O-CB 3.29Å; Y219-L222 PolarHBondContact O-N 3.3Å; Y219-S223 PolarHBondContact O-N 3.31Å; Y219-Y251 HydrophobicContact CD1-CD2 4.13Å; Y219-Y251 HydrophobicContact CD2-CD2 4.22Å; Y219-Y251 HydrophobicContact CD2-CE2 4.5Å; Y219-Y251 AromaticContact CG-CD2 3.79Å; Y219-Y251 HydrophobicContact CG-CD2 3.79Å; Y219-Y251 HydrophobicContact CG-CE2 4.3Å; Y219-V254 HydrophobicContact CE1-CG2 4.38Å; Y219-V254 HydrophobicContact CE2-CB 4.44Å; Y219-V254 HydrophobicContact CE2-CG1 3.79Å; Y219-V254 WeakPolarHBondContact OH-CG1 3.39Å; Y219-V254 VanDerWaalsContact OH-CG2 3.31Å; Y219-V254 WeakPolarHBondContact OH-CG2 3.42Å
220	Y	90.1	Very high	88.5	Confident	1 Å²	1	38.5 Å²	38.5	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-65.8	-44.6	177.6	-174.7	-130.9	0	0	0	112.3	A187 I191 D216 S217 F218 L222 S223 V224 I495 N498 V499 I502 L537 V541	A187-Y220 VanDerWaalsContact CB-OH 3.27Å; A187-Y220 WeakPolarHBondContact CB-OH 3.47Å; I191-Y220 HydrophobicContact CD1-CD1 4.4Å; I191-Y220 HydrophobicContact CD1-CE1 4.06Å; I191-Y220 HydrophobicContact CG1-CE1 3.82Å; D216-Y220 WeakPolarHBondContact O-CB 2.96Å; D216-Y220 PolarHBondContact O-N 3.44Å; S217-Y220 PolarHBondContact O-N 2.86Å; F218-Y220 VanDerWaalsContact C-N 3.3Å; F218-Y220 PolarHBondContact O-N 3.2Å; Y220-L222 VanDerWaalsContact C-N 3.3Å; Y220-L222 PolarHBondContact O-N 3.09Å; Y220-S223 WeakPolarHBondContact CA-OG 3.21Å; Y220-S223 PolarHBondContact O-N 2.99Å; Y220-S223 VanDerWaalsContact O-N 3.11Å; Y220-S223 PolarHBondContact O-OG 3.48Å; Y220-V224 HydrophobicContact CD2-CG2 4.24Å; Y220-V224 HydrophobicContact CE1-CG2 4.46Å; Y220-V224 HydrophobicContact CE2-CG2 3.85Å; Y220-V224 WeakPolarHBondContact O-CG2 3.48Å; Y220-V224 PolarHBondContact O-N 3.14Å; Y220-I495 HydrophobicContact CG-CG2 4.38Å; Y220-N498 HydrophobicContact CD2-CB 4.12Å; Y220-N498 HydrophobicContact CE2-CB 3.57Å; Y220-V499 HydrophobicContact CD2-CG2 3.9Å; Y220-V499 HydrophobicContact CG-CG2 4.34Å; Y220-I502 HydrophobicContact CD2-CD1 4.38Å; Y220-I502 HydrophobicContact CE2-CD1 3.56Å; Y220-L537 WeakPolarHBondContact OH-CD1 3.46Å; Y220-V541 HydrophobicContact CD1-CG1 3.91Å; Y220-V541 HydrophobicContact CD1-CG2 3.91Å; Y220-V541 HydrophobicContact CE1-CB 4.41Å; Y220-V541 HydrophobicContact CE1-CG1 4.18Å; Y220-V541 HydrophobicContact CE1-CG2 3.32Å
221	I	91.8	Very high	88.8	Confident	62 Å²	62	32.8 Å²	32.8	32%	0.318	17%	0.172	S	C	.	.	H	α-helix	trans	-57.8	-43.8	173	-72.4	164.3	0	0	0	110.8	S217 F218 S223 V224 V225 L538 V541	S217-I221 WeakPolarHBondContact O-CB 3.43Å; S217-I221 WeakPolarHBondContact O-CD1 3.45Å; S217-I221 VanDerWaalsContact O-CG1 3.23Å; S217-I221 WeakPolarHBondContact O-CG1 3.47Å; S217-I221 PolarHBondContact O-N 3.3Å; F218-I221 PolarHBondContact O-N 2.97Å; I221-S223 VanDerWaalsContact C-N 3.33Å; I221-S223 PolarHBondContact O-N 2.81Å; I221-V224 PolarHBondContact O-N 3.12Å; I221-V225 HydrophobicContact CG2-CG2 4.31Å; I221-V225 WeakPolarHBondContact O-CB 3.23Å; I221-V225 VanDerWaalsContact O-CG2 3.28Å; I221-V225 WeakPolarHBondContact O-CG2 3.4Å; I221-V225 PolarHBondContact O-N 3.46Å; I221-L538 HydrophobicContact CG1-CD1 4.38Å; I221-L538 HydrophobicContact CG2-CD1 4.09Å; I221-V541 HydrophobicContact CG1-CG1 4.1Å
222	L	92.9	Very high	89.1	Confident	77 Å²	77	39.9 Å²	39.9	40%	0.403	20%	0.2	S	C	.	.	H	α-helix	trans	-60	-42.8	176.2	-176.8	65.8	0	0	0	111.8	F218 Y219 Y220 V225 A226 M247	F218-L222 PolarHBondContact O-N 3.42Å; Y219-L222 WeakPolarHBondContact O-CB 3.29Å; Y219-L222 PolarHBondContact O-N 3.3Å; Y220-L222 VanDerWaalsContact C-N 3.3Å; Y220-L222 PolarHBondContact O-N 3.09Å; L222-V225 PolarHBondContact O-N 3.19Å; L222-A226 PolarHBondContact O-N 3.47Å; L222-M247 HydrophobicContact CD2-SD 4.17Å; L222-M247 HydrophobicContact CG-SD 4.04Å
223	S	93.1	Very high	89.4	Confident	1 Å²	1	43 Å²	43	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-42.6	177.2	67.2	0	0	0	0	113.1	Y219 Y220 I221 A226 L227	Y219-S223 PolarHBondContact O-N 3.31Å; Y220-S223 WeakPolarHBondContact CA-OG 3.21Å; Y220-S223 PolarHBondContact O-N 2.99Å; Y220-S223 VanDerWaalsContact O-N 3.11Å; Y220-S223 PolarHBondContact O-OG 3.48Å; I221-S223 VanDerWaalsContact C-N 3.33Å; I221-S223 PolarHBondContact O-N 2.81Å; S223-A226 PolarHBondContact O-N 3.38Å; S223-L227 WeakPolarHBondContact O-CB 3.32Å; S223-L227 PolarHBondContact O-N 2.82Å
224	V	93.3	Very high	89.6	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-68.5	-40.3	178.2	176.3	0	0	0	0	110.9	Y220 I221 L227 I228 I502 V534 L537 L538	Y220-V224 HydrophobicContact CD2-CG2 4.24Å; Y220-V224 HydrophobicContact CE1-CG2 4.46Å; Y220-V224 HydrophobicContact CE2-CG2 3.85Å; Y220-V224 WeakPolarHBondContact O-CG2 3.48Å; Y220-V224 PolarHBondContact O-N 3.14Å; I221-V224 PolarHBondContact O-N 3.12Å; V224-L227 WeakPolarHBondContact O-CB 3.47Å; V224-L227 PolarHBondContact O-N 3.24Å; V224-I228 HydrophobicContact CG1-CD1 4.14Å; V224-I228 HydrophobicContact CG1-CG1 4.48Å; V224-I228 WeakPolarHBondContact O-CG1 3.18Å; V224-I228 PolarHBondContact O-N 2.86Å; V224-I502 HydrophobicContact CG2-CD1 3.64Å; V224-V534 HydrophobicContact CG1-CG1 4.09Å; V224-L537 HydrophobicContact CG2-CD2 4.18Å; V224-L538 HydrophobicContact CB-CD1 4.34Å; V224-L538 HydrophobicContact CG1-CB 3.82Å; V224-L538 HydrophobicContact CG1-CD1 4.08Å; V224-L538 HydrophobicContact CG1-CG 4.47Å
225	V	93.9	Very high	89.7	Confident	71 Å²	71	45 Å²	45	43%	0.43	22%	0.223	S	C	.	.	H	α-helix	trans	-63.8	-41.9	176.8	169.7	0	0	0	0	111.5	I221 L222 L227 I228 A229 L538	I221-V225 HydrophobicContact CG2-CG2 4.31Å; I221-V225 WeakPolarHBondContact O-CB 3.23Å; I221-V225 VanDerWaalsContact O-CG2 3.28Å; I221-V225 WeakPolarHBondContact O-CG2 3.4Å; I221-V225 PolarHBondContact O-N 3.46Å; L222-V225 PolarHBondContact O-N 3.19Å; V225-L227 VanDerWaalsContact C-N 3.33Å; V225-I228 PolarHBondContact O-N 2.94Å; V225-A229 PolarHBondContact O-N 2.85Å; V225-A229 VanDerWaalsContact O-N 3.09Å; V225-L538 HydrophobicContact CG2-CD1 4.33Å; V225-L538 HydrophobicContact CG2-CD2 4.19Å
226	A	93.9	Very high	90	Very high	17 Å²	17	43.7 Å²	43.7	14%	0.14	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-43.2	174	0	0	0	0	0	111.4	L222 S223 I228 A229 F230 L244 M247	L222-A226 PolarHBondContact O-N 3.47Å; S223-A226 PolarHBondContact O-N 3.38Å; A226-I228 PolarHBondContact O-N 2.81Å; A226-A229 WeakPolarHBondContact O-CB 3.38Å; A226-A229 PolarHBondContact O-N 3.45Å; A226-F230 HydrophobicContact CB-CE2 4.17Å; A226-F230 VanDerWaalsContact O-CD2 3.24Å; A226-F230 WeakPolarHBondContact O-CD2 3.42Å; A226-F230 VanDerWaalsContact O-CG 3.29Å; A226-F230 WeakPolarHBondContact O-CG 3.43Å; A226-F230 PolarHBondContact O-N 3.33Å; A226-F230 VanDerWaalsContact O-N 3.13Å; A226-L244 HydrophobicContact CB-CD2 4.36Å; A226-M247 HydrophobicContact CB-CE 3.75Å; A226-M247 HydrophobicContact CB-SD 4.46Å
227	L	92.3	Very high	90.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-44.6	176.2	-174.2	66.4	0	0	0	112.2	S223 V224 V225 A229 F230 I231 I502 L506 W510 V534	S223-L227 WeakPolarHBondContact O-CB 3.32Å; S223-L227 PolarHBondContact O-N 2.82Å; V224-L227 WeakPolarHBondContact O-CB 3.47Å; V224-L227 PolarHBondContact O-N 3.24Å; V225-L227 VanDerWaalsContact C-N 3.33Å; L227-A229 VanDerWaalsContact C-N 3.28Å; L227-A229 PolarHBondContact O-N 3.33Å; L227-F230 PolarHBondContact O-N 3.49Å; L227-I231 HydrophobicContact CD1-CD1 3.61Å; L227-I231 HydrophobicContact CD1-CG1 4.08Å; L227-I231 HydrophobicContact CD2-CD1 4.25Å; L227-I231 HydrophobicContact CG-CD1 3.65Å; L227-I231 HydrophobicContact CG-CG1 4.32Å; L227-I231 VanDerWaalsContact O-CG1 3.31Å; L227-I231 WeakPolarHBondContact O-CG1 2.94Å; L227-I231 PolarHBondContact O-N 3.48Å; L227-I502 HydrophobicContact CB-CG2 4.19Å; L227-I502 HydrophobicContact CD2-CG2 4.05Å; L227-I502 HydrophobicContact CG-CG2 4.49Å; L227-L506 HydrophobicContact CD1-CD1 3.67Å; L227-L506 HydrophobicContact CD2-CD1 3.98Å; L227-L506 HydrophobicContact CG-CD1 4.5Å; L227-W510 HydrophobicContact CD1-CH2 3.7Å; L227-W510 HydrophobicContact CD1-CZ3 3.93Å; L227-V534 HydrophobicContact CD2-CG1 3.91Å; L227-V534 HydrophobicContact CD2-CG2 4.22Å; L227-V534 HydrophobicContact CG-CG1 4.3Å
228	I	92.1	Very high	90.7	Very high	33 Å²	33	50.1 Å²	50.1	17%	0.169	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-42.1	176.6	-67	169.2	0	0	0	110.7	V224 V225 A226 F230 Y232 V534 V535 L538	V224-I228 HydrophobicContact CG1-CD1 4.14Å; V224-I228 HydrophobicContact CG1-CG1 4.48Å; V224-I228 WeakPolarHBondContact O-CG1 3.18Å; V224-I228 PolarHBondContact O-N 2.86Å; V225-I228 PolarHBondContact O-N 2.94Å; A226-I228 PolarHBondContact O-N 2.81Å; I228-F230 VanDerWaalsContact C-N 3.34Å; I228-F230 PolarHBondContact O-N 3.39Å; I228-Y232 WeakPolarHBondContact O-CB 3.4Å; I228-Y232 PolarHBondContact O-N 2.62Å; I228-V534 HydrophobicContact CD1-CG1 4.27Å; I228-V534 HydrophobicContact CG1-CB 4.3Å; I228-V534 HydrophobicContact CG1-CG1 3.49Å; I228-V534 VanDerWaalsContact CG1-CG1 3.49Å; I228-V535 HydrophobicContact CD1-CG2 4.12Å; I228-V535 HydrophobicContact CG1-CG2 4.44Å; I228-V535 HydrophobicContact CG2-CG2 4.35Å; I228-L538 HydrophobicContact CD1-CB 4.24Å; I228-L538 HydrophobicContact CD1-CD2 3.92Å
229	A	92.4	Very high	90.8	Very high	60 Å²	60	51 Å²	51	50%	0.496	25%	0.245	S	C	.	.	H	α-helix	trans	-63	-39.7	179.8	0	0	0	0	0	112.4	V225 A226 L227	V225-A229 PolarHBondContact O-N 2.85Å; V225-A229 VanDerWaalsContact O-N 3.09Å; A226-A229 WeakPolarHBondContact O-CB 3.38Å; A226-A229 PolarHBondContact O-N 3.45Å; L227-A229 VanDerWaalsContact C-N 3.28Å; L227-A229 PolarHBondContact O-N 3.33Å
230	F	91.3	Very high	91	Very high	20 Å²	20	48.9 Å²	48.9	9%	0.088	24%	0.237	C	C	.	.	H	α-helix	trans	-82.8	-20.5	-177.8	-56	-31.2	0	0	0	114.6	A226 L227 I228 W239 E240 V243 L244	A226-F230 HydrophobicContact CB-CE2 4.17Å; A226-F230 VanDerWaalsContact O-CD2 3.24Å; A226-F230 WeakPolarHBondContact O-CD2 3.42Å; A226-F230 VanDerWaalsContact O-CG 3.29Å; A226-F230 WeakPolarHBondContact O-CG 3.43Å; A226-F230 PolarHBondContact O-N 3.33Å; A226-F230 VanDerWaalsContact O-N 3.13Å; L227-F230 PolarHBondContact O-N 3.49Å; I228-F230 VanDerWaalsContact C-N 3.34Å; I228-F230 PolarHBondContact O-N 3.39Å; F230-W239 HydrophobicContact CE1-CH2 4.19Å; F230-W239 HydrophobicContact CE1-CZ3 4.02Å; F230-E240 HydrophobicContact CB-CB 4.34Å; F230-E240 HydrophobicContact CD1-CB 3.9Å; F230-E240 HydrophobicContact CD1-CG 3.58Å; F230-E240 HydrophobicContact CD2-CB 4.1Å; F230-E240 HydrophobicContact CE1-CB 4.2Å; F230-E240 HydrophobicContact CE1-CG 3.89Å; F230-E240 HydrophobicContact CE2-CB 4.37Å; F230-E240 HydrophobicContact CG-CB 3.87Å; F230-E240 HydrophobicContact CG-CG 4.04Å; F230-E240 HydrophobicContact CZ-CB 4.43Å; F230-V243 HydrophobicContact CE2-CB 4.46Å; F230-V243 HydrophobicContact CE2-CG1 4.22Å; F230-V243 HydrophobicContact CZ-CB 4.16Å; F230-V243 HydrophobicContact CZ-CG1 3.82Å; F230-L244 HydrophobicContact CD2-CD1 4.22Å; F230-L244 HydrophobicContact CD2-CD2 3.91Å; F230-L244 HydrophobicContact CD2-CG 3.97Å; F230-L244 HydrophobicContact CE2-CD2 3.71Å; F230-L244 HydrophobicContact CE2-CG 3.84Å
231	I	89.6	Confident	91.1	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-88.1	-17.7	175.5	-64.5	-178.6	0	0	0	110.4	V180 L227 D233 E234 W510 I525 V531 V534	V180-I231 HydrophobicContact CG1-CD1 4.44Å; L227-I231 HydrophobicContact CD1-CD1 3.61Å; L227-I231 HydrophobicContact CD1-CG1 4.08Å; L227-I231 HydrophobicContact CD2-CD1 4.25Å; L227-I231 HydrophobicContact CG-CD1 3.65Å; L227-I231 HydrophobicContact CG-CG1 4.32Å; L227-I231 VanDerWaalsContact O-CG1 3.31Å; L227-I231 WeakPolarHBondContact O-CG1 2.94Å; L227-I231 PolarHBondContact O-N 3.48Å; I231-D233 VanDerWaalsContact C-N 3.3Å; I231-D233 PolarHBondContact O-N 3.31Å; I231-E234 PolarHBondContact O-N 3.4Å; I231-W510 HydrophobicContact CD1-CH2 4.44Å; I231-W510 HydrophobicContact CG1-CH2 4.49Å; I231-I525 HydrophobicContact CB-CD1 3.83Å; I231-I525 HydrophobicContact CD1-CD1 4.3Å; I231-I525 HydrophobicContact CG1-CD1 3.64Å; I231-I525 HydrophobicContact CG2-CD1 3.47Å; I231-I525 VanDerWaalsContact CG2-CD1 3.47Å; I231-V531 HydrophobicContact CG2-CB 4.45Å; I231-V531 HydrophobicContact CG2-CG2 3.47Å; I231-V531 VanDerWaalsContact CG2-CG2 3.47Å; I231-V534 HydrophobicContact CD1-CG2 4.29Å
232	Y	87.8	Confident	91.1	Very high	179 Å²	179	49.2 Å²	49.2	70%	0.702	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-32.8	-171.4	-175.3	-97.3	0	0	0	114.6	I228	I228-Y232 WeakPolarHBondContact O-CB 3.4Å; I228-Y232 PolarHBondContact O-N 2.62Å
233	D	88.2	Confident	91.2	Very high	80 Å²	80	48.5 Å²	48.5	43%	0.428	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	7.2	179.3	64.5	-8.2	0	0	0	113.6	I231 K235	I231-D233 VanDerWaalsContact C-N 3.3Å; I231-D233 PolarHBondContact O-N 3.31Å; D233-K235 PolarHBondContact O-N 3.17Å; D233-K235 VanDerWaalsContact O-N 3.07Å; D233-K235 PolarHBondContact OD1-N 2.84Å
234	E	85.3	Confident	91.2	Very high	60 Å²	60	48.4 Å²	48.4	28%	0.28	24%	0.238	S	C	.	.	S	Bend	trans	61.2	9.2	179.4	-58.8	166.6	-172.2	0	0	114	I231 I525 R528	I231-E234 PolarHBondContact O-N 3.4Å; E234-I525 PolarHBondContact O-N 2.88Å; E234-R528 WeakPolarHBondContact OE1-CD 3.14Å; E234-R528 WeakPolarHBondContact OE1-CG 3.25Å; E234-R528 IonicContact OE1-CZ 3.38Å; E234-R528 IonicContact OE1-NE 2.67Å; E234-R528 PolarHBondContact OE1-NE 2.95Å; E234-R528 IonicContact OE1-NH2 3.27Å; E234-R528 PolarHBondContact OE1-NH2 3.48Å
235	K	88	Confident	91.2	Very high	83 Å²	83	50.6 Å²	50.6	36%	0.361	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	108.5	-170	-75.1	173.1	163.8	-121	0	111.4	D233 E522 M524	D233-K235 PolarHBondContact O-N 3.17Å; D233-K235 VanDerWaalsContact O-N 3.07Å; D233-K235 PolarHBondContact OD1-N 2.84Å; K235-E522 WeakPolarHBondContact CD-OE2 3.3Å; K235-E522 IonicContact NZ-OE2 2.73Å; K235-E522 PolarHBondContact NZ-OE2 2.91Å; K235-M524 HydrophobicContact CD-SD 4.46Å; K235-M524 HydrophobicContact CG-SD 3.76Å
236	I	89.6	Confident	91.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.6	-179.2	-50	179.8	0	0	0	110	E240 W510 V523 I525	I236-E240 WeakPolarHBondContact CA-OE2 3.38Å; I236-E240 HydrophobicContact CG2-CB 4.47Å; I236-W510 HydrophobicContact CD1-CD2 3.45Å; I236-W510 VanDerWaalsContact CD1-CD2 3.45Å; I236-W510 HydrophobicContact CD1-CE3 3.64Å; I236-W510 HydrophobicContact CD1-CG 4.17Å; I236-W510 HydrophobicContact CD1-CH2 3.36Å; I236-W510 HydrophobicContact CD1-CZ2 3.18Å; I236-W510 HydrophobicContact CD1-CZ3 3.59Å; I236-W510 HydrophobicContact CG2-CB 4.32Å; I236-W510 HydrophobicContact CG2-CD2 4.12Å; I236-W510 HydrophobicContact CG2-CE3 3.93Å; I236-W510 HydrophobicContact CG2-CG 4.33Å; I236-V523 HydrophobicContact CB-CB 4.26Å; I236-V523 PolarHBondContact N-O 3.01Å; I236-V523 PolarHBondContact O-N 3.37Å; I236-I525 HydrophobicContact CD1-CD1 3.94Å; I236-I525 HydrophobicContact CD1-CG1 4.25Å; I236-I525 HydrophobicContact CG1-CD1 4.12Å; I236-I525 HydrophobicContact CG1-CG1 4.39Å
237	V	91.3	Very high	91.1	Very high	33 Å²	33	52.6 Å²	52.6	20%	0.2	26%	0.259	C	S	.	.			trans	-95.7	163.4	175.7	-66.9	0	0	0	0	112.2	W239 E240 S241 E522	V237-W239 VanDerWaalsContact C-N 3.29Å; V237-W239 VanDerWaalsContact CG2-CD1 3.43Å; V237-W239 HydrophobicContact CG2-CD2 4.27Å; V237-W239 HydrophobicContact CG2-CG 4.13Å; V237-W239 HydrophobicContact CG2-CZ2 4.24Å; V237-W239 PolarHBondContact O-N 3.21Å; V237-E240 HydrophobicContact CG2-CB 4.34Å; V237-E240 VanDerWaalsContact CG2-CD 3.46Å; V237-E240 HydrophobicContact CG2-CG 3.63Å; V237-E240 WeakPolarHBondContact CG2-OE2 3.19Å; V237-E240 PolarHBondContact N-OE2 3.03Å; V237-E240 PolarHBondContact O-N 3.43Å; V237-S241 PolarHBondContact O-N 3.28Å; V237-S241 PolarHBondContact O-OG 3.06Å; V237-E522 HydrophobicContact CG1-CG 4.17Å
238	W	90.7	Very high	91	Very high	112 Å²	112	53.8 Å²	53.8	42%	0.424	26%	0.264	S	S	.	.	H	α-helix	trans	-59.2	-36	-174.6	69.4	-91.4	0	0	0	113.8	L242 T514 M515	W238-L242 HydrophobicContact CZ3-CD2 4.11Å; W238-L242 PolarHBondContact O-N 3.07Å; W238-T514 WeakPolarHBondContact CA-OG1 3.44Å; W238-M515 HydrophobicContact CB-CG 3.98Å
239	W	91.7	Very high	90.8	Very high	124 Å²	124	54.6 Å²	54.6	47%	0.47	28%	0.276	S	S	.	.	H	α-helix	trans	-73.3	-32.2	-177.3	70.1	-99	0	0	0	111.8	F230 V237 L242 V243	F230-W239 HydrophobicContact CE1-CH2 4.19Å; F230-W239 HydrophobicContact CE1-CZ3 4.02Å; V237-W239 VanDerWaalsContact C-N 3.29Å; V237-W239 VanDerWaalsContact CG2-CD1 3.43Å; V237-W239 HydrophobicContact CG2-CD2 4.27Å; V237-W239 HydrophobicContact CG2-CG 4.13Å; V237-W239 HydrophobicContact CG2-CZ2 4.24Å; V237-W239 PolarHBondContact O-N 3.21Å; W239-L242 PolarHBondContact O-N 2.82Å; W239-V243 HydrophobicContact CE3-CG2 4.03Å; W239-V243 HydrophobicContact CZ3-CG2 4.39Å; W239-V243 VanDerWaalsContact O-CG2 3.28Å; W239-V243 WeakPolarHBondContact O-CG2 3.46Å; W239-V243 PolarHBondContact O-N 3.04Å
240	E	92.7	Very high	90.7	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-44.2	175.8	-67.4	173	151.6	0	0	110.8	F230 I236 V237 L242 V243 L244	F230-E240 HydrophobicContact CB-CB 4.34Å; F230-E240 HydrophobicContact CD1-CB 3.9Å; F230-E240 HydrophobicContact CD1-CG 3.58Å; F230-E240 HydrophobicContact CD2-CB 4.1Å; F230-E240 HydrophobicContact CE1-CB 4.2Å; F230-E240 HydrophobicContact CE1-CG 3.89Å; F230-E240 HydrophobicContact CE2-CB 4.37Å; F230-E240 HydrophobicContact CG-CB 3.87Å; F230-E240 HydrophobicContact CG-CG 4.04Å; F230-E240 HydrophobicContact CZ-CB 4.43Å; I236-E240 WeakPolarHBondContact CA-OE2 3.38Å; I236-E240 HydrophobicContact CG2-CB 4.47Å; V237-E240 HydrophobicContact CG2-CB 4.34Å; V237-E240 VanDerWaalsContact CG2-CD 3.46Å; V237-E240 HydrophobicContact CG2-CG 3.63Å; V237-E240 WeakPolarHBondContact CG2-OE2 3.19Å; V237-E240 PolarHBondContact N-OE2 3.03Å; V237-E240 PolarHBondContact O-N 3.43Å; E240-L242 VanDerWaalsContact C-N 3.32Å; E240-L242 PolarHBondContact O-N 3.02Å; E240-V243 WeakPolarHBondContact O-CB 3.3Å; E240-V243 PolarHBondContact O-N 3.43Å; E240-V243 VanDerWaalsContact O-N 3.16Å; E240-L244 PolarHBondContact O-N 3.39Å; E240-L244 VanDerWaalsContact O-N 3.09Å
241	S	90.9	Very high	90.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-43.1	174.6	-54	0	0	0	0	111.5	V237 L244 V245 W510	V237-S241 PolarHBondContact O-N 3.28Å; V237-S241 PolarHBondContact O-OG 3.06Å; S241-L244 PolarHBondContact O-N 3.09Å; S241-V245 PolarHBondContact O-N 2.97Å; S241-W510 WeakPolarHBondContact OG-CB 3.45Å
242	L	92.1	Very high	90.1	Very high	70 Å²	70	55 Å²	55	37%	0.366	28%	0.276	S	S	.	.	H	α-helix	trans	-64.4	-39.3	175.7	-175.7	65.5	0	0	0	112	W238 W239 E240 L244 V245 V246	W238-L242 HydrophobicContact CZ3-CD2 4.11Å; W238-L242 PolarHBondContact O-N 3.07Å; W239-L242 PolarHBondContact O-N 2.82Å; E240-L242 VanDerWaalsContact C-N 3.32Å; E240-L242 PolarHBondContact O-N 3.02Å; L242-L244 VanDerWaalsContact C-N 3.32Å; L242-L244 PolarHBondContact O-N 3.46Å; L242-V245 PolarHBondContact O-N 3.35Å; L242-V246 HydrophobicContact CD1-CG2 4.38Å; L242-V246 HydrophobicContact CG-CG2 4.3Å; L242-V246 WeakPolarHBondContact O-CB 3.46Å; L242-V246 VanDerWaalsContact O-CG2 3.28Å; L242-V246 WeakPolarHBondContact O-CG2 3.33Å; L242-V246 PolarHBondContact O-N 3.37Å
243	V	94.9	Very high	89.9	Confident	62 Å²	62	51.1 Å²	51.1	38%	0.376	27%	0.267	S	S	.	.	H	α-helix	trans	-60.8	-41.5	176.7	168.1	0	0	0	0	111	F230 W239 E240 V246 M247	F230-V243 HydrophobicContact CE2-CB 4.46Å; F230-V243 HydrophobicContact CE2-CG1 4.22Å; F230-V243 HydrophobicContact CZ-CB 4.16Å; F230-V243 HydrophobicContact CZ-CG1 3.82Å; W239-V243 HydrophobicContact CE3-CG2 4.03Å; W239-V243 HydrophobicContact CZ3-CG2 4.39Å; W239-V243 VanDerWaalsContact O-CG2 3.28Å; W239-V243 WeakPolarHBondContact O-CG2 3.46Å; W239-V243 PolarHBondContact O-N 3.04Å; E240-V243 WeakPolarHBondContact O-CB 3.3Å; E240-V243 PolarHBondContact O-N 3.43Å; E240-V243 VanDerWaalsContact O-N 3.16Å; V243-V246 PolarHBondContact O-N 3.32Å; V243-M247 VanDerWaalsContact O-CB 3.29Å; V243-M247 WeakPolarHBondContact O-CB 3.32Å; V243-M247 PolarHBondContact O-N 3.38Å
244	L	93.4	Very high	89.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-46.9	175.9	-66.8	174.5	0	0	0	111.8	A226 F230 E240 S241 L242 M247 Y248 L503 W510	A226-L244 HydrophobicContact CB-CD2 4.36Å; F230-L244 HydrophobicContact CD2-CD1 4.22Å; F230-L244 HydrophobicContact CD2-CD2 3.91Å; F230-L244 HydrophobicContact CD2-CG 3.97Å; F230-L244 HydrophobicContact CE2-CD2 3.71Å; F230-L244 HydrophobicContact CE2-CG 3.84Å; E240-L244 PolarHBondContact O-N 3.39Å; E240-L244 VanDerWaalsContact O-N 3.09Å; S241-L244 PolarHBondContact O-N 3.09Å; L242-L244 VanDerWaalsContact C-N 3.32Å; L242-L244 PolarHBondContact O-N 3.46Å; L244-M247 HydrophobicContact CD2-CE 4.27Å; L244-M247 PolarHBondContact O-N 2.92Å; L244-Y248 PolarHBondContact O-N 3.16Å; L244-L503 HydrophobicContact CB-CD2 4.34Å; L244-L503 HydrophobicContact CD2-CD2 3.77Å; L244-W510 HydrophobicContact CD1-CE3 3.84Å; L244-W510 HydrophobicContact CD1-CZ3 3.63Å
245	V	92.4	Very high	89.1	Confident	46 Å²	46	47.2 Å²	47.2	28%	0.279	25%	0.249	S	C	.	.	H	α-helix	trans	-64.8	-41.9	178.4	177.9	0	0	0	0	111.6	S241 L242 M247 Y248 A249 V508	S241-V245 PolarHBondContact O-N 2.97Å; L242-V245 PolarHBondContact O-N 3.35Å; V245-M247 VanDerWaalsContact C-N 3.32Å; V245-M247 PolarHBondContact O-N 3.35Å; V245-Y248 WeakPolarHBondContact O-CB 3.07Å; V245-Y248 PolarHBondContact O-N 2.89Å; V245-A249 PolarHBondContact O-N 2.68Å; V245-A249 VanDerWaalsContact O-N 3.08Å; V245-V508 HydrophobicContact CG2-CG2 3.94Å
246	V	93.5	Very high	88.5	Confident	89 Å²	89	49.8 Å²	49.8	54%	0.539	26%	0.261	S	S	.	.	H	α-helix	trans	-65	-38.2	176.4	170.1	0	0	0	0	111.2	L242 V243 Y248 A249 G250	L242-V246 HydrophobicContact CD1-CG2 4.38Å; L242-V246 HydrophobicContact CG-CG2 4.3Å; L242-V246 WeakPolarHBondContact O-CB 3.46Å; L242-V246 VanDerWaalsContact O-CG2 3.28Å; L242-V246 WeakPolarHBondContact O-CG2 3.33Å; L242-V246 PolarHBondContact O-N 3.37Å; V243-V246 PolarHBondContact O-N 3.32Å; V246-Y248 VanDerWaalsContact C-N 3.29Å; V246-Y248 PolarHBondContact O-N 3.38Å; V246-A249 WeakPolarHBondContact O-CB 3.35Å; V246-A249 PolarHBondContact O-N 3.13Å; V246-G250 PolarHBondContact O-N 3.5Å
247	M	93	Very high	88	Confident	41 Å²	41	55.9 Å²	55.9	20%	0.202	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-35.7	176	-168.7	163.1	64.9	0	0	111.6	L222 A226 V243 L244 V245 G250 Y251 L503	L222-M247 HydrophobicContact CD2-SD 4.17Å; L222-M247 HydrophobicContact CG-SD 4.04Å; A226-M247 HydrophobicContact CB-CE 3.75Å; A226-M247 HydrophobicContact CB-SD 4.46Å; V243-M247 VanDerWaalsContact O-CB 3.29Å; V243-M247 WeakPolarHBondContact O-CB 3.32Å; V243-M247 PolarHBondContact O-N 3.38Å; L244-M247 HydrophobicContact CD2-CE 4.27Å; L244-M247 PolarHBondContact O-N 2.92Å; V245-M247 VanDerWaalsContact C-N 3.32Å; V245-M247 PolarHBondContact O-N 3.35Å; M247-G250 PolarHBondContact O-N 2.86Å; M247-Y251 PolarHBondContact O-N 3.26Å; M247-L503 HydrophobicContact CB-CD1 4.36Å; M247-L503 HydrophobicContact CE-CD1 4.15Å; M247-L503 HydrophobicContact CE-CD2 3.18Å; M247-L503 HydrophobicContact CE-CG 4.3Å; M247-L503 HydrophobicContact CG-CD1 4.26Å
248	Y	90.1	Very high	87.1	Confident	25 Å²	25	55 Å²	55	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-43.7	171.7	-173.6	-113.9	0	0	0	112.1	L244 V245 V246 G250 Y251 I252 V499 F500 L503 V504	L244-Y248 PolarHBondContact O-N 3.16Å; V245-Y248 WeakPolarHBondContact O-CB 3.07Å; V245-Y248 PolarHBondContact O-N 2.89Å; V246-Y248 VanDerWaalsContact C-N 3.29Å; V246-Y248 PolarHBondContact O-N 3.38Å; Y248-G250 PolarHBondContact O-N 3.35Å; Y248-Y251 HydrophobicContact CD2-CD1 4.03Å; Y248-Y251 AromaticContact CE2-CD1 3.86Å; Y248-Y251 HydrophobicContact CE2-CD1 3.86Å; Y248-Y251 HydrophobicContact CE2-CE1 4.21Å; Y248-Y251 WeakPolarHBondContact O-CA 3.48Å; Y248-Y251 WeakPolarHBondContact O-CB 3.39Å; Y248-Y251 PolarHBondContact O-N 2.99Å; Y248-Y251 VanDerWaalsContact O-N 3.07Å; Y248-I252 HydrophobicContact CD1-CD1 3.96Å; Y248-I252 HydrophobicContact CD1-CG1 4.36Å; Y248-I252 HydrophobicContact CE1-CD1 3.53Å; Y248-I252 HydrophobicContact CE1-CG1 4.02Å; Y248-I252 WeakPolarHBondContact O-CG1 3.45Å; Y248-I252 PolarHBondContact O-N 3.3Å; Y248-V499 HydrophobicContact CD2-CG1 4.43Å; Y248-F500 HydrophobicContact CE1-CD2 4.17Å; Y248-F500 HydrophobicContact CE2-CB 4.14Å; Y248-F500 HydrophobicContact CE2-CD2 4.12Å; Y248-F500 AromaticContact CZ-CD2 3.67Å; Y248-F500 WeakPolarHBondContact OH-CD2 3.49Å; Y248-L503 HydrophobicContact CD2-CB 4.25Å; Y248-L503 HydrophobicContact CD2-CD1 4.28Å; Y248-L503 HydrophobicContact CG-CB 4.34Å; Y248-V504 HydrophobicContact CD1-CG2 3.25Å; Y248-V504 HydrophobicContact CD2-CG2 3.96Å; Y248-V504 HydrophobicContact CE1-CG2 3.55Å; Y248-V504 HydrophobicContact CE2-CG2 4.25Å; Y248-V504 HydrophobicContact CG-CG2 3.49Å; Y248-V504 VanDerWaalsContact CG-CG2 3.49Å
249	A	89	Confident	85.9	Confident	51 Å²	51	52.1 Å²	52.1	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-58.9	-39.2	173.8	0	0	0	0	0	111.6	V245 V246 I252 L253	V245-A249 PolarHBondContact O-N 2.68Å; V245-A249 VanDerWaalsContact O-N 3.08Å; V246-A249 WeakPolarHBondContact O-CB 3.35Å; V246-A249 PolarHBondContact O-N 3.13Å; A249-I252 PolarHBondContact O-N 2.97Å; A249-L253 WeakPolarHBondContact O-CG 3.46Å; A249-L253 PolarHBondContact O-N 3.41Å
250	G	88.7	Confident	84.8	Confident	30 Å²	30	49.7 Å²	49.7	31%	0.309	28%	0.28	S	S	.	.	H	α-helix	trans	-60.7	-43.5	171.7	0	0	0	0	0	113.2	V246 M247 Y248 L253 V254	V246-G250 PolarHBondContact O-N 3.5Å; M247-G250 PolarHBondContact O-N 2.86Å; Y248-G250 PolarHBondContact O-N 3.35Å; G250-L253 PolarHBondContact O-N 3.02Å; G250-V254 WeakPolarHBondContact O-CG2 3.48Å; G250-V254 PolarHBondContact O-N 3.43Å
251	Y	85.8	Confident	83.6	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-46.4	174.6	169.2	-105.2	0	0	0	112.2	Y219 M247 Y248 L253 V254 M255 V499	Y219-Y251 HydrophobicContact CD1-CD2 4.13Å; Y219-Y251 HydrophobicContact CD2-CD2 4.22Å; Y219-Y251 HydrophobicContact CD2-CE2 4.5Å; Y219-Y251 AromaticContact CG-CD2 3.79Å; Y219-Y251 HydrophobicContact CG-CD2 3.79Å; Y219-Y251 HydrophobicContact CG-CE2 4.3Å; M247-Y251 PolarHBondContact O-N 3.26Å; Y248-Y251 HydrophobicContact CD2-CD1 4.03Å; Y248-Y251 AromaticContact CE2-CD1 3.86Å; Y248-Y251 HydrophobicContact CE2-CD1 3.86Å; Y248-Y251 HydrophobicContact CE2-CE1 4.21Å; Y248-Y251 WeakPolarHBondContact O-CA 3.48Å; Y248-Y251 WeakPolarHBondContact O-CB 3.39Å; Y248-Y251 PolarHBondContact O-N 2.99Å; Y248-Y251 VanDerWaalsContact O-N 3.07Å; Y251-L253 VanDerWaalsContact C-N 3.32Å; Y251-L253 PolarHBondContact O-N 3.37Å; Y251-V254 PolarHBondContact O-N 2.98Å; Y251-M255 HydrophobicContact CD1-SD 4.29Å; Y251-M255 HydrophobicContact CD2-CG 4.4Å; Y251-M255 HydrophobicContact CE1-CE 4.25Å; Y251-M255 HydrophobicContact CE1-CG 4.45Å; Y251-M255 HydrophobicContact CE1-SD 3.53Å; Y251-M255 VanDerWaalsContact CE1-SD 3.53Å; Y251-M255 HydrophobicContact CE2-CE 3.74Å; Y251-M255 HydrophobicContact CE2-CG 4.09Å; Y251-M255 HydrophobicContact CE2-SD 3.8Å; Y251-M255 WeakPolarHBondContact O-CG 3.44Å; Y251-M255 PolarHBondContact O-N 2.83Å; Y251-M255 WeakPolarHBondContact OH-CE 3.48Å; Y251-M255 PolarHBondContact OH-SD 3.18Å; Y251-M255 VanDerWaalsContact OH-SD 3.36Å; Y251-V499 HydrophobicContact CD1-CG1 3.93Å; Y251-V499 HydrophobicContact CD2-CG1 4.19Å; Y251-V499 HydrophobicContact CE1-CB 4.44Å; Y251-V499 HydrophobicContact CE1-CG1 3.98Å; Y251-V499 HydrophobicContact CE2-CG1 4.23Å; Y251-V499 HydrophobicContact CG-CG1 4Å
252	I	82.9	Confident	82.5	Confident	55 Å²	55	55.3 Å²	55.3	28%	0.282	31%	0.307	S	S	.	.	H	α-helix	trans	-58.3	-45.1	175	-62	-180	0	0	0	110.9	T153 Y248 A249 V254 M255 K256	T153-I252 HydrophobicContact CG2-CB 4.43Å; T153-I252 HydrophobicContact CG2-CD1 4.14Å; T153-I252 HydrophobicContact CG2-CG1 3.75Å; T153-I252 HydrophobicContact CG2-CG2 4.16Å; Y248-I252 HydrophobicContact CD1-CD1 3.96Å; Y248-I252 HydrophobicContact CD1-CG1 4.36Å; Y248-I252 HydrophobicContact CE1-CD1 3.53Å; Y248-I252 HydrophobicContact CE1-CG1 4.02Å; Y248-I252 WeakPolarHBondContact O-CG1 3.45Å; Y248-I252 PolarHBondContact O-N 3.3Å; A249-I252 PolarHBondContact O-N 2.97Å; I252-V254 VanDerWaalsContact C-N 3.34Å; I252-V254 PolarHBondContact O-N 2.85Å; I252-M255 PolarHBondContact O-N 2.94Å; I252-K256 WeakPolarHBondContact O-CB 2.92Å; I252-K256 PolarHBondContact O-N 3.34Å
253	L	83.1	Confident	81.5	Confident	99 Å²	99	60.8 Å²	60.8	52%	0.518	32%	0.323	S	S	.	.	H	α-helix	trans	-60.9	-43.7	179	-73.8	173.6	0	0	0	111.4	A249 G250 Y251 K256 F257	A249-L253 WeakPolarHBondContact O-CG 3.46Å; A249-L253 PolarHBondContact O-N 3.41Å; G250-L253 PolarHBondContact O-N 3.02Å; Y251-L253 VanDerWaalsContact C-N 3.32Å; Y251-L253 PolarHBondContact O-N 3.37Å; L253-K256 WeakPolarHBondContact O-CB 3.11Å; L253-K256 PolarHBondContact O-N 2.86Å; L253-F257 WeakPolarHBondContact O-CD2 3.39Å; L253-F257 PolarHBondContact O-N 2.92Å
254	V	80.8	Confident	80.3	Confident	38 Å²	38	64.6 Å²	64.6	23%	0.23	33%	0.334	C	S	.	.	H	α-helix	trans	-64.1	-43.5	177.1	173	0	0	0	0	111	Y219 G250 Y251 I252 K256 F257 N258 M261	Y219-V254 HydrophobicContact CE1-CG2 4.38Å; Y219-V254 HydrophobicContact CE2-CB 4.44Å; Y219-V254 HydrophobicContact CE2-CG1 3.79Å; Y219-V254 WeakPolarHBondContact OH-CG1 3.39Å; Y219-V254 VanDerWaalsContact OH-CG2 3.31Å; Y219-V254 WeakPolarHBondContact OH-CG2 3.42Å; G250-V254 WeakPolarHBondContact O-CG2 3.48Å; G250-V254 PolarHBondContact O-N 3.43Å; Y251-V254 PolarHBondContact O-N 2.98Å; I252-V254 VanDerWaalsContact C-N 3.34Å; I252-V254 PolarHBondContact O-N 2.85Å; V254-K256 VanDerWaalsContact C-N 3.28Å; V254-K256 PolarHBondContact O-N 2.94Å; V254-F257 CarbonylContact O-C 3.55Å; V254-F257 PolarHBondContact O-N 2.59Å; V254-F257 VanDerWaalsContact O-N 3.07Å; V254-N258 PolarHBondContact O-N 3.23Å; V254-M261 HydrophobicContact CG1-CE 4.05Å
255	M	75.6	Confident	79	Confident	19 Å²	19	70 Å²	70	9%	0.094	36%	0.358	C	S	.	.	H	α-helix	trans	-62.2	-37.4	177.1	-76.8	-163.3	140	0	0	112.3	A152 Y251 I252 F257 N258	A152-M255 HydrophobicContact CB-CE 3.78Å; A152-M255 HydrophobicContact CB-SD 3.29Å; A152-M255 WeakPolarHBondContact CB-SD 3.46Å; Y251-M255 HydrophobicContact CD1-SD 4.29Å; Y251-M255 HydrophobicContact CD2-CG 4.4Å; Y251-M255 HydrophobicContact CE1-CE 4.25Å; Y251-M255 HydrophobicContact CE1-CG 4.45Å; Y251-M255 HydrophobicContact CE1-SD 3.53Å; Y251-M255 VanDerWaalsContact CE1-SD 3.53Å; Y251-M255 HydrophobicContact CE2-CE 3.74Å; Y251-M255 HydrophobicContact CE2-CG 4.09Å; Y251-M255 HydrophobicContact CE2-SD 3.8Å; Y251-M255 WeakPolarHBondContact O-CG 3.44Å; Y251-M255 PolarHBondContact O-N 2.83Å; Y251-M255 WeakPolarHBondContact OH-CE 3.48Å; Y251-M255 PolarHBondContact OH-SD 3.18Å; Y251-M255 VanDerWaalsContact OH-SD 3.36Å; I252-M255 PolarHBondContact O-N 2.94Å; M255-F257 VanDerWaalsContact C-N 3.25Å; M255-F257 PolarHBondContact O-N 3.01Å; M255-N258 WeakPolarHBondContact O-CB 3.08Å; M255-N258 PolarHBondContact O-N 3.18Å
256	K	75.5	Confident	77.7	Confident	138 Å²	138	72.9 Å²	72.9	60%	0.6	37%	0.37	S	S	*	.	H	α-helix	trans	-59.8	-35.5	173.3	-174.9	179.4	179.7	176.5	0	112.5	I252 L253 V254	I252-K256 WeakPolarHBondContact O-CB 2.92Å; I252-K256 PolarHBondContact O-N 3.34Å; L253-K256 WeakPolarHBondContact O-CB 3.11Å; L253-K256 PolarHBondContact O-N 2.86Å; V254-K256 VanDerWaalsContact C-N 3.28Å; V254-K256 PolarHBondContact O-N 2.94Å
257	F	79	Confident	75.7	Confident	127 Å²	127	71.3 Å²	71.3	56%	0.557	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	7.9	177	-65.1	-68	0	0	0	113.8	L253 V254 M255 S259 S260 M261	L253-F257 WeakPolarHBondContact O-CD2 3.39Å; L253-F257 PolarHBondContact O-N 2.92Å; V254-F257 CarbonylContact O-C 3.55Å; V254-F257 PolarHBondContact O-N 2.59Å; V254-F257 VanDerWaalsContact O-N 3.07Å; M255-F257 VanDerWaalsContact C-N 3.25Å; M255-F257 PolarHBondContact O-N 3.01Å; F257-S259 PolarHBondContact O-N 3.23Å; F257-S260 WeakPolarHBondContact O-CB 3.49Å; F257-S260 PolarHBondContact O-N 3.48Å; F257-M261 PolarHBondContact O-N 3.43Å; F257-M261 VanDerWaalsContact O-N 3.08Å
258	N	73.7	Confident	73.6	Confident	16 Å²	16	77 Å²	77	9%	0.086	40%	0.396	C	S	.	.	H	α-helix	trans	-56.1	-44.4	-174.8	174.6	57.1	0	0	0	112.9	R215 V254 M255 S260 M261 Q262	R215-N258 WeakPolarHBondContact CD-OD1 3.23Å; R215-N258 PolarHBondContact NH1-ND2 3.07Å; R215-N258 PolarHBondContact NH1-OD1 3.22Å; V254-N258 PolarHBondContact O-N 3.23Å; M255-N258 WeakPolarHBondContact O-CB 3.08Å; M255-N258 PolarHBondContact O-N 3.18Å; N258-S260 PolarHBondContact O-N 2.72Å; N258-M261 WeakPolarHBondContact O-CB 3.16Å; N258-M261 PolarHBondContact O-N 3.31Å; N258-Q262 WeakPolarHBondContact O-CB 3.42Å; N258-Q262 PolarHBondContact O-N 3.45Å
259	S	65.4	Low	71.3	Confident	50 Å²	50	80.4 Å²	80.4	35%	0.35	42%	0.423	S	S	.	.	H	α-helix	trans	-66.9	-21.9	-178.9	-31.8	0	0	0	0	113	F257 R263	F257-S259 PolarHBondContact O-N 3.23Å; S259-R263 WeakPolarHBondContact O-CG 3.49Å; S259-R263 PolarHBondContact O-NE 3.12Å
260	S	67.4	Low	69	Low	73 Å²	73	84.8 Å²	84.8	51%	0.51	44%	0.439	S	S	.	.	H	α-helix	trans	-78.6	-41.7	171.3	-169.3	0	0	0	0	110.9	F257 N258 R263 F264	F257-S260 WeakPolarHBondContact O-CB 3.49Å; F257-S260 PolarHBondContact O-N 3.48Å; N258-S260 PolarHBondContact O-N 2.72Å; S260-R263 PolarHBondContact O-N 2.96Å; S260-F264 PolarHBondContact O-N 3.29Å
261	M	68.1	Low	66.5	Low	51 Å²	51	92.2 Å²	92.2	25%	0.251	46%	0.463	S	S	.	.	H	α-helix	trans	-65.7	-43.3	178.6	-166.1	173.2	51.6	0	0	111.7	W211 R215 V254 F257 N258 R263 F264 F265	W211-M261 HydrophobicContact CH2-CG 4.23Å; W211-M261 HydrophobicContact CZ2-CE 3.92Å; W211-M261 HydrophobicContact CZ2-CG 3.83Å; W211-M261 HydrophobicContact CZ2-SD 4.24Å; R215-M261 HydrophobicContact CG-CE 4.19Å; V254-M261 HydrophobicContact CG1-CE 4.05Å; F257-M261 PolarHBondContact O-N 3.43Å; F257-M261 VanDerWaalsContact O-N 3.08Å; N258-M261 WeakPolarHBondContact O-CB 3.16Å; N258-M261 PolarHBondContact O-N 3.31Å; M261-R263 VanDerWaalsContact C-N 3.34Å; M261-R263 PolarHBondContact O-N 2.75Å; M261-F264 PolarHBondContact O-N 3.31Å; M261-F264 VanDerWaalsContact O-N 3.16Å; M261-F265 HydrophobicContact CG-CD2 3.78Å; M261-F265 HydrophobicContact CG-CE2 3.93Å; M261-F265 WeakPolarHBondContact O-CD2 3.18Å; M261-F265 PolarHBondContact O-N 2.87Å
262	Q	68.7	Low	64.1	Low	77 Å²	77	99.6 Å²	99.6	36%	0.36	50%	0.502	S	S	.	.	H	α-helix	trans	-59.7	-44	175.9	-170.5	177.7	-3.8	0	0	111.4	N258 F264 M266	N258-Q262 WeakPolarHBondContact O-CB 3.42Å; N258-Q262 PolarHBondContact O-N 3.45Å; Q262-F264 VanDerWaalsContact C-N 3.35Å; Q262-F264 PolarHBondContact O-N 3.48Å; Q262-M266 HydrophobicContact CG-CG 4.38Å; Q262-M266 HydrophobicContact CG-SD 3.4Å; Q262-M266 WeakPolarHBondContact CG-SD 3.33Å; Q262-M266 VanDerWaalsContact O-CB 3.25Å; Q262-M266 WeakPolarHBondContact O-CB 3.44Å; Q262-M266 PolarHBondContact O-N 2.98Å
263	R	69.8	Low	61.9	Low	185 Å²	185	102.7 Å²	102.7	70%	0.698	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-36.8	175.2	-79.9	-175.1	-81.2	174.6	-8.7	112.9	S259 S260 M261 G267	S259-R263 WeakPolarHBondContact O-CG 3.49Å; S259-R263 PolarHBondContact O-NE 3.12Å; S260-R263 PolarHBondContact O-N 2.96Å; M261-R263 VanDerWaalsContact C-N 3.34Å; M261-R263 PolarHBondContact O-N 2.75Å; R263-G267 WeakPolarHBondContact O-CA 3.35Å; R263-G267 PolarHBondContact O-N 3.42Å
264	F	69.7	Low	59.6	Low	142 Å²	142	102.9 Å²	102.9	62%	0.623	54%	0.54	S	S	*	.	H	α-helix	trans	-70.2	-44	177.9	-175.5	-99.5	0	0	0	112.7	S260 M261 Q262	S260-F264 PolarHBondContact O-N 3.29Å; M261-F264 PolarHBondContact O-N 3.31Å; M261-F264 VanDerWaalsContact O-N 3.16Å; Q262-F264 VanDerWaalsContact C-N 3.35Å; Q262-F264 PolarHBondContact O-N 3.48Å
265	F	66.3	Low	57.2	Low	115 Å²	115	108.8 Å²	108.8	50%	0.504	57%	0.57	S	S	.	*	H	α-helix	trans	-76.8	-45.9	-179.2	-87.3	-90.2	0	0	0	112.6	W211 M261	W211-F265 HydrophobicContact CE3-CB 4.41Å; W211-F265 HydrophobicContact CH2-CB 3.68Å; W211-F265 AromaticContact CH2-CD1 3.87Å; W211-F265 HydrophobicContact CH2-CD1 3.87Å; W211-F265 AromaticContact CH2-CD2 3.39Å; W211-F265 HydrophobicContact CH2-CD2 3.39Å; W211-F265 HydrophobicContact CH2-CE1 4.34Å; W211-F265 AromaticContact CH2-CE2 3.91Å; W211-F265 HydrophobicContact CH2-CE2 3.91Å; W211-F265 AromaticContact CH2-CG 3.36Å; W211-F265 HydrophobicContact CH2-CG 3.36Å; W211-F265 HydrophobicContact CH2-CZ 4.35Å; W211-F265 HydrophobicContact CZ2-CB 4.23Å; W211-F265 HydrophobicContact CZ2-CD2 4.09Å; W211-F265 HydrophobicContact CZ2-CG 4.24Å; W211-F265 HydrophobicContact CZ3-CB 3.78Å; W211-F265 AromaticContact CZ3-CD1 3.77Å; W211-F265 HydrophobicContact CZ3-CD1 3.77Å; W211-F265 HydrophobicContact CZ3-CD2 4.14Å; W211-F265 HydrophobicContact CZ3-CE1 4.37Å; W211-F265 AromaticContact CZ3-CG 3.63Å; W211-F265 HydrophobicContact CZ3-CG 3.63Å; M261-F265 HydrophobicContact CG-CD2 3.78Å; M261-F265 HydrophobicContact CG-CE2 3.93Å; M261-F265 WeakPolarHBondContact O-CD2 3.18Å; M261-F265 PolarHBondContact O-N 2.87Å
266	M	66.3	Low	54.9	Low	105 Å²	105	111 Å²	111	52%	0.517	60%	0.598	S	S	.	*	H	α-helix	trans	-78.9	-29.2	179	-67.7	170.4	61.2	0	0	112.7	Q262 K268 S269	Q262-M266 HydrophobicContact CG-CG 4.38Å; Q262-M266 HydrophobicContact CG-SD 3.4Å; Q262-M266 WeakPolarHBondContact CG-SD 3.33Å; Q262-M266 VanDerWaalsContact O-CB 3.25Å; Q262-M266 WeakPolarHBondContact O-CB 3.44Å; Q262-M266 PolarHBondContact O-N 2.98Å; M266-K268 PolarHBondContact O-N 3.48Å; M266-K268 VanDerWaalsContact O-N 3.16Å; M266-S269 PolarHBondContact O-N 3.15Å
267	G	51.7	Low	52.7	Low	56 Å²	56	112.5 Å²	112.5	58%	0.577	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-14	175.7	0	0	0	0	0	114.3	R263	R263-G267 WeakPolarHBondContact O-CA 3.35Å; R263-G267 PolarHBondContact O-N 3.42Å
268	K	47.4	Very low	50.2	Low	162 Å²	162	111.2 Å²	111.2	70%	0.704	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-17.7	173.3	-123.1	174.4	-178.7	176.6	0	113.5	M266 N270	M266-K268 PolarHBondContact O-N 3.48Å; M266-K268 VanDerWaalsContact O-N 3.16Å; K268-N270 PolarHBondContact O-N 2.93Å
269	S	42	Very low	47.9	Very low	96 Å²	96	114.5 Å²	114.5	67%	0.671	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-4	-173.5	-164.3	0	0	0	0	114.7	M266	M266-S269 PolarHBondContact O-N 3.15Å
270	N	41.8	Very low	46.2	Very low	143 Å²	143	118.8 Å²	118.8	77%	0.765	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	17.9	-177.7	-116.4	9.4	0	0	0	115.5	K268	K268-N270 PolarHBondContact O-N 2.93Å
271	K	36.6	Very low	44.2	Very low	186 Å²	186	121 Å²	121	81%	0.809	70%	0.695	S	S	*	*	S	Bend	trans	-93.9	-5.3	175	-96.2	-179.5	177	174.3	0	115.8
272	N	33.7	Very low	42.2	Very low	158 Å²	158	124.6 Å²	124.6	85%	0.845	73%	0.725	S	S	*	*	S	Bend	trans	-121.3	11.8	-174.3	-73.4	-5.5	0	0	0	116.1
273	V	37.8	Very low	40.2	Very low	121 Å²	121	129.9 Å²	129.9	73%	0.733	75%	0.749	S	S	*	*			trans	-134.8	73.9	172.2	-169.7	0	0	0	0	110.2
274	A	34.8	Very low	38.1	Very low	103 Å²	103	130.4 Å²	130.4	85%	0.851	76%	0.762	S	S	*	*			trans	-105.6	79.4	158.6	0	0	0	0	0	108.2
275	N	30.6	Very low	36.1	Very low	162 Å²	162	132.3 Å²	132.3	87%	0.866	77%	0.773	S	S	*	*			trans	-169.8	124.1	143.5	-131.2	5.3	0	0	0	111.5
276	G	27.3	Very low	34.2	Very low	66 Å²	66	135 Å²	135	68%	0.68	79%	0.793	S	S	*	*			trans	108.3	92.7	157.7	0	0	0	0	0	117
277	N	29	Very low	32.2	Very low	168 Å²	168	136.2 Å²	136.2	90%	0.898	81%	0.806	S	S	*	*			trans	24	115.7	145.3	-57.3	-5	0	0	0	119.8
278	A	25.8	Very low	30.8	Very low	100 Å²	100	143.5 Å²	143.5	83%	0.826	82%	0.821	S	S	*	*				167.3	133.4	114.8	0	0	0	0	0	112.8
279	A	27	Very low	30	Very low	85 Å²	85	141.2 Å²	141.2	70%	0.702	82%	0.823	S	S	*	*			trans	62	105.1	142.1	0	0	0	0	0	121.2
280	T	28.4	Very low	29.1	Very low	141 Å²	141	142.4 Å²	142.4	87%	0.865	83%	0.831	S	S	*	*				51	96.7	129.5	52.2	0	0	0	0	119.2
281	S	25.8	Very low	28.3	Very low	120 Å²	120	145.9 Å²	145.9	84%	0.839	84%	0.84	S	S	*	*			trans	-143.6	117.4	138.1	42.5	0	0	0	0	108
282	S	24.9	Very low	27.6	Very low	126 Å²	126	142 Å²	142	88%	0.881	84%	0.842	S	S	*	*			trans	-91.3	105.9	176	27.8	0	0	0	0	107.6
283	E	27.4	Very low	27.1	Very low	188 Å²	188	144.9 Å²	144.9	88%	0.879	84%	0.843	S	S	*	*			trans	-106.8	135.6	155.4	-74.6	-166.6	141.4	0	0	108.9	E285	E283-E285 PolarHBondContact O-N 3.41Å
284	M	26.6	Very low	26.4	Very low	195 Å²	195	145 Å²	145	96%	0.961	85%	0.849	S	S	*	*			trans	-85.3	106.2	-167.1	-157.7	164.4	172.7	0	0	106.9
285	E	27.5	Very low	26	Very low	183 Å²	183	151 Å²	151	86%	0.855	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-80	128.5	170.8	-82.9	-172.7	154.5	0	0	110.4	E283	E283-E285 PolarHBondContact O-N 3.41Å
286	D	26.4	Very low	25.7	Very low	172 Å²	172	146.9 Å²	146.9	92%	0.92	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-65.3	127.8	173.7	-94.9	-39	0	0	0	111.7
287	V	23.4	Very low	25.5	Very low	130 Å²	130	149 Å²	149	79%	0.788	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-92.8	123.1	175.9	176	0	0	0	0	109.7
288	K	23.7	Very low	25.4	Very low	208 Å²	208	147.6 Å²	147.6	90%	0.904	85%	0.847	S	S	*	*			trans	-135.4	153.9	149	-94.8	-168.9	179.5	174	0	111.6
289	P	29.4	Very low	25.6	Very low	115 Å²	115	148 Å²	148	75%	0.747	84%	0.839	S	S	*	*			trans	-108	146.7	-139.7	37.4	-30	0	0	0	113.5
290	S	23.8	Very low	25.9	Very low	121 Å²	121	151.2 Å²	151.2	85%	0.846	84%	0.842	S	S	*	*			trans	-160.4	121.6	151	57.6	0	0	0	0	111.5
291	K	24.1	Very low	26.5	Very low	215 Å²	215	149.5 Å²	149.5	94%	0.935	83%	0.831	S	S	*	*			trans	-64.2	144.2	172.4	-76.7	174.1	172.8	174.2	0	111.7
292	A	22.9	Very low	26.8	Very low	104 Å²	104	149.8 Å²	149.8	86%	0.86	82%	0.823	S	S	*	*			trans	-148.2	133.8	141.8	0	0	0	0	0	110.1
293	Y	22.2	Very low	27.5	Very low	219 Å²	219	151.5 Å²	151.5	86%	0.859	82%	0.817	S	S	*	*			trans	-78.3	142.8	-173.7	-143.8	-97.4	0	0	0	111.1
294	S	23.6	Very low	27.8	Very low	125 Å²	125	150 Å²	150	87%	0.874	81%	0.812	S	S	*	*			trans	-146.4	144	153.9	-177.7	0	0	0	0	109.9
295	R	25.3	Very low	27.9	Very low	227 Å²	227	147.8 Å²	147.8	86%	0.857	80%	0.801	S	S	*	*			trans	-118.9	143.1	-151.3	-175.3	-176.1	-178.3	168.6	0.4	110.7
296	G	24.3	Very low	28.3	Very low	76 Å²	76	146 Å²	146	78%	0.784	80%	0.797	S	S	*	*			trans	103.3	124.6	165.7	0	0	0	0	0	112.5
297	S	23.5	Very low	28.7	Very low	112 Å²	112	141.5 Å²	141.5	78%	0.783	78%	0.784	S	S	*	*				-171.2	135.7	52.8	155.1	0	0	0	0	111.2
298	V	26.9	Very low	29.6	Very low	137 Å²	137	140 Å²	140	83%	0.83	78%	0.779	S	S	*	*			trans	51.5	115	147.6	-167.4	0	0	0	0	120.8
299	V	31.2	Very low	30.1	Very low	109 Å²	109	135 Å²	135	66%	0.661	77%	0.768	S	S	*	*			trans	-39	142.5	167.9	-178.4	0	0	0	0	117	V301	V299-V301 HydrophobicContact CG1-CG2 3.78Å
300	M	32.9	Very low	30.5	Very low	152 Å²	152	134.3 Å²	134.3	75%	0.749	77%	0.766	S	S	*	*			trans	-130.3	128	139.1	-73.2	-66.5	-84.8	0	0	110.3	D302 E303	M300-D302 PolarHBondContact O-N 3.01Å; M300-E303 PolarHBondContact O-N 3.49Å
301	V	39.8	Very low	31	Very low	105 Å²	105	137.3 Å²	137.3	64%	0.636	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-68.1	-11.9	-169.9	176.1	0	0	0	0	113.4	V299 E303	V299-V301 HydrophobicContact CG1-CG2 3.78Å; V301-E303 VanDerWaalsContact C-N 3.29Å; V301-E303 PolarHBondContact O-N 3.21Å
302	D	33.1	Very low	31.6	Very low	127 Å²	127	137 Å²	137	68%	0.679	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-70.9	-19.7	176.4	-85.6	-13	0	0	0	113.8	M300	M300-D302 PolarHBondContact O-N 3.01Å
303	E	40.2	Very low	32.6	Very low	161 Å²	161	143.4 Å²	143.4	75%	0.752	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-85.3	-19.4	-177.4	-145	143.6	-167.8	0	0	112.7	M300 V301	M300-E303 PolarHBondContact O-N 3.49Å; V301-E303 VanDerWaalsContact C-N 3.29Å; V301-E303 PolarHBondContact O-N 3.21Å
304	M	32.1	Very low	34	Very low	156 Å²	156	140 Å²	140	77%	0.768	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-23.1	170.4	-81.5	179.2	69.8	0	0	112.9	N306 A307	M304-N306 VanDerWaalsContact C-N 3.29Å; M304-N306 PolarHBondContact O-N 3.02Å; M304-A307 PolarHBondContact O-N 3.36Å
305	M	29.7	Very low	35.6	Very low	150 Å²	150	136.6 Å²	136.6	74%	0.739	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-15.7	176.1	-79.6	-177	45.2	0	0	113.3
306	N	36.7	Very low	37.1	Very low	144 Å²	144	132 Å²	132	77%	0.77	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-3	174.3	-132.4	10.8	0	0	0	113.4	M304 S308	M304-N306 VanDerWaalsContact C-N 3.29Å; M304-N306 PolarHBondContact O-N 3.02Å; N306-S308 VanDerWaalsContact C-N 3.34Å
307	A	34.8	Very low	38.5	Very low	79 Å²	79	131 Å²	131	65%	0.653	70%	0.702	S	S	*	*	S	Bend	trans	-83.6	-5	-178.5	0	0	0	0	0	113.9	M304	M304-A307 PolarHBondContact O-N 3.36Å
308	S	41.8	Very low	40.2	Very low	97 Å²	97	125.8 Å²	125.8	68%	0.678	67%	0.666	S	S	*	*			trans	-175.2	108	166	41.8	0	0	0	0	113.8	N306	N306-S308 VanDerWaalsContact C-N 3.34Å
309	P	33.6	Very low	41.8	Very low	104 Å²	104	124.4 Å²	124.4	68%	0.675	65%	0.654	S	S	*	*			trans	-97.9	95.8	150.7	32.3	-21.2	0	0	0	108.4	K311	P309-K311 PolarHBondContact O-N 3.11Å
310	S	37.7	Very low	43.2	Very low	101 Å²	101	126.9 Å²	126.9	71%	0.706	65%	0.651	S	S	*	*			trans	-54.5	133.8	154.1	59.6	0	0	0	0	109.2
311	K	35.2	Very low	44.6	Very low	183 Å²	183	121.4 Å²	121.4	80%	0.796	63%	0.626	S	S	*	*			trans	101.9	72.8	161.9	-58.6	173.4	176.8	173.4	0	118.6	P309	P309-K311 PolarHBondContact O-N 3.11Å
312	F	36.7	Very low	45.5	Very low	208 Å²	208	120.8 Å²	120.8	91%	0.912	62%	0.617	S	S	*	*			trans	-135	101.8	133.5	-66.4	-81.1	0	0	0	105
313	R	43.6	Very low	46.8	Very low	239 Å²	239	120.2 Å²	120.2	90%	0.902	62%	0.618	S	S	*	*				73.3	88.9	54.8	-151.8	177	172.9	163.8	-1.8	113.8
314	F	51.7	Low	47.7	Very low	149 Å²	149	115.1 Å²	115.1	65%	0.654	60%	0.598	S	S	*	*	S	Bend	trans	71.8	158.1	175.7	-97.4	-86.8	0	0	0	116.2	E316	F314-E316 PolarHBondContact O-N 3.15Å
315	P	57.1	Low	48.8	Very low	53 Å²	53	113.2 Å²	113.2	34%	0.344	60%	0.6	S	S	.	*				-104.9	93.4	-123.6	33.1	-11.4	0	0	0	111.7	A317 G318 L319 I340	P315-A317 VanDerWaalsContact C-N 3.27Å; P315-A317 PolarHBondContact O-N 3.49Å; P315-G318 PolarHBondContact O-N 3.14Å; P315-L319 WeakPolarHBondContact O-CB 3.48Å; P315-L319 PolarHBondContact O-N 3.46Å; P315-I340 HydrophobicContact CB-CG1 4.16Å; P315-I340 HydrophobicContact CG-CD1 4.16Å; P315-I340 HydrophobicContact CG-CG1 4.13Å
316	E	56.4	Low	49.6	Very low	131 Å²	131	113.7 Å²	113.7	61%	0.612	60%	0.601	S	S	*	*	H	α-helix	trans	-62	-34.9	-178.3	-149.1	-168.2	139.4	0	0	112.5	F314 R320	F314-E316 PolarHBondContact O-N 3.15Å; E316-R320 WeakPolarHBondContact O-CB 3.45Å; E316-R320 PolarHBondContact O-N 2.74Å; E316-R320 IonicContact OE1-CZ 3.93Å; E316-R320 IonicContact OE1-NH2 3.41Å; E316-R320 PolarHBondContact OE1-NH2 2.92Å
317	A	53.8	Low	51	Low	54 Å²	54	112.6 Å²	112.6	45%	0.446	59%	0.589	S	S	.	*	H	α-helix	trans	-69.2	-41.1	177	0	0	0	0	0	113.2	P315 V321 L339	P315-A317 VanDerWaalsContact C-N 3.27Å; P315-A317 PolarHBondContact O-N 3.49Å; A317-V321 VanDerWaalsContact O-CG2 3.29Å; A317-V321 WeakPolarHBondContact O-CG2 3.34Å; A317-V321 PolarHBondContact O-N 2.84Å; A317-V321 VanDerWaalsContact O-N 3.11Å; A317-L339 HydrophobicContact CB-CD2 4.08Å
318	G	60	Low	52.6	Low	3 Å²	3	110.7 Å²	110.7	3%	0.031	58%	0.577	C	S	.	*	H	α-helix	trans	-68.4	-39.7	176.2	0	0	0	0	0	112.1	P315 V321 M322	P315-G318 PolarHBondContact O-N 3.14Å; G318-V321 PolarHBondContact O-N 3.27Å; G318-M322 WeakPolarHBondContact O-CG 3.47Å; G318-M322 PolarHBondContact O-N 3.12Å; G318-M322 VanDerWaalsContact O-N 3.1Å
319	L	59.7	Low	53.5	Low	107 Å²	107	110.7 Å²	110.7	56%	0.56	57%	0.574	S	S	*	*	H	α-helix	trans	-66.7	-42.2	175.6	-165.4	70.7	0	0	0	111.3	P315 V321 M322 V323	P315-L319 WeakPolarHBondContact O-CB 3.48Å; P315-L319 PolarHBondContact O-N 3.46Å; L319-V321 VanDerWaalsContact C-N 3.32Å; L319-V321 PolarHBondContact O-N 3.08Å; L319-M322 PolarHBondContact O-N 3.33Å; L319-M322 VanDerWaalsContact O-N 3.1Å; L319-V323 VanDerWaalsContact O-CG2 3.29Å; L319-V323 WeakPolarHBondContact O-CG2 3.35Å; L319-V323 PolarHBondContact O-N 3.27Å
320	R	60.7	Low	54.7	Low	162 Å²	162	114.7 Å²	114.7	61%	0.611	58%	0.581	S	S	*	*	H	α-helix	trans	-60.9	-41.1	176.7	-160	179.5	-69.7	-153.8	2.2	111.2	E316 M322 V323 T324	E316-R320 WeakPolarHBondContact O-CB 3.45Å; E316-R320 PolarHBondContact O-N 2.74Å; E316-R320 IonicContact OE1-CZ 3.93Å; E316-R320 IonicContact OE1-NH2 3.41Å; E316-R320 PolarHBondContact OE1-NH2 2.92Å; R320-M322 PolarHBondContact O-N 2.84Å; R320-V323 PolarHBondContact O-N 3.28Å; R320-T324 WeakPolarHBondContact O-CG2 3.26Å; R320-T324 PolarHBondContact O-N 3.13Å; R320-T324 VanDerWaalsContact O-N 3.09Å
321	V	62.3	Low	56.3	Low	37 Å²	37	113.5 Å²	113.5	22%	0.224	57%	0.57	C	S	.	*	H	α-helix	trans	-63.6	-38.4	173.6	171.6	0	0	0	0	112.3	A317 G318 L319 T324 M335	A317-V321 VanDerWaalsContact O-CG2 3.29Å; A317-V321 WeakPolarHBondContact O-CG2 3.34Å; A317-V321 PolarHBondContact O-N 2.84Å; A317-V321 VanDerWaalsContact O-N 3.11Å; G318-V321 PolarHBondContact O-N 3.27Å; L319-V321 VanDerWaalsContact C-N 3.32Å; L319-V321 PolarHBondContact O-N 3.08Å; V321-T324 PolarHBondContact O-OG1 2.94Å; V321-M335 HydrophobicContact CG1-CB 3.95Å
322	M	59.1	Low	57.9	Low	91 Å²	91	107.7 Å²	107.7	45%	0.448	54%	0.543	S	S	.	.	H	α-helix	trans	-70.1	-31.8	177.3	-73	-178.4	67.5	0	0	113.5	G318 L319 R320 R332 L333 A336	G318-M322 WeakPolarHBondContact O-CG 3.47Å; G318-M322 PolarHBondContact O-N 3.12Å; G318-M322 VanDerWaalsContact O-N 3.1Å; L319-M322 PolarHBondContact O-N 3.33Å; L319-M322 VanDerWaalsContact O-N 3.1Å; R320-M322 PolarHBondContact O-N 2.84Å; M322-R332 PolarHBondContact O-NH1 2.92Å; M322-L333 HydrophobicContact CE-CD1 4.46Å; M322-A336 HydrophobicContact CG-CB 3.78Å; M322-A336 HydrophobicContact SD-CB 4.06Å
323	V	60	Low	59.4	Low	115 Å²	115	103.2 Å²	103.2	70%	0.697	53%	0.528	S	S	*	.	H	α-helix	trans	-82.4	-23.4	179.8	179.3	0	0	0	0	112.1	L319 R320	L319-V323 VanDerWaalsContact O-CG2 3.29Å; L319-V323 WeakPolarHBondContact O-CG2 3.35Å; L319-V323 PolarHBondContact O-N 3.27Å; R320-V323 PolarHBondContact O-N 3.28Å
324	T	59.1	Low	60.5	Low	54 Å²	54	99.8 Å²	99.8	33%	0.331	52%	0.515	S	S	.	.			trans	-64.6	137.8	174.8	69.8	0	0	0	0	111.7	R320 V321 R332	R320-T324 WeakPolarHBondContact O-CG2 3.26Å; R320-T324 PolarHBondContact O-N 3.13Å; R320-T324 VanDerWaalsContact O-N 3.09Å; V321-T324 PolarHBondContact O-OG1 2.94Å; T324-R332 WeakPolarHBondContact O-CD 3.41Å; T324-R332 PolarHBondContact O-NH1 3.44Å
325	S	54.7	Low	60.8	Low	117 Å²	117	97.7 Å²	97.7	82%	0.818	51%	0.508	S	S	*	.	S	Bend	trans	-91	-0.7	177.6	56.2	0	0	0	0	113.6	F327	S325-F327 VanDerWaalsContact C-N 3.25Å; S325-F327 PolarHBondContact O-N 3.26Å
326	H	47.5	Very low	61.3	Low	160 Å²	160	95.3 Å²	95.3	74%	0.741	49%	0.493	S	S	*	.	S	Bend	trans	-73.2	-13.7	-170.4	-143.8	-65.9	0	0	0	114.1
327	F	65.2	Low	61.7	Low	121 Å²	121	91.4 Å²	91.4	53%	0.531	48%	0.48	S	S	.	.	S	Bend	trans	-134	149.1	-177	-58.5	-72.4	0	0	0	111.8	S325 R332	S325-F327 VanDerWaalsContact C-N 3.25Å; S325-F327 PolarHBondContact O-N 3.26Å; F327-R332 HydrophobicContact CB-CG 3.96Å; F327-R332 VanDerWaalsContact O-CD 3.27Å; F327-R332 WeakPolarHBondContact O-CD 3.22Å; F327-R332 PolarHBondContact O-NE 2.87Å
328	G	69.7	Low	62.2	Low	38 Å²	38	95.2 Å²	95.2	39%	0.392	48%	0.483	S	S	.	.			trans	-58.7	154.6	177.7	0	0	0	0	0	113.6	K330 T331 R332	G328-K330 VanDerWaalsContact C-N 3.31Å; G328-K330 PolarHBondContact O-N 3.44Å; G328-T331 PolarHBondContact O-N 2.8Å; G328-T331 VanDerWaalsContact O-N 3.1Å; G328-R332 PolarHBondContact O-N 3.4Å; G328-R332 VanDerWaalsContact O-N 3.14Å
329	P	59.4	Low	62.2	Low	97 Å²	97	98.7 Å²	98.7	63%	0.63	50%	0.501	S	S	*	.	H	α-helix	trans	-58	-35.9	-172.9	18.9	-29.6	0	0	0	114.1	L333	P329-L333 PolarHBondContact O-N 3.41Å
330	K	60.1	Low	62.4	Low	189 Å²	189	96.7 Å²	96.7	82%	0.822	49%	0.49	S	S	*	.	H	α-helix	trans	-68.6	-38.6	177.1	-69.3	-174.5	176.6	-178.8	0	112.8	G328 R334	G328-K330 VanDerWaalsContact C-N 3.31Å; G328-K330 PolarHBondContact O-N 3.44Å; K330-R334 WeakPolarHBondContact O-CB 3.4Å; K330-R334 PolarHBondContact O-N 3.27Å; K330-R334 VanDerWaalsContact O-N 3.15Å
331	T	69.4	Low	62.6	Low	75 Å²	75	93.5 Å²	93.5	46%	0.46	48%	0.484	S	S	.	.	H	α-helix	trans	-70.1	-39.1	-179.8	-49.7	0	0	0	0	111.3	G328 R334 M335	G328-T331 PolarHBondContact O-N 2.8Å; G328-T331 VanDerWaalsContact O-N 3.1Å; T331-R334 PolarHBondContact O-N 2.82Å; T331-M335 HydrophobicContact CG2-CG 4.45Å; T331-M335 WeakPolarHBondContact O-CB 3.48Å; T331-M335 WeakPolarHBondContact O-CG 3.42Å; T331-M335 PolarHBondContact O-N 3.34Å
332	R	69.4	Low	62.6	Low	61 Å²	61	95.1 Å²	95.1	23%	0.23	49%	0.494	C	S	.	.	H	α-helix	trans	-61.8	-46.9	176.1	-69.4	-177.1	-70.6	172.9	-1.3	112.2	M322 T324 F327 G328 R334 M335 A336	M322-R332 PolarHBondContact O-NH1 2.92Å; T324-R332 WeakPolarHBondContact O-CD 3.41Å; T324-R332 PolarHBondContact O-NH1 3.44Å; F327-R332 HydrophobicContact CB-CG 3.96Å; F327-R332 VanDerWaalsContact O-CD 3.27Å; F327-R332 WeakPolarHBondContact O-CD 3.22Å; F327-R332 PolarHBondContact O-NE 2.87Å; G328-R332 PolarHBondContact O-N 3.4Å; G328-R332 VanDerWaalsContact O-N 3.14Å; R332-R334 VanDerWaalsContact C-N 3.34Å; R332-R334 PolarHBondContact O-N 2.84Å; R332-M335 PolarHBondContact O-N 2.86Å; R332-A336 VanDerWaalsContact O-CB 3.27Å; R332-A336 WeakPolarHBondContact O-CB 3.18Å; R332-A336 PolarHBondContact O-N 3.47Å
333	L	67.8	Low	62.5	Low	115 Å²	115	95.6 Å²	95.6	60%	0.602	50%	0.495	S	S	*	.	H	α-helix	trans	-61.7	-43	177.7	-160.3	95.3	0	0	0	111.5	M322 P329 S337	M322-L333 HydrophobicContact CE-CD1 4.46Å; P329-L333 PolarHBondContact O-N 3.41Å; L333-S337 VanDerWaalsContact O-CB 3.3Å; L333-S337 WeakPolarHBondContact O-CB 3.25Å; L333-S337 PolarHBondContact O-N 3.12Å; L333-S337 PolarHBondContact O-OG 3.1Å
334	R	66.5	Low	62.3	Low	167 Å²	167	96.5 Å²	96.5	63%	0.63	49%	0.486	S	S	*	.	H	α-helix	trans	-67.6	-43.6	-178.5	-153.6	176.1	-169.8	-172.7	2.2	111.9	K330 T331 R332 S337 R338	K330-R334 WeakPolarHBondContact O-CB 3.4Å; K330-R334 PolarHBondContact O-N 3.27Å; K330-R334 VanDerWaalsContact O-N 3.15Å; T331-R334 PolarHBondContact O-N 2.82Å; R332-R334 VanDerWaalsContact C-N 3.34Å; R332-R334 PolarHBondContact O-N 2.84Å; R334-S337 WeakPolarHBondContact CA-OG 3.36Å; R334-S337 PolarHBondContact O-N 2.93Å; R334-S337 PolarHBondContact O-OG 3.24Å; R334-R338 PolarHBondContact O-N 2.91Å
335	M	59.9	Low	62.2	Low	104 Å²	104	99.7 Å²	99.7	51%	0.512	50%	0.497	S	S	.	.	H	α-helix	trans	-66.1	-44.9	177	-72	-67.1	-76.6	0	0	111.9	V321 T331 R332 S337 R338 L339	V321-M335 HydrophobicContact CG1-CB 3.95Å; T331-M335 HydrophobicContact CG2-CG 4.45Å; T331-M335 WeakPolarHBondContact O-CB 3.48Å; T331-M335 WeakPolarHBondContact O-CG 3.42Å; T331-M335 PolarHBondContact O-N 3.34Å; R332-M335 PolarHBondContact O-N 2.86Å; M335-S337 VanDerWaalsContact C-N 3.33Å; M335-S337 PolarHBondContact O-N 2.86Å; M335-R338 PolarHBondContact O-N 3.05Å; M335-L339 PolarHBondContact O-N 3.44Å
336	A	66.4	Low	62.3	Low	3 Å²	3	100 Å²	100	3%	0.025	48%	0.484	C	S	.	.	H	α-helix	trans	-60.7	-42.1	174.8	0	0	0	0	0	111.6	M322 R332 L339 I340	M322-A336 HydrophobicContact CG-CB 3.78Å; M322-A336 HydrophobicContact SD-CB 4.06Å; R332-A336 VanDerWaalsContact O-CB 3.27Å; R332-A336 WeakPolarHBondContact O-CB 3.18Å; R332-A336 PolarHBondContact O-N 3.47Å; A336-L339 PolarHBondContact O-N 2.87Å; A336-I340 WeakPolarHBondContact O-CD1 3.45Å; A336-I340 VanDerWaalsContact O-CG1 3.25Å; A336-I340 WeakPolarHBondContact O-CG1 3.37Å; A336-I340 PolarHBondContact O-N 3.01Å; A336-I340 VanDerWaalsContact O-N 3.08Å
337	S	65.9	Low	62.5	Low	49 Å²	49	97 Å²	97	34%	0.343	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-43.3	177.2	72.7	0	0	0	0	112.9	L333 R334 M335 L339 I340 I341	L333-S337 VanDerWaalsContact O-CB 3.3Å; L333-S337 WeakPolarHBondContact O-CB 3.25Å; L333-S337 PolarHBondContact O-N 3.12Å; L333-S337 PolarHBondContact O-OG 3.1Å; R334-S337 WeakPolarHBondContact CA-OG 3.36Å; R334-S337 PolarHBondContact O-N 2.93Å; R334-S337 PolarHBondContact O-OG 3.24Å; M335-S337 VanDerWaalsContact C-N 3.33Å; M335-S337 PolarHBondContact O-N 2.86Å; S337-L339 PolarHBondContact O-N 3.4Å; S337-I340 PolarHBondContact O-N 3.07Å; S337-I341 WeakPolarHBondContact O-CD1 3.5Å; S337-I341 VanDerWaalsContact O-CG1 3.24Å; S337-I341 WeakPolarHBondContact O-CG1 3.35Å; S337-I341 PolarHBondContact O-N 2.94Å
338	R	64.1	Low	62	Low	134 Å²	134	95.3 Å²	95.3	51%	0.506	47%	0.472	S	S	.	.	H	α-helix	trans	-63.6	-41.8	177.9	-81.9	-168.3	169.3	-157.3	-6.2	112	R334 M335 I340 I341 T342 E372	R334-R338 PolarHBondContact O-N 2.91Å; M335-R338 PolarHBondContact O-N 3.05Å; R338-I340 VanDerWaalsContact C-N 3.34Å; R338-I340 PolarHBondContact O-N 3.14Å; R338-I341 PolarHBondContact O-N 3.03Å; R338-T342 WeakPolarHBondContact O-CB 3.12Å; R338-T342 PolarHBondContact O-N 3.27Å; R338-T342 PolarHBondContact O-OG1 3.45Å; R338-E372 IonicContact NH2-OE1 2.76Å; R338-E372 PolarHBondContact NH2-OE1 2.89Å; R338-E372 VanDerWaalsContact NH2-OE1 3.15Å
339	L	60.3	Low	61.1	Low	77 Å²	77	100.1 Å²	100.1	40%	0.403	48%	0.484	S	S	.	.	H	α-helix	trans	-60.5	-44	175.4	-107.8	139.5	0	0	0	111.6	A317 M335 A336 S337 E343	A317-L339 HydrophobicContact CB-CD2 4.08Å; M335-L339 PolarHBondContact O-N 3.44Å; A336-L339 PolarHBondContact O-N 2.87Å; S337-L339 PolarHBondContact O-N 3.4Å; L339-E343 PolarHBondContact O-N 3.4Å
340	I	63	Low	60.6	Low	64 Å²	64	99.2 Å²	99.2	33%	0.328	49%	0.485	S	S	.	.	H	α-helix	trans	-66.1	-43.2	179.2	-67.7	165	0	0	0	111.7	P315 A336 S337 R338 R344	P315-I340 HydrophobicContact CB-CG1 4.16Å; P315-I340 HydrophobicContact CG-CD1 4.16Å; P315-I340 HydrophobicContact CG-CG1 4.13Å; A336-I340 WeakPolarHBondContact O-CD1 3.45Å; A336-I340 VanDerWaalsContact O-CG1 3.25Å; A336-I340 WeakPolarHBondContact O-CG1 3.37Å; A336-I340 PolarHBondContact O-N 3.01Å; A336-I340 VanDerWaalsContact O-N 3.08Å; S337-I340 PolarHBondContact O-N 3.07Å; R338-I340 VanDerWaalsContact C-N 3.34Å; R338-I340 PolarHBondContact O-N 3.14Å; I340-R344 WeakPolarHBondContact O-CB 3.38Å; I340-R344 WeakPolarHBondContact O-CG 3.3Å; I340-R344 PolarHBondContact O-N 3.32Å
341	I	65.4	Low	59.9	Low	95 Å²	95	94.6 Å²	94.6	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-65.2	-45.4	-179	-68.4	163.1	0	0	0	110.8	S337 R338 E343 R344 Q345	S337-I341 WeakPolarHBondContact O-CD1 3.5Å; S337-I341 VanDerWaalsContact O-CG1 3.24Å; S337-I341 WeakPolarHBondContact O-CG1 3.35Å; S337-I341 PolarHBondContact O-N 2.94Å; R338-I341 PolarHBondContact O-N 3.03Å; I341-E343 VanDerWaalsContact C-N 3.32Å; I341-E343 PolarHBondContact O-N 3.28Å; I341-R344 PolarHBondContact O-N 3.39Å; I341-Q345 WeakPolarHBondContact O-CG 3.26Å; I341-Q345 PolarHBondContact O-N 3.22Å
342	T	62.4	Low	58.8	Low	71 Å²	71	96.5 Å²	96.5	44%	0.436	48%	0.484	S	S	.	.	H	α-helix	trans	-62.2	-41.4	-178.4	-51.7	0	0	0	0	111.4	R338 Q345 K346	R338-T342 WeakPolarHBondContact O-CB 3.12Å; R338-T342 PolarHBondContact O-N 3.27Å; R338-T342 PolarHBondContact O-OG1 3.45Å; T342-Q345 PolarHBondContact O-N 3.07Å; T342-K346 PolarHBondContact O-N 3.32Å
343	E	55.8	Low	57.5	Low	101 Å²	101	96.8 Å²	96.8	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-72.1	-34.5	179.6	-154.2	62.9	-169.7	0	0	112.1	L339 I341 K346 L347	L339-E343 PolarHBondContact O-N 3.4Å; I341-E343 VanDerWaalsContact C-N 3.32Å; I341-E343 PolarHBondContact O-N 3.28Å; E343-K346 PolarHBondContact O-N 2.99Å; E343-L347 WeakPolarHBondContact O-CG 3.29Å; E343-L347 PolarHBondContact O-N 3.22Å
344	R	55.3	Low	56.1	Low	135 Å²	135	96.5 Å²	96.5	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-40.8	171.9	-80	-67.8	-173.3	-165.8	0.8	112.2	I340 I341 L347 V348	I340-R344 WeakPolarHBondContact O-CB 3.38Å; I340-R344 WeakPolarHBondContact O-CG 3.3Å; I340-R344 PolarHBondContact O-N 3.32Å; I341-R344 PolarHBondContact O-N 3.39Å; R344-L347 PolarHBondContact O-N 2.92Å; R344-V348 VanDerWaalsContact O-CG2 3.27Å; R344-V348 WeakPolarHBondContact O-CG2 3.5Å; R344-V348 PolarHBondContact O-N 3.39Å
345	Q	58.3	Low	54.5	Low	121 Å²	121	98 Å²	98	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-65.6	-42.1	176.9	-74.1	178.5	-45.5	0	0	111.8	I341 T342 L347 V348 Q349	I341-Q345 WeakPolarHBondContact O-CG 3.26Å; I341-Q345 PolarHBondContact O-N 3.22Å; T342-Q345 PolarHBondContact O-N 3.07Å; Q345-L347 PolarHBondContact O-N 3.49Å; Q345-V348 PolarHBondContact O-N 3.4Å; Q345-Q349 PolarHBondContact O-N 3.46Å
346	K	55.8	Low	53	Low	124 Å²	124	98.4 Å²	98.4	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-59.9	-43.4	173.9	-81.6	-175.3	176.2	178.7	0	113.1	T342 E343 Q349 A350	T342-K346 PolarHBondContact O-N 3.32Å; E343-K346 PolarHBondContact O-N 2.99Å; K346-Q349 PolarHBondContact O-N 3.03Å; K346-A350 WeakPolarHBondContact O-CB 3.31Å; K346-A350 PolarHBondContact O-N 3.31Å
347	L	51.3	Low	51.1	Low	97 Å²	97	106.6 Å²	106.6	51%	0.508	57%	0.569	S	S	.	*	H	α-helix	trans	-68.5	-34.9	179.5	-71.6	171	0	0	0	112.7	E343 R344 Q345 A350 S351	E343-L347 WeakPolarHBondContact O-CG 3.29Å; E343-L347 PolarHBondContact O-N 3.22Å; R344-L347 PolarHBondContact O-N 2.92Å; Q345-L347 PolarHBondContact O-N 3.49Å; L347-A350 PolarHBondContact O-N 3.03Å; L347-S351 PolarHBondContact O-N 2.98Å
348	V	55.1	Low	49.8	Very low	84 Å²	84	110.9 Å²	110.9	51%	0.509	59%	0.593	S	S	.	*	H	α-helix	trans	-69.4	-38.2	174.3	171	0	0	0	0	111.1	R344 Q345 S351 N352	R344-V348 VanDerWaalsContact O-CG2 3.27Å; R344-V348 WeakPolarHBondContact O-CG2 3.5Å; R344-V348 PolarHBondContact O-N 3.39Å; Q345-V348 PolarHBondContact O-N 3.4Å; V348-S351 PolarHBondContact O-N 3.24Å; V348-S351 PolarHBondContact O-OG 2.94Å; V348-N352 PolarHBondContact O-N 3.4Å
349	Q	50.9	Low	48.1	Very low	139 Å²	139	111.4 Å²	111.4	65%	0.65	61%	0.605	S	S	*	*	H	α-helix	trans	-64.9	-39.1	171.7	-90.4	174.2	-25.2	0	0	112.1	Q345 K346 N352	Q345-Q349 PolarHBondContact O-N 3.46Å; K346-Q349 PolarHBondContact O-N 3.03Å; Q349-N352 PolarHBondContact O-N 2.77Å
350	A	48.3	Very low	46.5	Very low	78 Å²	78	115.5 Å²	115.5	65%	0.645	63%	0.627	S	S	*	*	H	α-helix	trans	-67.9	-32.8	177.1	0	0	0	0	0	113.3	K346 L347 N352	K346-A350 WeakPolarHBondContact O-CB 3.31Å; K346-A350 PolarHBondContact O-N 3.31Å; L347-A350 PolarHBondContact O-N 3.03Å; A350-N352 VanDerWaalsContact C-N 3.3Å; A350-N352 PolarHBondContact O-N 3.4Å
351	S	45.7	Very low	44.9	Very low	92 Å²	92	116.3 Å²	116.3	64%	0.643	65%	0.651	S	S	*	*	H	α-helix	trans	-75.8	-17.3	177.2	80.3	0	0	0	0	113.8	L347 V348 G353	L347-S351 PolarHBondContact O-N 2.98Å; V348-S351 PolarHBondContact O-N 3.24Å; V348-S351 PolarHBondContact O-OG 2.94Å; S351-G353 VanDerWaalsContact C-N 3.29Å; S351-G353 PolarHBondContact O-N 3.36Å
352	N	46.8	Very low	43.3	Very low	115 Å²	115	120.4 Å²	120.4	62%	0.615	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	11	-178.6	-75	-3.3	0	0	0	113.9	V348 Q349 A350 V354	V348-N352 PolarHBondContact O-N 3.4Å; Q349-N352 PolarHBondContact O-N 2.77Å; A350-N352 VanDerWaalsContact C-N 3.3Å; A350-N352 PolarHBondContact O-N 3.4Å; N352-V354 VanDerWaalsContact C-N 3.33Å; N352-V354 PolarHBondContact O-N 3.41Å
353	G	42.3	Very low	41.6	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.8	25.3	162.6	0	0	0	0	0	116.2	S351	S351-G353 VanDerWaalsContact C-N 3.29Å; S351-G353 PolarHBondContact O-N 3.36Å
354	V	37.7	Very low	40.3	Very low	109 Å²	109	126.4 Å²	126.4	66%	0.661	70%	0.697	S	S	*	*			trans	-92.7	99.7	173.1	-177.3	0	0	0	0	108.7	N352 T356	N352-V354 VanDerWaalsContact C-N 3.33Å; N352-V354 PolarHBondContact O-N 3.41Å; V354-T356 PolarHBondContact O-N 2.92Å; V354-T356 VanDerWaalsContact O-N 3.14Å
355	E	32.7	Very low	39.1	Very low	197 Å²	197	127 Å²	127	92%	0.921	71%	0.709	S	S	*	*			trans	-59.6	112.6	162.9	-82	-174.1	160.9	0	0	108.5
356	T	29.8	Very low	37.6	Very low	114 Å²	114	129 Å²	129	70%	0.699	72%	0.718	S	S	*	*			trans	-101	103.4	171.6	-50.8	0	0	0	0	107.7	V354 V358	V354-T356 PolarHBondContact O-N 2.92Å; V354-T356 VanDerWaalsContact O-N 3.14Å; T356-V358 PolarHBondContact O-N 3.16Å
357	Q	25.9	Very low	36.2	Very low	175 Å²	175	130 Å²	130	82%	0.818	73%	0.729	S	S	*	*			trans	-57.4	127.2	157.9	-79.5	-169.3	-8.8	0	0	108.5	I359	Q357-I359 PolarHBondContact O-N 3.08Å
358	V	38.1	Very low	35	Very low	139 Å²	139	128.7 Å²	128.7	84%	0.842	74%	0.739	S	S	*	*			trans	-73.1	105.6	171.5	177.7	0	0	0	0	107.3	T356	T356-V358 PolarHBondContact O-N 3.16Å
359	I	28.9	Very low	34.1	Very low	145 Å²	145	132.9 Å²	132.9	74%	0.744	76%	0.759	S	S	*	*			trans	-156.5	128.1	150.2	-86.1	135.8	0	0	0	107.1	Q357	Q357-I359 PolarHBondContact O-N 3.08Å
360	D	26.1	Very low	32.9	Very low	162 Å²	162	131.9 Å²	131.9	87%	0.866	76%	0.762	S	S	*	*			trans	55.3	111.4	167.5	-100.7	-27.3	0	0	0	121	K362	D360-K362 PolarHBondContact O-N 3.02Å
361	G	29.5	Very low	31.9	Very low	82 Å²	82	134.3 Å²	134.3	85%	0.845	77%	0.771	S	S	*	*			trans	-81	105.6	-176.2	0	0	0	0	0	113.5
362	K	33.4	Very low	31	Very low	180 Å²	180	134.9 Å²	134.9	78%	0.783	76%	0.764	S	S	*	*			trans	-151.9	113.6	145.7	-138.5	-177.3	-176.6	-169.1	0	109.2	D360	D360-K362 PolarHBondContact O-N 3.02Å
363	V	25.7	Very low	30	Very low	129 Å²	129	137 Å²	137	78%	0.782	78%	0.775	S	S	*	*			trans	-130.2	102.6	168.7	178.3	0	0	0	0	107.3	I365	V363-I365 HydrophobicContact CG1-CD1 4.02Å; V363-I365 HydrophobicContact CG1-CG1 3.81Å
364	E	28.8	Very low	29.1	Very low	169 Å²	169	140.4 Å²	140.4	79%	0.79	77%	0.77	S	S	*	*			trans	-69.6	125.9	161.9	-74	175.8	171	0	0	108.2
365	I	29.9	Very low	28.4	Very low	148 Å²	148	141 Å²	141	76%	0.759	78%	0.776	S	S	*	*			trans	-127	110.3	162.6	-61.9	174.3	0	0	0	107.2	V363	V363-I365 HydrophobicContact CG1-CD1 4.02Å; V363-I365 HydrophobicContact CG1-CG1 3.81Å
366	E	27.5	Very low	28	Very low	163 Å²	163	141 Å²	141	76%	0.762	77%	0.774	S	S	*	*			trans	-75.6	143.5	174.1	-148.4	-169.2	147.7	0	0	110.9
367	N	25.9	Very low	27.8	Very low	145 Å²	145	144.5 Å²	144.5	78%	0.775	78%	0.782	S	S	*	*			trans	75.8	112.3	158.8	-67.5	-36.3	0	0	0	121.3
368	G	27	Very low	27.8	Very low	69 Å²	69	139.6 Å²	139.6	71%	0.711	77%	0.771	S	S	*	*			trans	176.1	78.6	162.3	0	0	0	0	0	110.4	V370	G368-V370 PolarHBondContact O-N 3.46Å
369	N	34.5	Very low	27.2	Very low	172 Å²	172	142 Å²	142	92%	0.92	77%	0.773	S	S	*	*			trans	-53.4	106.7	179.7	-101.1	-13.7	0	0	0	112.3
370	V	26.7	Very low	27.2	Very low	119 Å²	119	142.3 Å²	142.3	72%	0.721	77%	0.772	S	S	*	*			trans	-125.3	125.4	156.1	-179.4	0	0	0	0	105.5	G368 E372	G368-V370 PolarHBondContact O-N 3.46Å; V370-E372 VanDerWaalsContact C-N 3.3Å; V370-E372 PolarHBondContact O-N 2.91Å
371	P	26.7	Very low	27.3	Very low	129 Å²	129	141.9 Å²	141.9	84%	0.838	77%	0.769	S	S	*	*			trans	-69	95.1	178.2	24.5	-24.3	0	0	0	108.1	D373	P371-D373 PolarHBondContact O-N 3.27Å
372	E	26.9	Very low	27.5	Very low	104 Å²	104	141.6 Å²	141.6	49%	0.486	75%	0.748	S	S	.	*			trans	-66.8	108.1	160.9	-118.2	-171.7	162.4	0	0	106.3	R338 V370 K374	R338-E372 IonicContact NH2-OE1 2.76Å; R338-E372 PolarHBondContact NH2-OE1 2.89Å; R338-E372 VanDerWaalsContact NH2-OE1 3.15Å; V370-E372 VanDerWaalsContact C-N 3.3Å; V370-E372 PolarHBondContact O-N 2.91Å; E372-K374 HydrophobicContact CB-CG 4.27Å; E372-K374 PolarHBondContact O-N 3.47Å; E372-K374 WeakPolarHBondContact OE2-CE 3.42Å; E372-K374 IonicContact OE2-NZ 3.22Å; E372-K374 PolarHBondContact OE2-NZ 2.93Å
373	D	25.4	Very low	27.9	Very low	158 Å²	158	134.8 Å²	134.8	85%	0.845	72%	0.722	S	S	*	*			trans	-63.4	72.4	151.2	-94.2	-29.5	0	0	0	107.5	P371	P371-D373 PolarHBondContact O-N 3.27Å
374	K	23.9	Very low	29	Very low	140 Å²	140	131.3 Å²	131.3	61%	0.609	70%	0.698	S	S	*	*			trans	-67.5	124.2	152.6	-87.2	171.1	169.3	159	0	104.9	E372 K376	E372-K374 HydrophobicContact CB-CG 4.27Å; E372-K374 PolarHBondContact O-N 3.47Å; E372-K374 WeakPolarHBondContact OE2-CE 3.42Å; E372-K374 IonicContact OE2-NZ 3.22Å; E372-K374 PolarHBondContact OE2-NZ 2.93Å; K374-K376 PolarHBondContact O-N 2.91Å
375	P	24.2	Very low	30	Very low	121 Å²	121	124.2 Å²	124.2	79%	0.786	67%	0.667	S	S	*	*			trans	-53.2	115.4	157.1	-4.7	17.3	0	0	0	104.7	E377	P375-E377 PolarHBondContact O-N 3.26Å
376	K	23.9	Very low	31.5	Very low	199 Å²	199	117.3 Å²	117.3	87%	0.865	63%	0.633	S	S	*	*			trans	-46.1	113.1	178	-75.2	177	174.1	178.1	0	107.4	K374 A378	K374-K376 PolarHBondContact O-N 2.91Å; K376-A378 PolarHBondContact O-N 2.79Å
377	E	25.6	Very low	32.9	Very low	186 Å²	186	116.1 Å²	116.1	87%	0.869	63%	0.625	S	S	*	*			trans	-54.7	100.6	153.8	-78.8	174.4	158.8	0	0	104.7	P375 E379	P375-E377 PolarHBondContact O-N 3.26Å; E377-E379 PolarHBondContact O-N 3.41Å
378	A	24.6	Very low	34.4	Very low	73 Å²	73	113.9 Å²	113.9	60%	0.603	61%	0.61	S	S	*	*			trans	-66.7	109.5	156.3	0	0	0	0	0	104.4	K376 E380	K376-A378 PolarHBondContact O-N 2.79Å; A378-E380 HydrophobicContact CB-CG 4.39Å; A378-E380 PolarHBondContact O-N 2.96Å
379	E	27.2	Very low	36.2	Very low	189 Å²	189	115.3 Å²	115.3	88%	0.883	60%	0.6	S	S	*	*			trans	-54.9	73.6	149	-70.9	-179.4	144.7	0	0	108	E377 N381	E377-E379 PolarHBondContact O-N 3.41Å; E379-N381 PolarHBondContact O-N 3.32Å
380	E	28.3	Very low	37.7	Very low	151 Å²	151	108.6 Å²	108.6	71%	0.706	57%	0.566	S	S	*	*			trans	-90.3	64.6	164.3	-101.2	-177.7	169.2	0	0	106.6	A378 D382	A378-E380 HydrophobicContact CB-CG 4.39Å; A378-E380 PolarHBondContact O-N 2.96Å; E380-D382 PolarHBondContact O-N 3.08Å
381	N	28.8	Very low	38.8	Very low	153 Å²	153	114.9 Å²	114.9	82%	0.818	58%	0.577	S	S	*	*			trans	-88.8	32.5	165	-138.7	13.8	0	0	0	110.3	E379 T383	E379-N381 PolarHBondContact O-N 3.32Å; N381-T383 PolarHBondContact O-N 3.26Å
382	D	33.1	Very low	40.8	Very low	76 Å²	76	110.1 Å²	110.1	41%	0.406	55%	0.551	S	S	.	*			trans	-91.3	88.9	175.8	-79.7	-25.7	0	0	0	108.4	E380 I384 H388	E380-D382 PolarHBondContact O-N 3.08Å; D382-I384 PolarHBondContact O-N 3.32Å; D382-H388 IonicContact OD2-CG 3.91Å; D382-H388 IonicContact OD2-ND1 3.15Å
383	T	41.9	Very low	42.7	Very low	38 Å²	38	112.8 Å²	112.8	23%	0.233	57%	0.566	C	S	.	*			trans	-30.4	127.5	138.3	50.3	0	0	0	0	108.1	N381 S385 A417 K418	N381-T383 PolarHBondContact O-N 3.26Å; T383-S385 VanDerWaalsContact C-N 3.28Å; T383-S385 PolarHBondContact O-N 3.11Å; T383-A417 HydrophobicContact CG2-CB 4.37Å; T383-K418 WeakPolarHBondContact OG1-CE 3.41Å
384	I	48.4	Very low	44.6	Very low	55 Å²	55	107.1 Å²	107.1	28%	0.282	55%	0.545	S	S	.	.			trans	-48.6	97.4	-175.1	-62.2	-178.6	0	0	0	108.4	D382 L406	D382-I384 PolarHBondContact O-N 3.32Å; I384-L406 HydrophobicContact CB-CD2 4.09Å; I384-L406 HydrophobicContact CG2-CD1 3.41Å; I384-L406 VanDerWaalsContact CG2-CD1 3.41Å; I384-L406 HydrophobicContact CG2-CD2 3.5Å; I384-L406 VanDerWaalsContact CG2-CD2 3.5Å; I384-L406 HydrophobicContact CG2-CG 4.08Å
385	S	50.8	Low	46.6	Very low	20 Å²	20	101.5 Å²	101.5	14%	0.14	52%	0.523	C	S	.	.			trans	-91.8	131	-179.2	62.7	0	0	0	0	105.2	T383 F387 H388	T383-S385 VanDerWaalsContact C-N 3.28Å; T383-S385 PolarHBondContact O-N 3.11Å; S385-F387 PolarHBondContact O-N 3.41Å; S385-H388 PolarHBondContact O-N 2.84Å; S385-H388 VanDerWaalsContact OG-CB 3.28Å; S385-H388 WeakPolarHBondContact OG-CB 2.95Å; S385-H388 PolarHBondContact OG-N 3.02Å
386	P	59.4	Low	48.8	Very low	4 Å²	4	101.2 Å²	101.2	3%	0.026	51%	0.509	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-1	-179.8	24	-31.8	0	0	0	112.9	W399 W403 L406 F410	P386-W399 VanDerWaalsContact O-CZ2 3.25Å; P386-W399 WeakPolarHBondContact O-CZ2 3.19Å; P386-W403 PolarHBondContact O-NE1 2.99Å; P386-L406 HydrophobicContact CB-CB 4.46Å; P386-F410 HydrophobicContact CG-CB 3.84Å; P386-F410 HydrophobicContact CG-CD1 4.15Å; P386-F410 HydrophobicContact CG-CD2 3.95Å; P386-F410 HydrophobicContact CG-CG 3.7Å
387	F	57.8	Low	51.1	Low	137 Å²	137	96.2 Å²	96.2	60%	0.601	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-10.8	-175.5	-55.1	-66.6	0	0	0	114	S385 F410	S385-F387 PolarHBondContact O-N 3.41Å; F387-F410 HydrophobicContact CE2-CD1 4.12Å; F387-F410 AromaticContact CE2-CE1 3.64Å; F387-F410 HydrophobicContact CE2-CE1 3.64Å; F387-F410 HydrophobicContact CE2-CE2 4.41Å; F387-F410 AromaticContact CE2-CZ 3.8Å; F387-F410 HydrophobicContact CE2-CZ 3.8Å; F387-F410 HydrophobicContact CZ-CD1 4.44Å; F387-F410 HydrophobicContact CZ-CE1 4.12Å
388	H	58.1	Low	53	Low	98 Å²	98	90.6 Å²	90.6	45%	0.454	46%	0.464	S	S	.	.			trans	-100.3	111.7	177	-166.9	-100.2	0	0	0	111.2	D382 S385 P390 W399	D382-H388 IonicContact OD2-CG 3.91Å; D382-H388 IonicContact OD2-ND1 3.15Å; S385-H388 PolarHBondContact O-N 2.84Å; S385-H388 VanDerWaalsContact OG-CB 3.28Å; S385-H388 WeakPolarHBondContact OG-CB 2.95Å; S385-H388 PolarHBondContact OG-N 3.02Å; H388-P390 WeakPolarHBondContact O-CD 3.27Å; H388-W399 PolarHBondContact O-NE1 2.89Å
389	I	65.1	Low	55.5	Low	99 Å²	99	89.4 Å²	89.4	51%	0.508	44%	0.444	S	S	.	.			trans	-80.2	116.6	-178.7	-59.4	169.1	0	0	0	109.1	K396 W399	I389-K396 HydrophobicContact CG2-CG 4.38Å; I389-W399 HydrophobicContact CG1-CH2 4.07Å; I389-W399 HydrophobicContact CG1-CZ2 4.19Å
390	P	65.7	Low	57.9	Low	32 Å²	32	86 Å²	86	21%	0.208	43%	0.431	C	S	.	.			trans	-70.1	143.4	-178.3	27.9	-34.5	0	0	0	112.3	H388 G392 K396 W399	H388-P390 WeakPolarHBondContact O-CD 3.27Å; P390-G392 PolarHBondContact O-N 2.84Å; P390-K396 WeakPolarHBondContact O-CG 3.27Å; P390-W399 HydrophobicContact CG-CB 3.85Å; P390-W399 HydrophobicContact CG-CG 4.15Å
391	R	49.7	Very low	60.2	Low	250 Å²	250	82.9 Å²	82.9	94%	0.943	42%	0.418	S	S	*	.	S	Bend	trans	-81.1	101.9	177.8	-67.2	-177.1	-178.7	168.2	2	110.5
392	G	68.9	Low	62.5	Low	30 Å²	30	76.2 Å²	76.2	31%	0.309	38%	0.384	S	S	.	.	S	Bend	trans	150.8	137.4	170.1	0	0	0	0	0	112.7	P390 G394 S395 K396	P390-G392 PolarHBondContact O-N 2.84Å; G392-G394 PolarHBondContact O-N 3.16Å; G392-S395 WeakPolarHBondContact O-CB 3.33Å; G392-S395 PolarHBondContact O-N 3.07Å; G392-K396 WeakPolarHBondContact O-CG 3.36Å; G392-K396 PolarHBondContact O-N 3.24Å
393	M	66.5	Low	64.9	Low	159 Å²	159	77.1 Å²	77.1	78%	0.783	38%	0.381	S	S	*	.	H	α-helix	trans	-57.2	-45.3	-171.4	-162.4	168.4	76.8	0	0	113.3	S395 K396 I397	M393-S395 PolarHBondContact O-N 3Å; M393-K396 PolarHBondContact O-N 2.85Å; M393-I397 WeakPolarHBondContact O-CG1 3.34Å; M393-I397 PolarHBondContact O-N 3.4Å; M393-I397 VanDerWaalsContact O-N 3.14Å
394	G	64.5	Low	66.9	Low	39 Å²	39	78.3 Å²	78.3	40%	0.402	39%	0.39	S	S	.	.	H	α-helix	trans	-70.2	-28.3	176.1	0	0	0	0	0	114.5	G392 K398	G392-G394 PolarHBondContact O-N 3.16Å; G394-K398 WeakPolarHBondContact O-CG 3.48Å; G394-K398 PolarHBondContact O-N 3.33Å
395	S	65.3	Low	68.6	Low	22 Å²	22	75.9 Å²	75.9	15%	0.154	38%	0.378	C	S	.	.	H	α-helix	trans	-73.6	-35.4	171.5	-91.6	0	0	0	0	112.1	R27 G392 M393 K398 W399	R27-S395 PolarHBondContact NE-OG 2.81Å; R27-S395 PolarHBondContact NH2-OG 3.14Å; G392-S395 WeakPolarHBondContact O-CB 3.33Å; G392-S395 PolarHBondContact O-N 3.07Å; M393-S395 PolarHBondContact O-N 3Å; S395-K398 PolarHBondContact O-N 3.02Å; S395-W399 WeakPolarHBondContact O-CB 3.46Å; S395-W399 PolarHBondContact O-N 3.3Å
396	K	70.4	Confident	69.9	Low	115 Å²	115	75 Å²	75	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-43.8	176.7	-73.8	-177.6	177.7	-172.8	0	111.4	I389 P390 G392 M393 W399 L400	I389-K396 HydrophobicContact CG2-CG 4.38Å; P390-K396 WeakPolarHBondContact O-CG 3.27Å; G392-K396 WeakPolarHBondContact O-CG 3.36Å; G392-K396 PolarHBondContact O-N 3.24Å; M393-K396 PolarHBondContact O-N 2.85Å; K396-W399 PolarHBondContact O-N 3.45Å; K396-L400 VanDerWaalsContact O-CB 3.28Å; K396-L400 WeakPolarHBondContact O-CB 3.43Å; K396-L400 PolarHBondContact O-N 2.79Å
397	I	73.1	Confident	70.9	Confident	95 Å²	95	77.2 Å²	77.2	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-62.2	-46.4	176.9	-66.3	167.3	0	0	0	110.8	M393 L400 I401	M393-I397 WeakPolarHBondContact O-CG1 3.34Å; M393-I397 PolarHBondContact O-N 3.4Å; M393-I397 VanDerWaalsContact O-N 3.14Å; I397-L400 WeakPolarHBondContact O-CB 3.43Å; I397-L400 PolarHBondContact O-N 3.28Å; I397-I401 HydrophobicContact CG2-CD1 4.02Å; I397-I401 WeakPolarHBondContact O-CG1 3.5Å; I397-I401 PolarHBondContact O-N 2.97Å
398	K	66.4	Low	72.2	Confident	67 Å²	67	73.5 Å²	73.5	29%	0.291	37%	0.369	S	S	.	.	H	α-helix	trans	-63.9	-44.7	177.6	-72.3	175.7	-177.4	176.5	0	112.4	R27 G394 S395 L400 I401 S402	R27-K398 HydrophobicContact CG-CD 4.38Å; R27-K398 PolarHBondContact O-NZ 2.93Å; G394-K398 WeakPolarHBondContact O-CG 3.48Å; G394-K398 PolarHBondContact O-N 3.33Å; S395-K398 PolarHBondContact O-N 3.02Å; K398-L400 VanDerWaalsContact C-N 3.3Å; K398-L400 PolarHBondContact O-N 3.35Å; K398-I401 PolarHBondContact O-N 3.48Å; K398-S402 PolarHBondContact O-N 3.41Å; K398-S402 PolarHBondContact O-OG 3.09Å
399	W	75.7	Confident	73.4	Confident	48 Å²	48	68.9 Å²	68.9	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-59.6	-43.6	175.1	-179.1	89	0	0	0	110.6	P386 H388 I389 P390 S395 K396 I401 S402 W403	P386-W399 VanDerWaalsContact O-CZ2 3.25Å; P386-W399 WeakPolarHBondContact O-CZ2 3.19Å; H388-W399 PolarHBondContact O-NE1 2.89Å; I389-W399 HydrophobicContact CG1-CH2 4.07Å; I389-W399 HydrophobicContact CG1-CZ2 4.19Å; P390-W399 HydrophobicContact CG-CB 3.85Å; P390-W399 HydrophobicContact CG-CG 4.15Å; S395-W399 WeakPolarHBondContact O-CB 3.46Å; S395-W399 PolarHBondContact O-N 3.3Å; K396-W399 PolarHBondContact O-N 3.45Å; W399-I401 PolarHBondContact O-N 3.4Å; W399-S402 CarbonylContact O-C 3.58Å; W399-S402 PolarHBondContact O-N 3.36Å; W399-W403 AromaticContact CE2-CD1 3.6Å; W399-W403 AromaticContact CH2-CD1 3.3Å; W399-W403 HydrophobicContact CH2-CG 4.15Å; W399-W403 AromaticContact CH2-NE1 3.45Å; W399-W403 AromaticContact CZ2-CD1 3.23Å; W399-W403 HydrophobicContact CZ2-CG 4.35Å; W399-W403 AromaticContact CZ2-NE1 3.52Å; W399-W403 AromaticContact CZ3-CD1 3.77Å; W399-W403 HydrophobicContact CZ3-CG 4.25Å; W399-W403 WeakPolarHBondContact O-CA 3.47Å; W399-W403 WeakPolarHBondContact O-CB 3.49Å; W399-W403 PolarHBondContact O-N 3.38Å
400	L	77.9	Confident	74.2	Confident	117 Å²	117	68 Å²	68	61%	0.613	34%	0.34	S	S	*	.	H	α-helix	trans	-60.3	-43	177.6	-172.3	72.9	0	0	0	112.3	K396 I397 K398 W403 P404	K396-L400 VanDerWaalsContact O-CB 3.28Å; K396-L400 WeakPolarHBondContact O-CB 3.43Å; K396-L400 PolarHBondContact O-N 2.79Å; I397-L400 WeakPolarHBondContact O-CB 3.43Å; I397-L400 PolarHBondContact O-N 3.28Å; K398-L400 VanDerWaalsContact C-N 3.3Å; K398-L400 PolarHBondContact O-N 3.35Å; L400-W403 WeakPolarHBondContact O-CB 3.48Å; L400-W403 PolarHBondContact O-N 3.44Å; L400-P404 WeakPolarHBondContact O-CD 3.36Å
401	I	77.3	Confident	75	Confident	87 Å²	87	73.5 Å²	73.5	45%	0.446	36%	0.361	S	S	.	.	H	α-helix	trans	-65.9	-46.2	177.3	-67.2	166.4	0	0	0	110.6	Y119 I397 K398 W399 W403 P404	Y119-I401 HydrophobicContact CD2-CG2 4.39Å; Y119-I401 HydrophobicContact CE2-CG2 4.45Å; Y119-I401 WeakPolarHBondContact CE2-O 3.25Å; I397-I401 HydrophobicContact CG2-CD1 4.02Å; I397-I401 WeakPolarHBondContact O-CG1 3.5Å; I397-I401 PolarHBondContact O-N 2.97Å; K398-I401 PolarHBondContact O-N 3.48Å; W399-I401 PolarHBondContact O-N 3.4Å; I401-W403 VanDerWaalsContact C-N 3.3Å; I401-W403 PolarHBondContact O-N 3.49Å; I401-P404 WeakPolarHBondContact O-CD 3.27Å
402	S	76.8	Confident	76.6	Confident	13 Å²	13	64 Å²	64	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-77.6	-14.2	179.7	-56.5	0	0	0	0	113.7	K398 W399 L405 L406	K398-S402 PolarHBondContact O-N 3.41Å; K398-S402 PolarHBondContact O-OG 3.09Å; W399-S402 CarbonylContact O-C 3.58Å; W399-S402 PolarHBondContact O-N 3.36Å; S402-L405 WeakPolarHBondContact O-CB 3.38Å; S402-L405 PolarHBondContact O-N 3.01Å; S402-L406 WeakPolarHBondContact O-CB 3.38Å; S402-L406 WeakPolarHBondContact O-CD1 3.44Å; S402-L406 VanDerWaalsContact O-CG 3.25Å; S402-L406 WeakPolarHBondContact O-CG 3.14Å; S402-L406 PolarHBondContact O-N 3.43Å
403	W	82.9	Confident	77.4	Confident	94 Å²	94	62.8 Å²	62.8	36%	0.356	32%	0.317	S	S	.	.	H	α-helix	trans	-56.9	-49.8	-172.9	-170.9	79.7	0	0	0	114.1	P386 W399 L400 I401 L405 L406 L407	P386-W403 PolarHBondContact O-NE1 2.99Å; W399-W403 AromaticContact CE2-CD1 3.6Å; W399-W403 AromaticContact CH2-CD1 3.3Å; W399-W403 HydrophobicContact CH2-CG 4.15Å; W399-W403 AromaticContact CH2-NE1 3.45Å; W399-W403 AromaticContact CZ2-CD1 3.23Å; W399-W403 HydrophobicContact CZ2-CG 4.35Å; W399-W403 AromaticContact CZ2-NE1 3.52Å; W399-W403 AromaticContact CZ3-CD1 3.77Å; W399-W403 HydrophobicContact CZ3-CG 4.25Å; W399-W403 WeakPolarHBondContact O-CA 3.47Å; W399-W403 WeakPolarHBondContact O-CB 3.49Å; W399-W403 PolarHBondContact O-N 3.38Å; L400-W403 WeakPolarHBondContact O-CB 3.48Å; L400-W403 PolarHBondContact O-N 3.44Å; I401-W403 VanDerWaalsContact C-N 3.3Å; I401-W403 PolarHBondContact O-N 3.49Å; W403-L405 VanDerWaalsContact C-N 3.3Å; W403-L405 PolarHBondContact O-N 3.32Å; W403-L406 PolarHBondContact O-N 3.29Å; W403-L407 HydrophobicContact CH2-CD1 3.46Å; W403-L407 VanDerWaalsContact CH2-CD1 3.46Å; W403-L407 HydrophobicContact CZ2-CD1 3.45Å; W403-L407 VanDerWaalsContact CZ2-CD1 3.45Å; W403-L407 HydrophobicContact CZ3-CD1 4.08Å; W403-L407 WeakPolarHBondContact O-CB 3.32Å; W403-L407 PolarHBondContact O-N 3.13Å
404	P	84.9	Confident	78.2	Confident	64 Å²	64	56.3 Å²	56.3	42%	0.416	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-41.8	178.4	18.2	-30.2	0	0	0	112.3	Y119 L400 I401 L408	Y119-P404 WeakPolarHBondContact OH-CG 2.94Å; L400-P404 WeakPolarHBondContact O-CD 3.36Å; I401-P404 WeakPolarHBondContact O-CD 3.27Å; P404-L408 WeakPolarHBondContact O-CB 3.06Å; P404-L408 PolarHBondContact O-N 3.23Å
405	L	82.7	Confident	78.9	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-47.8	175.1	-176.7	80.4	0	0	0	112	Y119 A123 I126 S402 W403 L407 L408 L409 F439	Y119-L405 WeakPolarHBondContact OH-CB 3.25Å; Y119-L405 PolarHBondContact OH-N 3.19Å; A123-L405 HydrophobicContact CB-CD1 3.47Å; A123-L405 VanDerWaalsContact CB-CD1 3.47Å; A123-L405 HydrophobicContact CB-CD2 3.87Å; A123-L405 HydrophobicContact CB-CG 4.3Å; I126-L405 HydrophobicContact CB-CD2 4.33Å; I126-L405 HydrophobicContact CD1-CD2 3.72Å; S402-L405 WeakPolarHBondContact O-CB 3.38Å; S402-L405 PolarHBondContact O-N 3.01Å; W403-L405 VanDerWaalsContact C-N 3.3Å; W403-L405 PolarHBondContact O-N 3.32Å; L405-L407 VanDerWaalsContact C-N 3.29Å; L405-L407 PolarHBondContact O-N 2.94Å; L405-L408 PolarHBondContact O-N 3.11Å; L405-L409 HydrophobicContact CD1-CD1 4.4Å; L405-L409 HydrophobicContact CD2-CD1 4.3Å; L405-L409 HydrophobicContact CG-CD1 3.98Å; L405-L409 HydrophobicContact CG-CG 4.47Å; L405-L409 WeakPolarHBondContact O-CB 3.49Å; L405-L409 WeakPolarHBondContact O-CG 3.25Å; L405-L409 PolarHBondContact O-N 3.14Å; L405-F439 HydrophobicContact CD1-CE1 4Å; L405-F439 HydrophobicContact CD1-CE2 4.11Å; L405-F439 HydrophobicContact CD1-CZ 3.51Å
406	L	77.9	Confident	79.5	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-38.1	-179.4	-74.2	160.3	0	0	0	111.6	I126 I384 P386 S402 W403 F410	I126-L406 HydrophobicContact CG2-CD2 4.47Å; I384-L406 HydrophobicContact CB-CD2 4.09Å; I384-L406 HydrophobicContact CG2-CD1 3.41Å; I384-L406 VanDerWaalsContact CG2-CD1 3.41Å; I384-L406 HydrophobicContact CG2-CD2 3.5Å; I384-L406 VanDerWaalsContact CG2-CD2 3.5Å; I384-L406 HydrophobicContact CG2-CG 4.08Å; P386-L406 HydrophobicContact CB-CB 4.46Å; S402-L406 WeakPolarHBondContact O-CB 3.38Å; S402-L406 WeakPolarHBondContact O-CD1 3.44Å; S402-L406 VanDerWaalsContact O-CG 3.25Å; S402-L406 WeakPolarHBondContact O-CG 3.14Å; S402-L406 PolarHBondContact O-N 3.43Å; W403-L406 PolarHBondContact O-N 3.29Å; L406-F410 WeakPolarHBondContact O-CB 3.35Å; L406-F410 PolarHBondContact O-N 3.49Å
407	L	82.1	Confident	79.5	Confident	49 Å²	49	52 Å²	52	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-46.4	175.3	-175.8	141.2	0	0	0	110.8	W403 L405 L409 F410 F411	W403-L407 HydrophobicContact CH2-CD1 3.46Å; W403-L407 VanDerWaalsContact CH2-CD1 3.46Å; W403-L407 HydrophobicContact CZ2-CD1 3.45Å; W403-L407 VanDerWaalsContact CZ2-CD1 3.45Å; W403-L407 HydrophobicContact CZ3-CD1 4.08Å; W403-L407 WeakPolarHBondContact O-CB 3.32Å; W403-L407 PolarHBondContact O-N 3.13Å; L405-L407 VanDerWaalsContact C-N 3.29Å; L405-L407 PolarHBondContact O-N 2.94Å; L407-L409 PolarHBondContact O-N 3.25Å; L407-F410 PolarHBondContact O-N 2.76Å; L407-F411 HydrophobicContact CD1-CE2 4.26Å; L407-F411 HydrophobicContact CD2-CD2 3.74Å; L407-F411 HydrophobicContact CD2-CE2 3.81Å; L407-F411 HydrophobicContact CG-CD2 3.9Å; L407-F411 HydrophobicContact CG-CE2 3.78Å; L407-F411 VanDerWaalsContact O-CD2 3.25Å; L407-F411 WeakPolarHBondContact O-CD2 3.37Å; L407-F411 PolarHBondContact O-N 3.47Å
408	L	85.3	Confident	79.6	Confident	60 Å²	60	50.7 Å²	50.7	31%	0.314	26%	0.257	S	S	.	.	H	α-helix	trans	-58.6	-47.2	176	174.6	156.4	0	0	0	111.5	P404 L405 F411 T412 W435 F439	P404-L408 WeakPolarHBondContact O-CB 3.06Å; P404-L408 PolarHBondContact O-N 3.23Å; L405-L408 PolarHBondContact O-N 3.11Å; L408-F411 PolarHBondContact O-N 2.85Å; L408-T412 WeakPolarHBondContact O-CB 3.43Å; L408-T412 WeakPolarHBondContact O-CG2 3.2Å; L408-T412 PolarHBondContact O-N 2.97Å; L408-T412 VanDerWaalsContact O-N 3.15Å; L408-T412 PolarHBondContact O-OG1 3.46Å; L408-W435 HydrophobicContact CD1-CH2 3.88Å; L408-W435 HydrophobicContact CD1-CZ3 4.28Å; L408-W435 HydrophobicContact CD2-CD2 4.12Å; L408-W435 HydrophobicContact CD2-CE3 4.05Å; L408-W435 HydrophobicContact CD2-CH2 3.5Å; L408-W435 VanDerWaalsContact CD2-CH2 3.5Å; L408-W435 HydrophobicContact CD2-CZ2 3.53Å; L408-W435 HydrophobicContact CD2-CZ3 3.75Å; L408-W435 HydrophobicContact CG-CH2 3.97Å; L408-W435 HydrophobicContact CG-CZ2 4.13Å; L408-F439 HydrophobicContact CD2-CZ 4.28Å
409	L	82.8	Confident	79.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69	-35.3	178	-70.9	174.8	0	0	0	112.3	I126 T127 Y131 L405 L407 F411 T412 V413 W435 F439	I126-L409 HydrophobicContact CG2-CD1 4.07Å; T127-L409 HydrophobicContact CG2-CD2 4.44Å; Y131-L409 HydrophobicContact CE2-CB 4.09Å; Y131-L409 HydrophobicContact CE2-CD1 4.03Å; L405-L409 HydrophobicContact CD1-CD1 4.4Å; L405-L409 HydrophobicContact CD2-CD1 4.3Å; L405-L409 HydrophobicContact CG-CD1 3.98Å; L405-L409 HydrophobicContact CG-CG 4.47Å; L405-L409 WeakPolarHBondContact O-CB 3.49Å; L405-L409 WeakPolarHBondContact O-CG 3.25Å; L405-L409 PolarHBondContact O-N 3.14Å; L407-L409 PolarHBondContact O-N 3.25Å; L409-F411 PolarHBondContact O-N 3.48Å; L409-T412 WeakPolarHBondContact CA-OG1 3.47Å; L409-T412 PolarHBondContact O-N 2.98Å; L409-V413 HydrophobicContact CD2-CG2 4.2Å; L409-V413 PolarHBondContact O-N 2.95Å; L409-W435 HydrophobicContact CD2-CB 4.32Å; L409-W435 HydrophobicContact CD2-CD2 4.36Å; L409-W435 HydrophobicContact CD2-CG 4Å; L409-F439 HydrophobicContact CD2-CE2 4.18Å; L409-F439 HydrophobicContact CD2-CZ 4.46Å
410	F	81.2	Confident	79.5	Confident	82 Å²	82	61.4 Å²	61.4	36%	0.36	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-37.9	177.5	177.2	-95	0	0	0	112.7	P386 F387 L406 L407	P386-F410 HydrophobicContact CG-CB 3.84Å; P386-F410 HydrophobicContact CG-CD1 4.15Å; P386-F410 HydrophobicContact CG-CD2 3.95Å; P386-F410 HydrophobicContact CG-CG 3.7Å; F387-F410 HydrophobicContact CE2-CD1 4.12Å; F387-F410 AromaticContact CE2-CE1 3.64Å; F387-F410 HydrophobicContact CE2-CE1 3.64Å; F387-F410 HydrophobicContact CE2-CE2 4.41Å; F387-F410 AromaticContact CE2-CZ 3.8Å; F387-F410 HydrophobicContact CE2-CZ 3.8Å; F387-F410 HydrophobicContact CZ-CD1 4.44Å; F387-F410 HydrophobicContact CZ-CE1 4.12Å; L406-F410 WeakPolarHBondContact O-CB 3.35Å; L406-F410 PolarHBondContact O-N 3.49Å; L407-F410 PolarHBondContact O-N 2.76Å
411	F	82.4	Confident	79.4	Confident	147 Å²	147	61.6 Å²	61.6	65%	0.645	30%	0.304	S	S	*	.	H	α-helix	trans	-76.1	-29.3	176.9	-83.3	-68.1	0	0	0	113	L407 L408 L409	L407-F411 HydrophobicContact CD1-CE2 4.26Å; L407-F411 HydrophobicContact CD2-CD2 3.74Å; L407-F411 HydrophobicContact CD2-CE2 3.81Å; L407-F411 HydrophobicContact CG-CD2 3.9Å; L407-F411 HydrophobicContact CG-CE2 3.78Å; L407-F411 VanDerWaalsContact O-CD2 3.25Å; L407-F411 WeakPolarHBondContact O-CD2 3.37Å; L407-F411 PolarHBondContact O-N 3.47Å; L408-F411 PolarHBondContact O-N 2.85Å; L409-F411 PolarHBondContact O-N 3.48Å
412	T	84.6	Confident	79.3	Confident	51 Å²	51	61.1 Å²	61.1	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-101.1	-30.1	-169.6	57.8	0	0	0	0	113.5	L408 L409 L431 W435	L408-T412 WeakPolarHBondContact O-CB 3.43Å; L408-T412 WeakPolarHBondContact O-CG2 3.2Å; L408-T412 PolarHBondContact O-N 2.97Å; L408-T412 VanDerWaalsContact O-N 3.15Å; L408-T412 PolarHBondContact O-OG1 3.46Å; L409-T412 WeakPolarHBondContact CA-OG1 3.47Å; L409-T412 PolarHBondContact O-N 2.98Å; T412-L431 WeakPolarHBondContact O-CD1 3.27Å; T412-W435 HydrophobicContact CG2-CZ2 3.88Å; T412-W435 PolarHBondContact OG1-NE1 3.09Å
413	V	85.1	Confident	79.5	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.018	34%	0.335	C	S	.	.	S	Bend	trans	-118.5	117.5	-176.8	-169.1	0	0	0	0	110.4	Y131 L409 N415 L431	Y131-V413 HydrophobicContact CD1-CB 3.87Å; Y131-V413 HydrophobicContact CD1-CG1 3.49Å; Y131-V413 VanDerWaalsContact CD1-CG1 3.49Å; Y131-V413 HydrophobicContact CE1-CB 4.07Å; Y131-V413 HydrophobicContact CE1-CG1 4.18Å; Y131-V413 HydrophobicContact CG-CG1 4.07Å; L409-V413 HydrophobicContact CD2-CG2 4.2Å; L409-V413 PolarHBondContact O-N 2.95Å; V413-N415 PolarHBondContact O-N 3.08Å; V413-L431 HydrophobicContact CG1-CB 4.31Å; V413-L431 HydrophobicContact CG2-CB 4.17Å
414	P	82.2	Confident	79.6	Confident	24 Å²	24	70.6 Å²	70.6	16%	0.156	34%	0.342	C	S	.	.			trans	-63.5	134.6	172.7	20.8	-23.2	0	0	0	109.3	C416 W421 F424 A427 S428 L431	P414-C416 PolarHBondContact O-N 3.07Å; P414-W421 HydrophobicContact CB-CD2 4.16Å; P414-W421 HydrophobicContact CB-CE3 3.63Å; P414-W421 HydrophobicContact CB-CZ3 4.13Å; P414-F424 HydrophobicContact CG-CB 4.47Å; P414-A427 HydrophobicContact CG-CB 4.46Å; P414-S428 WeakPolarHBondContact CG-OG 3.42Å; P414-S428 WeakPolarHBondContact O-CB 3.23Å; P414-S428 PolarHBondContact O-OG 3.41Å; P414-L431 HydrophobicContact CG-CD1 4.4Å
415	N	79.5	Confident	79.6	Confident	22 Å²	22	69.6 Å²	69.6	12%	0.118	33%	0.331	C	S	.	.			trans	-90.5	106.4	-179.2	-172.7	-28.2	0	0	0	110.7	Y131 V413 A417 K418 W421	Y131-N415 HydrophobicContact CE1-CB 4.11Å; V413-N415 PolarHBondContact O-N 3.08Å; N415-A417 VanDerWaalsContact C-N 3.25Å; N415-A417 PolarHBondContact O-N 2.78Å; N415-A417 WeakPolarHBondContact OD1-CB 3.45Å; N415-A417 PolarHBondContact OD1-N 2.8Å; N415-K418 PolarHBondContact O-N 3.05Å; N415-W421 WeakPolarHBondContact O-CB 3.06Å
416	C	78.2	Confident	79.9	Confident	4 Å²	4	73.5 Å²	73.5	3%	0.027	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-7.8	-178.9	-73.6	0	0	0	0	115.4	P414 K418 W421 F425 S428	P414-C416 PolarHBondContact O-N 3.07Å; C416-K418 PolarHBondContact O-N 3.41Å; C416-W421 PolarHBondContact SG-O 2.72Å; C416-F425 HydrophobicContact CB-CB 4.4Å; C416-F425 WeakPolarHBondContact SG-CA 3.37Å; C416-F425 PolarHBondContact SG-N 3.27Å; C416-S428 PolarHBondContact SG-OG 3.4Å
417	A	69.9	Low	80.5	Confident	58 Å²	58	75.1 Å²	75.1	48%	0.479	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-17.8	168.4	0	0	0	0	0	111.8	T383 N415	T383-A417 HydrophobicContact CG2-CB 4.37Å; N415-A417 VanDerWaalsContact C-N 3.25Å; N415-A417 PolarHBondContact O-N 2.78Å; N415-A417 WeakPolarHBondContact OD1-CB 3.45Å; N415-A417 PolarHBondContact OD1-N 2.8Å
418	K	75.1	Confident	80.8	Confident	68 Å²	68	72.8 Å²	72.8	30%	0.296	35%	0.352	S	S	.	.	S	Bend	trans	-89.8	134.7	177.6	-65.3	-172.3	178.8	-178.1	0	111	T383 N415 C416 R420 W421 E422	T383-K418 WeakPolarHBondContact OG1-CE 3.41Å; N415-K418 PolarHBondContact O-N 3.05Å; C416-K418 PolarHBondContact O-N 3.41Å; K418-R420 PolarHBondContact O-N 2.88Å; K418-W421 PolarHBondContact O-N 2.86Å; K418-E422 PolarHBondContact O-N 3.04Å
419	P	70.1	Confident	81	Confident	114 Å²	114	72.6 Å²	72.6	74%	0.74	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.1	-176.7	22.9	-33.6	0	0	0	113.5	W421	P419-W421 VanDerWaalsContact C-N 3.3Å; P419-W421 PolarHBondContact O-N 3.26Å
420	R	71.6	Confident	81.5	Confident	227 Å²	227	77.3 Å²	77.3	86%	0.857	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.9	176.4	-59.7	-173.1	-159.6	167.9	5.4	113.4	K418	K418-R420 PolarHBondContact O-N 2.88Å
421	W	75.3	Confident	82	Confident	121 Å²	121	76.5 Å²	76.5	46%	0.458	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	4.6	-172.2	-64.4	94.7	0	0	0	113	P414 N415 C416 K418 P419 K423 F424	P414-W421 HydrophobicContact CB-CD2 4.16Å; P414-W421 HydrophobicContact CB-CE3 3.63Å; P414-W421 HydrophobicContact CB-CZ3 4.13Å; N415-W421 WeakPolarHBondContact O-CB 3.06Å; C416-W421 PolarHBondContact SG-O 2.72Å; K418-W421 PolarHBondContact O-N 2.86Å; P419-W421 VanDerWaalsContact C-N 3.3Å; P419-W421 PolarHBondContact O-N 3.26Å; W421-K423 PolarHBondContact O-N 3.36Å; W421-K423 VanDerWaalsContact O-N 3.08Å; W421-F424 AromaticContact CE3-CD2 3.8Å; W421-F424 HydrophobicContact CE3-CD2 3.8Å; W421-F424 HydrophobicContact CE3-CE2 4.31Å; W421-F424 HydrophobicContact CE3-CG 4.29Å; W421-F424 HydrophobicContact CZ3-CD2 4.34Å; W421-F424 HydrophobicContact CZ3-CE2 4.49Å; W421-F424 PolarHBondContact O-N 2.88Å
422	E	75.3	Confident	82.4	Confident	76 Å²	76	69.5 Å²	69.5	36%	0.355	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-55.4	-31.7	-177.4	-175.3	172.2	-157.4	0	0	113.2	K138 K418 F424 F425	K138-E422 IonicContact NZ-OE1 3.91Å; K138-E422 PolarHBondContact NZ-OE1 3.29Å; K418-E422 PolarHBondContact O-N 3.04Å; E422-F424 PolarHBondContact O-N 3.37Å; E422-F425 WeakPolarHBondContact O-CD1 3.41Å
423	K	79.8	Confident	82.8	Confident	195 Å²	195	68.6 Å²	68.6	85%	0.848	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-69.3	-19.4	177	-64.1	-174.5	-179.8	-178.1	0	113.8	W421 F425	W421-K423 PolarHBondContact O-N 3.36Å; W421-K423 VanDerWaalsContact O-N 3.08Å; K423-F425 VanDerWaalsContact C-N 3.33Å
424	F	84.9	Confident	83.2	Confident	112 Å²	112	72.3 Å²	72.3	49%	0.491	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-94.2	20	-178.4	-69.5	-83.3	0	0	0	113.1	P414 W421 E422 M426 A427 S428	P414-F424 HydrophobicContact CG-CB 4.47Å; W421-F424 AromaticContact CE3-CD2 3.8Å; W421-F424 HydrophobicContact CE3-CD2 3.8Å; W421-F424 HydrophobicContact CE3-CE2 4.31Å; W421-F424 HydrophobicContact CE3-CG 4.29Å; W421-F424 HydrophobicContact CZ3-CD2 4.34Å; W421-F424 HydrophobicContact CZ3-CE2 4.49Å; W421-F424 PolarHBondContact O-N 2.88Å; E422-F424 PolarHBondContact O-N 3.37Å; F424-M426 VanDerWaalsContact C-N 3.26Å; F424-M426 PolarHBondContact O-N 3.3Å; F424-M426 VanDerWaalsContact O-N 3.17Å; F424-A427 HydrophobicContact CB-CB 4.42Å; F424-A427 WeakPolarHBondContact O-CA 3.1Å; F424-A427 WeakPolarHBondContact O-CB 3.25Å; F424-A427 PolarHBondContact O-N 3.09Å; F424-S428 PolarHBondContact O-N 3.49Å; F424-S428 PolarHBondContact O-OG 2.95Å
425	F	85.9	Confident	83.7	Confident	43 Å²	43	73.7 Å²	73.7	19%	0.189	36%	0.36	C	S	.	.	H	α-helix	trans	-52.9	-38.4	-177.8	71.9	-84.6	0	0	0	114.3	K138 I139 K142 C416 E422 K423 S428 F429	K138-F425 HydrophobicContact CB-CB 4.02Å; K138-F425 HydrophobicContact CB-CD2 4.47Å; K138-F425 HydrophobicContact CB-CG 4.38Å; I139-F425 HydrophobicContact CG1-CD2 3.69Å; I139-F425 HydrophobicContact CG1-CE2 3.85Å; K142-F425 HydrophobicContact CG-CE1 4.42Å; K142-F425 HydrophobicContact CG-CE2 4.49Å; K142-F425 HydrophobicContact CG-CZ 4.1Å; C416-F425 HydrophobicContact CB-CB 4.4Å; C416-F425 WeakPolarHBondContact SG-CA 3.37Å; C416-F425 PolarHBondContact SG-N 3.27Å; E422-F425 WeakPolarHBondContact O-CD1 3.41Å; K423-F425 VanDerWaalsContact C-N 3.33Å; F425-S428 PolarHBondContact O-N 3.32Å; F425-F429 WeakPolarHBondContact O-CB 3.28Å; F425-F429 PolarHBondContact O-N 3.08Å
426	M	89.1	Confident	84.4	Confident	85 Å²	85	72.7 Å²	72.7	42%	0.419	35%	0.354	S	S	.	.	H	α-helix	trans	-71.1	-33.6	177.5	-155.8	56.9	54.3	0	0	112.8	I139 F424 F429 I430	I139-M426 HydrophobicContact CD1-CE 3.97Å; I139-M426 HydrophobicContact CD1-SD 4.22Å; I139-M426 HydrophobicContact CG1-CE 3.81Å; F424-M426 VanDerWaalsContact C-N 3.26Å; F424-M426 PolarHBondContact O-N 3.3Å; F424-M426 VanDerWaalsContact O-N 3.17Å; M426-F429 PolarHBondContact O-N 2.81Å; M426-F429 HydrophobicContact SD-CD1 4.28Å; M426-I430 WeakPolarHBondContact O-CG1 3.25Å; M426-I430 PolarHBondContact O-N 2.94Å; M426-I430 VanDerWaalsContact O-N 3.08Å
427	A	89.6	Confident	85.1	Confident	36 Å²	36	73.9 Å²	73.9	30%	0.298	37%	0.365	S	S	.	.	H	α-helix	trans	-69.1	-40.6	174.8	0	0	0	0	0	110.9	P414 F424 F429 I430 L431	P414-A427 HydrophobicContact CG-CB 4.46Å; F424-A427 HydrophobicContact CB-CB 4.42Å; F424-A427 WeakPolarHBondContact O-CA 3.1Å; F424-A427 WeakPolarHBondContact O-CB 3.25Å; F424-A427 PolarHBondContact O-N 3.09Å; A427-F429 VanDerWaalsContact C-N 3.34Å; A427-I430 PolarHBondContact O-N 3.29Å; A427-L431 VanDerWaalsContact O-CB 3.31Å; A427-L431 WeakPolarHBondContact O-CB 3.38Å; A427-L431 WeakPolarHBondContact O-CD1 3.48Å; A427-L431 VanDerWaalsContact O-CG 3.29Å; A427-L431 WeakPolarHBondContact O-CG 3.32Å; A427-L431 PolarHBondContact O-N 2.94Å
428	S	88.9	Confident	86.2	Confident	1 Å²	1	74 Å²	74	1%	0.007	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-40.1	173.7	-58.6	0	0	0	0	112.6	P414 C416 F424 F425 S432	P414-S428 WeakPolarHBondContact CG-OG 3.42Å; P414-S428 WeakPolarHBondContact O-CB 3.23Å; P414-S428 PolarHBondContact O-OG 3.41Å; C416-S428 PolarHBondContact SG-OG 3.4Å; F424-S428 PolarHBondContact O-N 3.49Å; F424-S428 PolarHBondContact O-OG 2.95Å; F425-S428 PolarHBondContact O-N 3.32Å; S428-S432 WeakPolarHBondContact O-CB 3.48Å; S428-S432 PolarHBondContact O-N 3.41Å; S428-S432 PolarHBondContact O-OG 3.29Å
429	F	90.6	Very high	87	Confident	55 Å²	55	71.3 Å²	71.3	24%	0.241	35%	0.348	C	S	.	.	H	α-helix	trans	-57	-57.5	173.7	178.8	-103.2	0	0	0	110.3	F132 S135 L136 I139 F425 M426 A427 L431 S432 T433	F132-F429 HydrophobicContact CD2-CD2 4.04Å; F132-F429 HydrophobicContact CD2-CE2 4.05Å; F132-F429 AromaticContact CE2-CD2 3.71Å; F132-F429 HydrophobicContact CE2-CD2 3.71Å; F132-F429 AromaticContact CE2-CE2 3.26Å; F132-F429 HydrophobicContact CE2-CE2 3.26Å; F132-F429 HydrophobicContact CE2-CZ 4Å; F132-F429 AromaticContact CZ-CE2 3.86Å; F132-F429 HydrophobicContact CZ-CE2 3.86Å; S135-F429 WeakPolarHBondContact OG-CA 3.37Å; L136-F429 HydrophobicContact CD2-CD2 4.23Å; L136-F429 HydrophobicContact CD2-CE2 3.65Å; L136-F429 HydrophobicContact CG-CD2 4.29Å; L136-F429 HydrophobicContact CG-CE2 4.03Å; I139-F429 HydrophobicContact CD1-CB 4.11Å; I139-F429 HydrophobicContact CD1-CD1 4.39Å; I139-F429 HydrophobicContact CD1-CD2 3.78Å; I139-F429 HydrophobicContact CD1-CE2 4.3Å; I139-F429 HydrophobicContact CD1-CG 3.83Å; F425-F429 WeakPolarHBondContact O-CB 3.28Å; F425-F429 PolarHBondContact O-N 3.08Å; M426-F429 PolarHBondContact O-N 2.81Å; M426-F429 HydrophobicContact SD-CD1 4.28Å; A427-F429 VanDerWaalsContact C-N 3.34Å; F429-L431 PolarHBondContact O-N 3.46Å; F429-S432 PolarHBondContact O-N 2.8Å; F429-S432 PolarHBondContact O-OG 3.03Å; F429-T433 WeakPolarHBondContact O-CB 3.23Å; F429-T433 PolarHBondContact O-N 3.16Å; F429-T433 PolarHBondContact O-OG1 3.49Å
430	I	91.9	Very high	88.1	Confident	99 Å²	99	65.9 Å²	65.9	51%	0.508	31%	0.312	S	S	.	.	H	α-helix	trans	-60.4	-47.3	-178.3	-64.4	166.6	0	0	0	112	M426 A427 T433 V434	M426-I430 WeakPolarHBondContact O-CG1 3.25Å; M426-I430 PolarHBondContact O-N 2.94Å; M426-I430 VanDerWaalsContact O-N 3.08Å; A427-I430 PolarHBondContact O-N 3.29Å; I430-T433 WeakPolarHBondContact O-CB 3.26Å; I430-T433 PolarHBondContact O-N 3.08Å; I430-V434 WeakPolarHBondContact O-CG2 3.14Å; I430-V434 PolarHBondContact O-N 3.31Å
431	L	92.1	Very high	89.1	Confident	66 Å²	66	58 Å²	58	35%	0.346	28%	0.283	S	S	.	.	H	α-helix	trans	-68	-38	-177.2	-71.5	163.3	0	0	0	112.2	T412 V413 P414 A427 F429 V434 W435	T412-L431 WeakPolarHBondContact O-CD1 3.27Å; V413-L431 HydrophobicContact CG1-CB 4.31Å; V413-L431 HydrophobicContact CG2-CB 4.17Å; P414-L431 HydrophobicContact CG-CD1 4.4Å; A427-L431 VanDerWaalsContact O-CB 3.31Å; A427-L431 WeakPolarHBondContact O-CB 3.38Å; A427-L431 WeakPolarHBondContact O-CD1 3.48Å; A427-L431 VanDerWaalsContact O-CG 3.29Å; A427-L431 WeakPolarHBondContact O-CG 3.32Å; A427-L431 PolarHBondContact O-N 2.94Å; F429-L431 PolarHBondContact O-N 3.46Å; L431-V434 PolarHBondContact O-N 3.43Å; L431-W435 VanDerWaalsContact O-CD1 3.29Å; L431-W435 PolarHBondContact O-N 2.79Å; L431-W435 VanDerWaalsContact O-N 3.1Å
432	S	91.6	Very high	90	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.3	-39.4	173.7	62.3	0	0	0	0	111.7	S428 F429 V434 W435 I436	S428-S432 WeakPolarHBondContact O-CB 3.48Å; S428-S432 PolarHBondContact O-N 3.41Å; S428-S432 PolarHBondContact O-OG 3.29Å; F429-S432 PolarHBondContact O-N 2.8Å; F429-S432 PolarHBondContact O-OG 3.03Å; S432-V434 VanDerWaalsContact C-N 3.33Å; S432-V434 PolarHBondContact O-N 3.5Å; S432-W435 PolarHBondContact O-N 3.41Å; S432-I436 VanDerWaalsContact O-CG1 3.26Å; S432-I436 WeakPolarHBondContact O-CG1 3.31Å; S432-I436 PolarHBondContact O-N 3.35Å
433	T	91.9	Very high	90.7	Very high	32 Å²	32	50.8 Å²	50.8	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-57.5	-44.1	172.7	-58.4	0	0	0	0	112.1	F132 F165 F429 I430 I436 A437	F132-T433 WeakPolarHBondContact CE2-OG1 3.37Å; F165-T433 HydrophobicContact CE2-CG2 3.84Å; F165-T433 HydrophobicContact CZ-CG2 3.42Å; F165-T433 VanDerWaalsContact CZ-CG2 3.42Å; F429-T433 WeakPolarHBondContact O-CB 3.23Å; F429-T433 PolarHBondContact O-N 3.16Å; F429-T433 PolarHBondContact O-OG1 3.49Å; I430-T433 WeakPolarHBondContact O-CB 3.26Å; I430-T433 PolarHBondContact O-N 3.08Å; T433-I436 PolarHBondContact O-N 3.19Å; T433-A437 PolarHBondContact O-N 3.13Å
434	V	93.2	Very high	91.3	Very high	80 Å²	80	41.5 Å²	41.5	49%	0.485	22%	0.216	S	C	.	.	H	α-helix	trans	-62.4	-44.5	176.3	172.1	0	0	0	0	111.4	I430 L431 S432 A437 V438	I430-V434 WeakPolarHBondContact O-CG2 3.14Å; I430-V434 PolarHBondContact O-N 3.31Å; L431-V434 PolarHBondContact O-N 3.43Å; S432-V434 VanDerWaalsContact C-N 3.33Å; S432-V434 PolarHBondContact O-N 3.5Å; V434-A437 WeakPolarHBondContact O-CB 3.47Å; V434-A437 PolarHBondContact O-N 2.67Å; V434-V438 WeakPolarHBondContact O-CG2 3.44Å; V434-V438 PolarHBondContact O-N 3.46Å
435	W	93.7	Very high	91.6	Very high	54 Å²	54	38.2 Å²	38.2	21%	0.205	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-36.7	177.5	-83.7	110.6	0	0	0	113.3	T127 L408 L409 T412 L431 S432 A437 V438 F439	T127-W435 HydrophobicContact CG2-CB 4.06Å; L408-W435 HydrophobicContact CD1-CH2 3.88Å; L408-W435 HydrophobicContact CD1-CZ3 4.28Å; L408-W435 HydrophobicContact CD2-CD2 4.12Å; L408-W435 HydrophobicContact CD2-CE3 4.05Å; L408-W435 HydrophobicContact CD2-CH2 3.5Å; L408-W435 VanDerWaalsContact CD2-CH2 3.5Å; L408-W435 HydrophobicContact CD2-CZ2 3.53Å; L408-W435 HydrophobicContact CD2-CZ3 3.75Å; L408-W435 HydrophobicContact CG-CH2 3.97Å; L408-W435 HydrophobicContact CG-CZ2 4.13Å; L409-W435 HydrophobicContact CD2-CB 4.32Å; L409-W435 HydrophobicContact CD2-CD2 4.36Å; L409-W435 HydrophobicContact CD2-CG 4Å; T412-W435 HydrophobicContact CG2-CZ2 3.88Å; T412-W435 PolarHBondContact OG1-NE1 3.09Å; L431-W435 VanDerWaalsContact O-CD1 3.29Å; L431-W435 PolarHBondContact O-N 2.79Å; L431-W435 VanDerWaalsContact O-N 3.1Å; S432-W435 PolarHBondContact O-N 3.41Å; W435-A437 VanDerWaalsContact C-N 3.33Å; W435-V438 HydrophobicContact CE3-CB 4.29Å; W435-V438 HydrophobicContact CE3-CG1 4.25Å; W435-V438 HydrophobicContact CZ3-CG1 4.09Å; W435-V438 PolarHBondContact O-N 3.05Å; W435-F439 HydrophobicContact CB-CD2 4.35Å; W435-F439 HydrophobicContact CB-CE2 4.01Å; W435-F439 HydrophobicContact CD2-CE2 4.35Å; W435-F439 HydrophobicContact CD2-CZ 4.17Å; W435-F439 HydrophobicContact CE3-CD1 4.42Å; W435-F439 AromaticContact CE3-CE1 3.72Å; W435-F439 HydrophobicContact CE3-CE1 3.72Å; W435-F439 AromaticContact CE3-CE2 3.84Å; W435-F439 HydrophobicContact CE3-CE2 3.84Å; W435-F439 AromaticContact CE3-CZ 3.38Å; W435-F439 HydrophobicContact CE3-CZ 3.38Å; W435-F439 HydrophobicContact CG-CE2 4.46Å; W435-F439 AromaticContact CZ3-CE1 3.92Å; W435-F439 HydrophobicContact CZ3-CE1 3.92Å; W435-F439 AromaticContact CZ3-CZ 3.9Å; W435-F439 HydrophobicContact CZ3-CZ 3.9Å; W435-F439 WeakPolarHBondContact O-CB 3.31Å; W435-F439 WeakPolarHBondContact O-CD2 3.35Å; W435-F439 VanDerWaalsContact O-CG 3.32Å; W435-F439 WeakPolarHBondContact O-CG 3.47Å; W435-F439 PolarHBondContact O-N 2.94Å
436	I	92.9	Very high	91.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.9	-46.6	172.6	-66.4	166.1	0	0	0	109.5	L124 T127 C128 F132 A161 F165 S432 T433 V438 F439 S440	L124-I436 HydrophobicContact CD2-CB 4.48Å; L124-I436 HydrophobicContact CD2-CG2 3.95Å; T127-I436 HydrophobicContact CG2-CD1 4.5Å; T127-I436 HydrophobicContact CG2-CG1 3.81Å; C128-I436 VanDerWaalsContact SG-CD1 3.55Å; F132-I436 HydrophobicContact CB-CD1 3.75Å; F132-I436 HydrophobicContact CD1-CD1 4.01Å; F132-I436 HydrophobicContact CD2-CD1 4.04Å; F132-I436 HydrophobicContact CG-CD1 3.68Å; A161-I436 HydrophobicContact CB-CD1 4.22Å; A161-I436 HydrophobicContact CB-CG2 4.47Å; F165-I436 HydrophobicContact CD2-CB 4.17Å; F165-I436 HydrophobicContact CD2-CG2 3.45Å; F165-I436 VanDerWaalsContact CD2-CG2 3.45Å; F165-I436 HydrophobicContact CE2-CB 4.36Å; F165-I436 HydrophobicContact CE2-CG2 4.05Å; F165-I436 HydrophobicContact CG-CG2 4.28Å; S432-I436 VanDerWaalsContact O-CG1 3.26Å; S432-I436 WeakPolarHBondContact O-CG1 3.31Å; S432-I436 PolarHBondContact O-N 3.35Å; T433-I436 PolarHBondContact O-N 3.19Å; I436-V438 PolarHBondContact O-N 3Å; I436-F439 PolarHBondContact O-N 3.38Å; I436-S440 VanDerWaalsContact O-CB 3.31Å; I436-S440 WeakPolarHBondContact O-CB 3.16Å; I436-S440 PolarHBondContact O-N 3.4Å; I436-S440 PolarHBondContact O-OG 2.72Å; I436-S440 VanDerWaalsContact O-OG 3.14Å
437	A	92.8	Very high	91.9	Very high	30 Å²	30	33.3 Å²	33.3	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-59.1	-44.8	176.8	0	0	0	0	0	112.5	F165 T433 V434 W435 S440 Y441	F165-A437 HydrophobicContact CD1-CB 3.58Å; F165-A437 HydrophobicContact CE1-CB 3.66Å; F165-A437 HydrophobicContact CG-CB 4.16Å; F165-A437 HydrophobicContact CZ-CB 4.3Å; T433-A437 PolarHBondContact O-N 3.13Å; V434-A437 WeakPolarHBondContact O-CB 3.47Å; V434-A437 PolarHBondContact O-N 2.67Å; W435-A437 VanDerWaalsContact C-N 3.33Å; A437-S440 PolarHBondContact O-N 2.83Å; A437-Y441 WeakPolarHBondContact O-CB 3.47Å; A437-Y441 PolarHBondContact O-N 3.03Å
438	V	93.4	Very high	91.9	Very high	60 Å²	60	31.7 Å²	31.7	36%	0.364	16%	0.163	S	C	.	.	H	α-helix	trans	-63.9	-46.6	178.1	172	0	0	0	0	111.6	V434 W435 I436 Y441 L442	V434-V438 WeakPolarHBondContact O-CG2 3.44Å; V434-V438 PolarHBondContact O-N 3.46Å; W435-V438 HydrophobicContact CE3-CB 4.29Å; W435-V438 HydrophobicContact CE3-CG1 4.25Å; W435-V438 HydrophobicContact CZ3-CG1 4.09Å; W435-V438 PolarHBondContact O-N 3.05Å; I436-V438 PolarHBondContact O-N 3Å; V438-Y441 PolarHBondContact O-N 3.48Å; V438-L442 HydrophobicContact CG1-CD1 4.35Å; V438-L442 WeakPolarHBondContact O-CG 3.44Å; V438-L442 PolarHBondContact O-N 2.91Å; V438-L442 VanDerWaalsContact O-N 3.09Å
439	F	93.4	Very high	91.8	Very high	11 Å²	11	31.7 Å²	31.7	5%	0.048	16%	0.163	C	C	.	.	H	α-helix	trans	-68.8	-36.9	179.2	-64.5	-41.5	0	0	0	112.2	M120 A123 L124 T127 L405 L408 L409 W435 I436 Y441 L442 M443	M120-F439 HydrophobicContact SD-CD1 4.07Å; A123-F439 HydrophobicContact CB-CD1 4.02Å; A123-F439 HydrophobicContact CB-CD2 3.89Å; A123-F439 HydrophobicContact CB-CE1 4.16Å; A123-F439 HydrophobicContact CB-CE2 4.03Å; A123-F439 HydrophobicContact CB-CG 3.9Å; A123-F439 HydrophobicContact CB-CZ 4.17Å; L124-F439 HydrophobicContact CD2-CB 3.67Å; L124-F439 HydrophobicContact CG-CB 3.83Å; T127-F439 WeakPolarHBondContact OG1-CE2 3.31Å; L405-F439 HydrophobicContact CD1-CE1 4Å; L405-F439 HydrophobicContact CD1-CE2 4.11Å; L405-F439 HydrophobicContact CD1-CZ 3.51Å; L408-F439 HydrophobicContact CD2-CZ 4.28Å; L409-F439 HydrophobicContact CD2-CE2 4.18Å; L409-F439 HydrophobicContact CD2-CZ 4.46Å; W435-F439 HydrophobicContact CB-CD2 4.35Å; W435-F439 HydrophobicContact CB-CE2 4.01Å; W435-F439 HydrophobicContact CD2-CE2 4.35Å; W435-F439 HydrophobicContact CD2-CZ 4.17Å; W435-F439 HydrophobicContact CE3-CD1 4.42Å; W435-F439 AromaticContact CE3-CE1 3.72Å; W435-F439 HydrophobicContact CE3-CE1 3.72Å; W435-F439 AromaticContact CE3-CE2 3.84Å; W435-F439 HydrophobicContact CE3-CE2 3.84Å; W435-F439 AromaticContact CE3-CZ 3.38Å; W435-F439 HydrophobicContact CE3-CZ 3.38Å; W435-F439 HydrophobicContact CG-CE2 4.46Å; W435-F439 AromaticContact CZ3-CE1 3.92Å; W435-F439 HydrophobicContact CZ3-CE1 3.92Å; W435-F439 AromaticContact CZ3-CZ 3.9Å; W435-F439 HydrophobicContact CZ3-CZ 3.9Å; W435-F439 WeakPolarHBondContact O-CB 3.31Å; W435-F439 WeakPolarHBondContact O-CD2 3.35Å; W435-F439 VanDerWaalsContact O-CG 3.32Å; W435-F439 WeakPolarHBondContact O-CG 3.47Å; W435-F439 PolarHBondContact O-N 2.94Å; I436-F439 PolarHBondContact O-N 3.38Å; F439-Y441 VanDerWaalsContact C-N 3.32Å; F439-Y441 PolarHBondContact O-N 3.38Å; F439-L442 PolarHBondContact O-N 3.3Å; F439-M443 WeakPolarHBondContact O-CB 3.23Å; F439-M443 PolarHBondContact O-N 2.84Å
440	S	92.4	Very high	91.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-39	173.1	-70.4	0	0	0	0	111.4	P162 I436 A437 M443 V444	P162-S440 PolarHBondContact O-OG 3.11Å; I436-S440 VanDerWaalsContact O-CB 3.31Å; I436-S440 WeakPolarHBondContact O-CB 3.16Å; I436-S440 PolarHBondContact O-N 3.4Å; I436-S440 PolarHBondContact O-OG 2.72Å; I436-S440 VanDerWaalsContact O-OG 3.14Å; A437-S440 PolarHBondContact O-N 2.83Å; S440-M443 PolarHBondContact O-N 2.98Å; S440-V444 WeakPolarHBondContact O-CG2 3.43Å; S440-V444 PolarHBondContact O-N 3.37Å
441	Y	93.1	Very high	91.5	Very high	62 Å²	62	24.3 Å²	24.3	24%	0.243	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-51.6	176	171.5	-98	0	0	0	111.5	F95 P96 I169 I173 A437 V438 F439 M443 V444 W445	F95-Y441 AromaticContact CD1-CE2 3.77Å; F95-Y441 HydrophobicContact CD1-CE2 3.77Å; F95-Y441 AromaticContact CD1-CZ 3.9Å; F95-Y441 HydrophobicContact CE1-CD2 4.02Å; F95-Y441 AromaticContact CE1-CE2 3.54Å; F95-Y441 HydrophobicContact CE1-CE2 3.54Å; P96-Y441 VanDerWaalsContact CD-OH 3.3Å; P96-Y441 WeakPolarHBondContact CD-OH 3.36Å; I169-Y441 HydrophobicContact CG2-CD2 4.41Å; I173-Y441 HydrophobicContact CD1-CD2 3.62Å; I173-Y441 HydrophobicContact CD1-CE2 3.77Å; I173-Y441 HydrophobicContact CG2-CE2 4.18Å; A437-Y441 WeakPolarHBondContact O-CB 3.47Å; A437-Y441 PolarHBondContact O-N 3.03Å; V438-Y441 PolarHBondContact O-N 3.48Å; F439-Y441 VanDerWaalsContact C-N 3.32Å; F439-Y441 PolarHBondContact O-N 3.38Å; Y441-M443 VanDerWaalsContact C-N 3.27Å; Y441-M443 PolarHBondContact O-N 3.24Å; Y441-V444 PolarHBondContact O-N 3.38Å; Y441-W445 HydrophobicContact CE1-CE3 4.25Å; Y441-W445 WeakPolarHBondContact O-CB 3.14Å; Y441-W445 PolarHBondContact O-N 2.96Å
442	L	92.7	Very high	91.2	Very high	46 Å²	46	21.5 Å²	21.5	24%	0.241	11%	0.112	C	C	.	.	H	α-helix	trans	-63	-36.6	178.1	-64	176.1	0	0	0	111.7	M120 V438 F439 W445 M446	M120-L442 HydrophobicContact CE-CB 3.8Å; M120-L442 HydrophobicContact CE-CD1 3.51Å; M120-L442 HydrophobicContact CE-CG 4.26Å; M120-L442 HydrophobicContact CG-CB 4.28Å; M120-L442 HydrophobicContact SD-CB 4.08Å; M120-L442 HydrophobicContact SD-CD1 4.17Å; V438-L442 HydrophobicContact CG1-CD1 4.35Å; V438-L442 WeakPolarHBondContact O-CG 3.44Å; V438-L442 PolarHBondContact O-N 2.91Å; V438-L442 VanDerWaalsContact O-N 3.09Å; F439-L442 PolarHBondContact O-N 3.3Å; L442-W445 HydrophobicContact CD2-CE3 3.89Å; L442-W445 HydrophobicContact CD2-CZ3 4.13Å; L442-M446 VanDerWaalsContact O-CG 3.25Å; L442-M446 WeakPolarHBondContact O-CG 3.48Å; L442-M446 PolarHBondContact O-N 3.28Å
443	M	91.6	Very high	90.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63	-51.4	176	177	-165.9	70	0	0	111.8	M120 F121 L124 A166 F439 S440 Y441 W445 M446 V447 L466 T470	M120-M443 HydrophobicContact CB-CB 4.07Å; F121-M443 HydrophobicContact CD1-CG 4.44Å; F121-M443 HydrophobicContact CD1-SD 3.62Å; F121-M443 HydrophobicContact CE1-CG 4.02Å; F121-M443 HydrophobicContact CE1-SD 3.19Å; F121-M443 WeakPolarHBondContact CE1-SD 3.42Å; F121-M443 HydrophobicContact CZ-CG 4.22Å; F121-M443 HydrophobicContact CZ-SD 3.93Å; L124-M443 HydrophobicContact CD1-CB 4.4Å; L124-M443 HydrophobicContact CD1-CE 4.07Å; L124-M443 HydrophobicContact CD1-CG 4.47Å; L124-M443 HydrophobicContact CD1-SD 3.38Å; L124-M443 WeakPolarHBondContact CD1-SD 3.15Å; A166-M443 HydrophobicContact CB-CE 4.26Å; F439-M443 WeakPolarHBondContact O-CB 3.23Å; F439-M443 PolarHBondContact O-N 2.84Å; S440-M443 PolarHBondContact O-N 2.98Å; Y441-M443 VanDerWaalsContact C-N 3.27Å; Y441-M443 PolarHBondContact O-N 3.24Å; M443-W445 VanDerWaalsContact C-N 3.3Å; M443-W445 PolarHBondContact O-N 3.2Å; M443-M446 PolarHBondContact O-N 3.08Å; M443-V447 WeakPolarHBondContact O-CB 3.28Å; M443-V447 VanDerWaalsContact O-CG2 3.3Å; M443-V447 WeakPolarHBondContact O-CG2 3.27Å; M443-V447 PolarHBondContact O-N 3.44Å; M443-L466 HydrophobicContact CE-CD1 3.81Å; M443-L466 HydrophobicContact CE-CD2 4.16Å; M443-L466 HydrophobicContact CE-CG 3.87Å; M443-L466 HydrophobicContact CG-CD1 3.89Å; M443-L466 HydrophobicContact SD-CD1 4.04Å; M443-T470 HydrophobicContact CE-CG2 4.08Å; M443-T470 HydrophobicContact SD-CG2 4.15Å
444	V	91.7	Very high	90.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.9	-42.3	178.6	178.5	0	0	0	0	110.2	F95 A166 I169 T174 V178 S440 Y441 V447 T448 L466	F95-V444 HydrophobicContact CE2-CG1 4.43Å; F95-V444 HydrophobicContact CZ-CB 4.4Å; F95-V444 HydrophobicContact CZ-CG1 3.84Å; A166-V444 HydrophobicContact CB-CG2 4.31Å; I169-V444 HydrophobicContact CB-CG2 4.47Å; I169-V444 HydrophobicContact CD1-CG2 4.38Å; I169-V444 HydrophobicContact CG2-CB 4.09Å; I169-V444 HydrophobicContact CG2-CG1 4.06Å; I169-V444 HydrophobicContact CG2-CG2 4.12Å; T174-V444 HydrophobicContact CG2-CG1 4.39Å; V178-V444 HydrophobicContact CG1-CG1 4.19Å; S440-V444 WeakPolarHBondContact O-CG2 3.43Å; S440-V444 PolarHBondContact O-N 3.37Å; Y441-V444 PolarHBondContact O-N 3.38Å; V444-V447 PolarHBondContact O-N 3.27Å; V444-T448 HydrophobicContact CG1-CG2 4.32Å; V444-T448 WeakPolarHBondContact O-CG2 3.47Å; V444-T448 PolarHBondContact O-N 3.27Å; V444-T448 PolarHBondContact O-OG1 2.92Å; V444-L466 HydrophobicContact CG2-CD2 3.96Å
445	W	91.4	Very high	89.8	Confident	43 Å²	43	21.4 Å²	21.4	16%	0.163	12%	0.116	C	C	.	.	H	α-helix	trans	-60.3	-49.7	177.3	-178	20.7	0	0	0	112.5	F95 P96 Y441 L442 M443 V447 T448 I449	F95-W445 HydrophobicContact CB-CD2 4.4Å; F95-W445 HydrophobicContact CB-CG 3.96Å; F95-W445 VanDerWaalsContact CB-NE1 3.33Å; F95-W445 HydrophobicContact CD1-CB 3.64Å; F95-W445 AromaticContact CD1-CD1 3.75Å; F95-W445 HydrophobicContact CD1-CD2 4.37Å; F95-W445 AromaticContact CD1-CG 3.65Å; F95-W445 HydrophobicContact CD1-CG 3.65Å; F95-W445 AromaticContact CD2-CD1 3.89Å; F95-W445 HydrophobicContact CD2-CG 4.46Å; F95-W445 HydrophobicContact CE1-CB 3.73Å; F95-W445 HydrophobicContact CE1-CG 4.26Å; F95-W445 HydrophobicContact CG-CB 4.09Å; F95-W445 AromaticContact CG-CD1 3.36Å; F95-W445 AromaticContact CG-CG 3.78Å; F95-W445 HydrophobicContact CG-CG 3.78Å; F95-W445 AromaticContact CG-NE1 3.98Å; F95-W445 HydrophobicContact CZ-CB 4.23Å; P96-W445 HydrophobicContact CB-CH2 4.05Å; P96-W445 HydrophobicContact CB-CZ2 3.89Å; P96-W445 HydrophobicContact CG-CH2 4.22Å; P96-W445 HydrophobicContact CG-CZ2 4.24Å; P96-W445 VanDerWaalsContact O-CZ2 3.23Å; P96-W445 WeakPolarHBondContact O-CZ2 3.3Å; P96-W445 PolarHBondContact O-NE1 3.26Å; Y441-W445 HydrophobicContact CE1-CE3 4.25Å; Y441-W445 WeakPolarHBondContact O-CB 3.14Å; Y441-W445 PolarHBondContact O-N 2.96Å; L442-W445 HydrophobicContact CD2-CE3 3.89Å; L442-W445 HydrophobicContact CD2-CZ3 4.13Å; M443-W445 VanDerWaalsContact C-N 3.3Å; M443-W445 PolarHBondContact O-N 3.2Å; W445-V447 VanDerWaalsContact C-N 3.27Å; W445-V447 PolarHBondContact O-N 3.24Å; W445-T448 PolarHBondContact O-N 3.06Å; W445-T448 PolarHBondContact O-OG1 2.91Å; W445-I449 HydrophobicContact CG-CD1 4.48Å; W445-I449 WeakPolarHBondContact O-CG1 3.28Å; W445-I449 PolarHBondContact O-N 3.37Å; W445-I449 VanDerWaalsContact O-N 3.14Å
446	M	91	Very high	89.3	Confident	23 Å²	23	19 Å²	19	11%	0.113	11%	0.108	C	C	.	.	H	α-helix	trans	-65.1	-33.7	179	-64.3	-60.3	103.8	0	0	112	A116 T117 L442 M443 I449 I450	A116-M446 HydrophobicContact CB-CG 4.22Å; A116-M446 HydrophobicContact CB-SD 4.26Å; T117-M446 WeakPolarHBondContact OG1-CB 3.48Å; L442-M446 VanDerWaalsContact O-CG 3.25Å; L442-M446 WeakPolarHBondContact O-CG 3.48Å; L442-M446 PolarHBondContact O-N 3.28Å; M443-M446 PolarHBondContact O-N 3.08Å; M446-I449 HydrophobicContact CE-CD1 3.8Å; M446-I449 HydrophobicContact SD-CD1 4.46Å; M446-I450 WeakPolarHBondContact O-CD1 3.36Å; M446-I450 VanDerWaalsContact O-CG1 3.23Å; M446-I450 WeakPolarHBondContact O-CG1 3.31Å; M446-I450 PolarHBondContact O-N 3.38Å; M446-I450 VanDerWaalsContact O-N 3.11Å
447	V	89.9	Confident	88.9	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-71	-40.3	178.7	169.7	0	0	0	0	112.7	T117 M443 V444 W445 I449 I450 G451 M461 F465 L466	T117-V447 HydrophobicContact CG2-CG2 3.51Å; M443-V447 WeakPolarHBondContact O-CB 3.28Å; M443-V447 VanDerWaalsContact O-CG2 3.3Å; M443-V447 WeakPolarHBondContact O-CG2 3.27Å; M443-V447 PolarHBondContact O-N 3.44Å; V444-V447 PolarHBondContact O-N 3.27Å; W445-V447 VanDerWaalsContact C-N 3.27Å; W445-V447 PolarHBondContact O-N 3.24Å; V447-I449 VanDerWaalsContact C-N 3.34Å; V447-I450 PolarHBondContact O-N 3.27Å; V447-G451 PolarHBondContact O-N 3.49Å; V447-M461 HydrophobicContact CG1-CB 3.86Å; V447-M461 HydrophobicContact CG1-CE 3.76Å; V447-F465 HydrophobicContact CB-CD1 4.5Å; V447-F465 HydrophobicContact CG1-CD1 4.02Å; V447-F465 HydrophobicContact CG2-CD1 3.6Å; V447-F465 HydrophobicContact CG2-CE1 3.41Å; V447-F465 VanDerWaalsContact CG2-CE1 3.41Å; V447-L466 HydrophobicContact CB-CD1 3.9Å; V447-L466 HydrophobicContact CG1-CD1 3.98Å; V447-L466 HydrophobicContact CG2-CD1 3.59Å
448	T	88.8	Confident	88.5	Confident	2 Å²	2	20.3 Å²	20.3	1%	0.012	11%	0.112	C	C	.	.	H	α-helix	trans	-65.6	-37.6	175.6	49.2	0	0	0	0	111.4	A91 F95 V178 V444 W445 I450 G451 Y452	A91-T448 HydrophobicContact CB-CG2 4.4Å; F95-T448 HydrophobicContact CE2-CG2 4.06Å; F95-T448 WeakPolarHBondContact CE2-OG1 3.37Å; V178-T448 HydrophobicContact CG2-CG2 4.43Å; V444-T448 HydrophobicContact CG1-CG2 4.32Å; V444-T448 WeakPolarHBondContact O-CG2 3.47Å; V444-T448 PolarHBondContact O-N 3.27Å; V444-T448 PolarHBondContact O-OG1 2.92Å; W445-T448 PolarHBondContact O-N 3.06Å; W445-T448 PolarHBondContact O-OG1 2.91Å; T448-I450 PolarHBondContact O-N 3.02Å; T448-G451 PolarHBondContact O-N 2.84Å; T448-Y452 WeakPolarHBondContact O-CB 3.48Å; T448-Y452 PolarHBondContact O-N 3.43Å
449	I	88.7	Confident	88.2	Confident	1 Å²	1	18 Å²	18	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-60.1	-46.6	171.2	-63.7	166.4	0	0	0	110.9	I92 D98 W445 M446 V447 G451 Y452 T453	I92-I449 HydrophobicContact CD1-CB 4.42Å; I92-I449 HydrophobicContact CD1-CG1 3.98Å; I92-I449 HydrophobicContact CD1-CG2 4.49Å; I92-I449 HydrophobicContact CG1-CG1 4.17Å; D98-I449 HydrophobicContact CB-CD1 3.88Å; W445-I449 HydrophobicContact CG-CD1 4.48Å; W445-I449 WeakPolarHBondContact O-CG1 3.28Å; W445-I449 PolarHBondContact O-N 3.37Å; W445-I449 VanDerWaalsContact O-N 3.14Å; M446-I449 HydrophobicContact CE-CD1 3.8Å; M446-I449 HydrophobicContact SD-CD1 4.46Å; V447-I449 VanDerWaalsContact C-N 3.34Å; I449-G451 PolarHBondContact O-N 2.89Å; I449-Y452 PolarHBondContact O-N 3.22Å; I449-T453 HydrophobicContact CG2-CG2 4.26Å; I449-T453 WeakPolarHBondContact O-CG2 3.46Å; I449-T453 PolarHBondContact O-N 2.93Å; I449-T453 PolarHBondContact O-OG1 2.97Å
450	I	87.7	Confident	87.9	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.1	-46.3	177.8	-66.5	161	0	0	0	110.3	H113 I114 T117 M446 V447 T448 Y452 T453 L454 M461	H113-I450 HydrophobicContact CB-CD1 4.13Å; H113-I450 HydrophobicContact CB-CG1 3.76Å; I114-I450 HydrophobicContact CB-CD1 4.49Å; I114-I450 HydrophobicContact CG1-CD1 3.83Å; I114-I450 HydrophobicContact CG1-CG1 4.23Å; T117-I450 WeakPolarHBondContact OG1-CD1 3.46Å; M446-I450 WeakPolarHBondContact O-CD1 3.36Å; M446-I450 VanDerWaalsContact O-CG1 3.23Å; M446-I450 WeakPolarHBondContact O-CG1 3.31Å; M446-I450 PolarHBondContact O-N 3.38Å; M446-I450 VanDerWaalsContact O-N 3.11Å; V447-I450 PolarHBondContact O-N 3.27Å; T448-I450 PolarHBondContact O-N 3.02Å; I450-Y452 PolarHBondContact O-N 2.64Å; I450-T453 WeakPolarHBondContact CA-OG1 3.36Å; I450-T453 PolarHBondContact O-N 3.32Å; I450-T453 PolarHBondContact O-OG1 3.07Å; I450-L454 HydrophobicContact CG2-CD1 3.7Å; I450-L454 HydrophobicContact CG2-CG 4.32Å; I450-L454 WeakPolarHBondContact O-CB 3.44Å; I450-L454 WeakPolarHBondContact O-CG 3.38Å; I450-L454 PolarHBondContact O-N 3.23Å; I450-M461 HydrophobicContact CB-CE 4.38Å; I450-M461 HydrophobicContact CG2-CE 4.02Å
451	G	87.1	Confident	87.7	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-55.5	-52.7	177.4	0	0	0	0	0	112.2	V447 T448 I449 T453 L454 G455 I456	V447-G451 PolarHBondContact O-N 3.49Å; T448-G451 PolarHBondContact O-N 2.84Å; I449-G451 PolarHBondContact O-N 2.89Å; G451-T453 PolarHBondContact O-N 3.13Å; G451-L454 PolarHBondContact O-N 3.21Å; G451-G455 PolarHBondContact O-N 3.22Å; G451-I456 CarbonylContact C-O 3.52Å; G451-I456 PolarHBondContact O-N 3.02Å
452	Y	86.2	Confident	87.6	Confident	7 Å²	7	14.8 Å²	14.8	3%	0.027	9%	0.085	C	C	.	.	H	α-helix	trans	-56.9	-47.8	177.1	-177.1	-110	0	0	0	112.1	P90 I92 N102 T448 I449 I450 L454 G455 M589 M591 E592	P90-Y452 HydrophobicContact CB-CD2 3.62Å; P90-Y452 HydrophobicContact CB-CE2 3.83Å; P90-Y452 HydrophobicContact CG-CD2 4.02Å; P90-Y452 HydrophobicContact CG-CE2 3.69Å; I92-Y452 HydrophobicContact CB-CG 4.49Å; I92-Y452 HydrophobicContact CD1-CD1 3.65Å; I92-Y452 HydrophobicContact CD1-CE1 4.36Å; I92-Y452 HydrophobicContact CD1-CG 4.06Å; I92-Y452 HydrophobicContact CG2-CD1 4.28Å; I92-Y452 HydrophobicContact CG2-CD2 4.18Å; I92-Y452 HydrophobicContact CG2-CE1 4.48Å; I92-Y452 HydrophobicContact CG2-CE2 4.44Å; I92-Y452 HydrophobicContact CG2-CG 4.12Å; N102-Y452 VanDerWaalsContact ND2-CE1 3.31Å; N102-Y452 WeakPolarHBondContact ND2-CE1 3.5Å; T448-Y452 WeakPolarHBondContact O-CB 3.48Å; T448-Y452 PolarHBondContact O-N 3.43Å; I449-Y452 PolarHBondContact O-N 3.22Å; I450-Y452 PolarHBondContact O-N 2.64Å; Y452-L454 VanDerWaalsContact C-N 3.29Å; Y452-L454 PolarHBondContact O-N 3.1Å; Y452-G455 PolarHBondContact O-N 3.44Å; Y452-M589 HydrophobicContact CD2-SD 3.72Å; Y452-M589 HydrophobicContact CE2-SD 4.4Å; Y452-M591 HydrophobicContact CD2-CE 3.63Å; Y452-M591 HydrophobicContact CE2-CE 3.54Å; Y452-M591 HydrophobicContact CG-CE 4.43Å; Y452-M591 WeakPolarHBondContact O-CE 3.2Å; Y452-E592 PolarHBondContact OH-N 3.47Å; Y452-E592 VanDerWaalsContact OH-N 3.09Å
453	T	85.1	Confident	87.4	Confident	16 Å²	16	12.7 Å²	12.7	10%	0.098	7%	0.074	C	C	.	.	H	α-helix	trans	-66.3	-28.9	-179	58.8	0	0	0	0	114.1	R105 V110 I449 I450 G451	R105-T453 HydrophobicContact CB-CG2 3.61Å; R105-T453 VanDerWaalsContact CD-CG2 3.4Å; R105-T453 HydrophobicContact CG-CG2 4.11Å; V110-T453 HydrophobicContact CG2-CG2 3.86Å; V110-T453 VanDerWaalsContact CG2-OG1 3.26Å; V110-T453 WeakPolarHBondContact CG2-OG1 3.38Å; I449-T453 HydrophobicContact CG2-CG2 4.26Å; I449-T453 WeakPolarHBondContact O-CG2 3.46Å; I449-T453 PolarHBondContact O-N 2.93Å; I449-T453 PolarHBondContact O-OG1 2.97Å; I450-T453 WeakPolarHBondContact CA-OG1 3.36Å; I450-T453 PolarHBondContact O-N 3.32Å; I450-T453 PolarHBondContact O-OG1 3.07Å; G451-T453 PolarHBondContact O-N 3.13Å
454	L	82.8	Confident	87.3	Confident	58 Å²	58	12.9 Å²	12.9	30%	0.304	8%	0.076	S	C	.	.	H	α-helix	trans	-91	-5.1	177.9	-64.4	179.2	0	0	0	112.9	I450 G451 Y452 I456	I450-L454 HydrophobicContact CG2-CD1 3.7Å; I450-L454 HydrophobicContact CG2-CG 4.32Å; I450-L454 WeakPolarHBondContact O-CB 3.44Å; I450-L454 WeakPolarHBondContact O-CG 3.38Å; I450-L454 PolarHBondContact O-N 3.23Å; G451-L454 PolarHBondContact O-N 3.21Å; Y452-L454 VanDerWaalsContact C-N 3.29Å; Y452-L454 PolarHBondContact O-N 3.1Å; L454-I456 VanDerWaalsContact C-N 3.25Å; L454-I456 HydrophobicContact CB-CD1 3.89Å; L454-I456 HydrophobicContact CB-CG1 3.88Å; L454-I456 HydrophobicContact CD1-CD1 4.03Å; L454-I456 PolarHBondContact O-N 3.37Å
455	G	79.7	Confident	87.2	Confident	35 Å²	35	13 Å²	13	36%	0.361	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	29.4	-173.6	0	0	0	0	0	113	G451 Y452	G451-G455 PolarHBondContact O-N 3.22Å; Y452-G455 PolarHBondContact O-N 3.44Å
456	I	83.9	Confident	87.1	Confident	5 Å²	5	11 Å²	11	3%	0.026	7%	0.069	C	C	.	.			trans	-98.5	124.9	177.6	-59	176	0	0	0	108	G451 L454 I460 M461	G451-I456 CarbonylContact C-O 3.52Å; G451-I456 PolarHBondContact O-N 3.02Å; L454-I456 VanDerWaalsContact C-N 3.25Å; L454-I456 HydrophobicContact CB-CD1 3.89Å; L454-I456 HydrophobicContact CB-CG1 3.88Å; L454-I456 HydrophobicContact CD1-CD1 4.03Å; L454-I456 PolarHBondContact O-N 3.37Å; I456-I460 HydrophobicContact CG2-CB 3.72Å; I456-I460 HydrophobicContact CG2-CD1 4.46Å; I456-I460 HydrophobicContact CG2-CG2 3.52Å; I456-M461 HydrophobicContact CB-CG 4.31Å; I456-M461 HydrophobicContact CB-SD 4.04Å; I456-M461 HydrophobicContact CD1-SD 4.2Å; I456-M461 HydrophobicContact CG2-CG 3.93Å; I456-M461 HydrophobicContact CG2-SD 3.75Å
457	P	83.4	Confident	87.1	Confident	33 Å²	33	10 Å²	10	21%	0.214	6%	0.064	C	C	.	.			trans	-52.8	141.4	175.3	-28	34.8	0	0	0	113.1	V459 I460 M461 E578	P457-V459 PolarHBondContact O-N 3.45Å; P457-I460 HydrophobicContact CB-CD1 4.31Å; P457-I460 HydrophobicContact CG-CD1 4.01Å; P457-I460 WeakPolarHBondContact O-CB 3.24Å; P457-I460 PolarHBondContact O-N 3.39Å; P457-M461 PolarHBondContact O-N 3.09Å; P457-M461 VanDerWaalsContact O-N 3.16Å; P457-E578 HydrophobicContact CB-CG 4.24Å; P457-E578 HydrophobicContact CG-CG 4.43Å
458	D	85.1	Confident	87	Confident	24 Å²	24	10 Å²	10	13%	0.128	6%	0.064	C	C	.	.	H	α-helix	trans	-55.9	-34.9	-178.8	-76.6	-31.1	0	0	0	112.6	A91 V178 M461 G462	A91-D458 VanDerWaalsContact CB-OD2 3.27Å; A91-D458 WeakPolarHBondContact CB-OD2 3.46Å; A91-D458 PolarHBondContact N-OD2 3.47Å; V178-D458 HydrophobicContact CG2-CB 3.55Å; D458-M461 PolarHBondContact O-N 3.2Å; D458-G462 PolarHBondContact O-N 3.35Å
459	V	86.1	Confident	86.9	Confident	10 Å²	10	9.9 Å²	9.9	6%	0.061	6%	0.064	C	C	.	.	H	α-helix	trans	-61.2	-46.5	173.3	-179.2	0	0	0	0	111.7	D177 P457 M461 G462 I463 E578	D177-V459 HydrophobicContact CB-CG2 3.57Å; P457-V459 PolarHBondContact O-N 3.45Å; V459-M461 VanDerWaalsContact C-N 3.31Å; V459-M461 PolarHBondContact O-N 2.64Å; V459-G462 PolarHBondContact O-N 3.02Å; V459-G462 VanDerWaalsContact O-N 3.16Å; V459-I463 HydrophobicContact CG1-CG2 4.3Å; V459-I463 WeakPolarHBondContact O-CG1 3.27Å; V459-I463 PolarHBondContact O-N 3.39Å; V459-E578 VanDerWaalsContact CB-OE1 3.32Å; V459-E578 WeakPolarHBondContact CB-OE1 3.39Å; V459-E578 WeakPolarHBondContact CG2-OE1 3.42Å
460	I	87.8	Confident	86.9	Confident	2 Å²	2	10.3 Å²	10.3	1%	0.01	7%	0.066	C	C	.	.	H	α-helix	trans	-61.5	-42.9	177.9	-73.4	161.7	0	0	0	110.3	I456 P457 G462 I463 T464 I575 E578 Y579	I456-I460 HydrophobicContact CG2-CB 3.72Å; I456-I460 HydrophobicContact CG2-CD1 4.46Å; I456-I460 HydrophobicContact CG2-CG2 3.52Å; P457-I460 HydrophobicContact CB-CD1 4.31Å; P457-I460 HydrophobicContact CG-CD1 4.01Å; P457-I460 WeakPolarHBondContact O-CB 3.24Å; P457-I460 PolarHBondContact O-N 3.39Å; I460-G462 VanDerWaalsContact C-N 3.29Å; I460-G462 PolarHBondContact O-N 3.47Å; I460-I463 WeakPolarHBondContact O-CG1 3.19Å; I460-I463 PolarHBondContact O-N 3.39Å; I460-T464 HydrophobicContact CG2-CG2 4.42Å; I460-T464 WeakPolarHBondContact O-CB 3.32Å; I460-T464 PolarHBondContact O-N 3.24Å; I460-T464 VanDerWaalsContact O-N 3.08Å; I460-T464 PolarHBondContact O-OG1 3.21Å; I460-I575 HydrophobicContact CG2-CG1 4.28Å; I460-E578 HydrophobicContact CD1-CB 3.65Å; I460-E578 HydrophobicContact CD1-CG 3.86Å; I460-E578 HydrophobicContact CG1-CB 3.81Å; I460-E578 HydrophobicContact CG1-CG 3.86Å; I460-Y579 HydrophobicContact CD1-CD2 3.89Å; I460-Y579 HydrophobicContact CD1-CE2 3.6Å
461	M	88.8	Confident	86.9	Confident	4 Å²	4	10.3 Å²	10.3	2%	0.02	7%	0.066	C	C	.	.	I	π-helix	trans	-62.3	-38.2	176.9	-65.4	-59.1	-65.1	0	0	111.6	V447 I450 I456 P457 D458 V459 F465 L466	V447-M461 HydrophobicContact CG1-CB 3.86Å; V447-M461 HydrophobicContact CG1-CE 3.76Å; I450-M461 HydrophobicContact CB-CE 4.38Å; I450-M461 HydrophobicContact CG2-CE 4.02Å; I456-M461 HydrophobicContact CB-CG 4.31Å; I456-M461 HydrophobicContact CB-SD 4.04Å; I456-M461 HydrophobicContact CD1-SD 4.2Å; I456-M461 HydrophobicContact CG2-CG 3.93Å; I456-M461 HydrophobicContact CG2-SD 3.75Å; P457-M461 PolarHBondContact O-N 3.09Å; P457-M461 VanDerWaalsContact O-N 3.16Å; D458-M461 PolarHBondContact O-N 3.2Å; V459-M461 VanDerWaalsContact C-N 3.31Å; V459-M461 PolarHBondContact O-N 2.64Å; M461-F465 HydrophobicContact CE-CB 4.17Å; M461-F465 HydrophobicContact CE-CD1 4.4Å; M461-F465 HydrophobicContact CE-CG 4.2Å; M461-F465 WeakPolarHBondContact O-CB 3.44Å; M461-F465 PolarHBondContact O-N 2.91Å; M461-L466 PolarHBondContact O-N 3.48Å
462	G	90.1	Very high	86.7	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	7%	0.067	C	C	.	.	I	π-helix	trans	-63.1	-58.6	172.3	0	0	0	0	0	113.2	D458 V459 I460 T464 A467	D458-G462 PolarHBondContact O-N 3.35Å; V459-G462 PolarHBondContact O-N 3.02Å; V459-G462 VanDerWaalsContact O-N 3.16Å; I460-G462 VanDerWaalsContact C-N 3.29Å; I460-G462 PolarHBondContact O-N 3.47Å; G462-T464 PolarHBondContact O-N 3.31Å; G462-A467 WeakPolarHBondContact O-CB 3.41Å; G462-A467 PolarHBondContact O-N 3.33Å; G462-A467 VanDerWaalsContact O-N 3.09Å
463	I	89.3	Confident	86.4	Confident	3 Å²	3	10.9 Å²	10.9	2%	0.015	7%	0.071	C	C	.	.	I	π-helix	trans	-65.8	-23.7	-173.9	63.9	169.7	0	0	0	113.9	G181 G185 V459 I460 A467	G181-I463 VanDerWaalsContact O-CA 3.3Å; G181-I463 WeakPolarHBondContact O-CA 3.47Å; G181-I463 VanDerWaalsContact O-CG2 3.28Å; G181-I463 WeakPolarHBondContact O-CG2 3.46Å; G185-I463 WeakPolarHBondContact CA-O 3.26Å; V459-I463 HydrophobicContact CG1-CG2 4.3Å; V459-I463 WeakPolarHBondContact O-CG1 3.27Å; V459-I463 PolarHBondContact O-N 3.39Å; I460-I463 WeakPolarHBondContact O-CG1 3.19Å; I460-I463 PolarHBondContact O-N 3.39Å; I463-A467 WeakPolarHBondContact O-CB 3.48Å
464	T	89.4	Confident	86.3	Confident	4 Å²	4	10.7 Å²	10.7	3%	0.025	7%	0.069	C	C	.	.	I	π-helix	trans	-109.1	-65.1	-175.5	63.1	0	0	0	0	111.9	I460 G462 A468 L571 I575	I460-T464 HydrophobicContact CG2-CG2 4.42Å; I460-T464 WeakPolarHBondContact O-CB 3.32Å; I460-T464 PolarHBondContact O-N 3.24Å; I460-T464 VanDerWaalsContact O-N 3.08Å; I460-T464 PolarHBondContact O-OG1 3.21Å; G462-T464 PolarHBondContact O-N 3.31Å; T464-A468 WeakPolarHBondContact O-CB 3.48Å; T464-A468 PolarHBondContact O-N 3.45Å; T464-L571 HydrophobicContact CG2-CD2 3.72Å; T464-I575 HydrophobicContact CG2-CD1 4.47Å
465	F	88.5	Confident	86.4	Confident	2 Å²	2	8.5 Å²	8.5	1%	0.009	6%	0.059	C	C	.	.	I	π-helix	trans	-80	-47.8	-165.8	-178.7	-86	0	0	0	111.5	I37 L41 T117 F121 V447 M461 G469	I37-F465 HydrophobicContact CG2-CD2 3.77Å; I37-F465 HydrophobicContact CG2-CE2 3.08Å; I37-F465 HydrophobicContact CG2-CZ 3.7Å; L41-F465 HydrophobicContact CD1-CD2 3.99Å; L41-F465 HydrophobicContact CD1-CE2 3.45Å; L41-F465 VanDerWaalsContact CD1-CE2 3.45Å; L41-F465 HydrophobicContact CD1-CZ 4.46Å; L41-F465 HydrophobicContact CD2-CD2 3.34Å; L41-F465 HydrophobicContact CD2-CE2 3.7Å; L41-F465 HydrophobicContact CD2-CG 4.24Å; L41-F465 HydrophobicContact CG-CD2 3.51Å; L41-F465 HydrophobicContact CG-CE2 3.53Å; T117-F465 HydrophobicContact CG2-CE1 3.32Å; T117-F465 HydrophobicContact CG2-CZ 3.57Å; F121-F465 HydrophobicContact CE2-CD1 4.29Å; F121-F465 AromaticContact CE2-CE1 3.46Å; F121-F465 HydrophobicContact CE2-CE1 3.46Å; F121-F465 VanDerWaalsContact CE2-CE1 3.46Å; F121-F465 AromaticContact CE2-CZ 3.83Å; F121-F465 HydrophobicContact CE2-CZ 3.83Å; F121-F465 HydrophobicContact CZ-CD1 4.29Å; F121-F465 AromaticContact CZ-CE1 3.85Å; F121-F465 HydrophobicContact CZ-CE1 3.85Å; V447-F465 HydrophobicContact CB-CD1 4.5Å; V447-F465 HydrophobicContact CG1-CD1 4.02Å; V447-F465 HydrophobicContact CG2-CD1 3.6Å; V447-F465 HydrophobicContact CG2-CE1 3.41Å; V447-F465 VanDerWaalsContact CG2-CE1 3.41Å; M461-F465 HydrophobicContact CE-CB 4.17Å; M461-F465 HydrophobicContact CE-CD1 4.4Å; M461-F465 HydrophobicContact CE-CG 4.2Å; M461-F465 WeakPolarHBondContact O-CB 3.44Å; M461-F465 PolarHBondContact O-N 2.91Å; F465-G469 PolarHBondContact O-N 3.45Å
466	L	90.5	Very high	86.5	Confident	1 Å²	1	8.2 Å²	8.2	1%	0.005	5%	0.048	C	C	.	.	I	π-helix	trans	-66.8	-50.4	179.1	-142	70.3	0	0	0	110.5	F121 A166 V178 T182 M443 V444 V447 M461 A468 G469 T470	F121-L466 HydrophobicContact CZ-CD1 4.38Å; A166-L466 HydrophobicContact CB-CD2 4.26Å; V178-L466 HydrophobicContact CG1-CD2 4.21Å; T182-L466 HydrophobicContact CG2-CB 4.04Å; T182-L466 HydrophobicContact CG2-CD2 3.94Å; T182-L466 HydrophobicContact CG2-CG 4.13Å; T182-L466 WeakPolarHBondContact OG1-CD2 3.47Å; M443-L466 HydrophobicContact CE-CD1 3.81Å; M443-L466 HydrophobicContact CE-CD2 4.16Å; M443-L466 HydrophobicContact CE-CG 3.87Å; M443-L466 HydrophobicContact CG-CD1 3.89Å; M443-L466 HydrophobicContact SD-CD1 4.04Å; V444-L466 HydrophobicContact CG2-CD2 3.96Å; V447-L466 HydrophobicContact CB-CD1 3.9Å; V447-L466 HydrophobicContact CG1-CD1 3.98Å; V447-L466 HydrophobicContact CG2-CD1 3.59Å; M461-L466 PolarHBondContact O-N 3.48Å; L466-A468 PolarHBondContact O-N 3.36Å; L466-G469 PolarHBondContact O-N 2.97Å; L466-T470 PolarHBondContact O-N 3.33Å; L466-T470 PolarHBondContact O-OG1 3.36Å
467	A	90.6	Very high	86.4	Confident	1 Å²	1	10.1 Å²	10.1	1%	0.008	7%	0.065	C	C	.	.	H	α-helix	trans	-52.3	-54	173.5	0	0	0	0	0	113.1	S186 G462 I463 G469 T470 S471	S186-A467 VanDerWaalsContact N-CB 3.28Å; G462-A467 WeakPolarHBondContact O-CB 3.41Å; G462-A467 PolarHBondContact O-N 3.33Å; G462-A467 VanDerWaalsContact O-N 3.09Å; I463-A467 WeakPolarHBondContact O-CB 3.48Å; A467-G469 VanDerWaalsContact C-N 3.31Å; A467-G469 PolarHBondContact O-N 2.94Å; A467-T470 PolarHBondContact O-N 2.71Å; A467-T470 PolarHBondContact O-OG1 2.83Å; A467-S471 WeakPolarHBondContact O-CB 3.28Å; A467-S471 PolarHBondContact O-N 3.49Å; A467-S471 VanDerWaalsContact O-N 3.15Å; A467-S471 PolarHBondContact O-OG 2.96Å
468	A	88.3	Confident	86.4	Confident	1 Å²	1	8.7 Å²	8.7	1%	0.008	6%	0.056	C	C	.	.	H	α-helix	trans	-60.8	-42.5	179.2	0	0	0	0	0	111.8	F36 F189 T464 L466 S471 V472	F36-A468 HydrophobicContact CD1-CB 4.42Å; F36-A468 HydrophobicContact CE1-CB 3.9Å; F189-A468 HydrophobicContact CD2-CB 4.15Å; F189-A468 HydrophobicContact CE2-CB 3.96Å; T464-A468 WeakPolarHBondContact O-CB 3.48Å; T464-A468 PolarHBondContact O-N 3.45Å; L466-A468 PolarHBondContact O-N 3.36Å; A468-S471 PolarHBondContact O-N 2.82Å; A468-V472 WeakPolarHBondContact O-CG2 3.34Å; A468-V472 PolarHBondContact O-N 3.24Å; A468-V472 VanDerWaalsContact O-N 3.11Å
469	G	86.1	Confident	86.4	Confident	1 Å²	1	8.6 Å²	8.6	1%	0.01	6%	0.055	C	C	.	.	H	α-helix	trans	-67.3	-38.8	-176	0	0	0	0	0	113.7	F121 F465 L466 A467	F121-G469 VanDerWaalsContact CD1-C 3.48Å; F465-G469 PolarHBondContact O-N 3.45Å; L466-G469 PolarHBondContact O-N 2.97Å; A467-G469 VanDerWaalsContact C-N 3.31Å; A467-G469 PolarHBondContact O-N 2.94Å
470	T	87.4	Confident	86	Confident	9 Å²	9	10.2 Å²	10.2	6%	0.055	6%	0.063	C	C	.	.	H	α-helix	trans	-72.1	-33.7	176.3	54.2	0	0	0	0	112.7	F121 P162 E163 M443 L466 A467 P473	F121-T470 HydrophobicContact CE1-CG2 4.18Å; P162-T470 HydrophobicContact CB-CG2 3.96Å; E163-T470 HydrophobicContact CG-CG2 4.38Å; E163-T470 WeakPolarHBondContact CG-OG1 3.25Å; E163-T470 PolarHBondContact OE1-OG1 2.93Å; M443-T470 HydrophobicContact CE-CG2 4.08Å; M443-T470 HydrophobicContact SD-CG2 4.15Å; L466-T470 PolarHBondContact O-N 3.33Å; L466-T470 PolarHBondContact O-OG1 3.36Å; A467-T470 PolarHBondContact O-N 2.71Å; A467-T470 PolarHBondContact O-OG1 2.83Å; T470-P473 WeakPolarHBondContact O-CD 3.28Å
471	S	88.3	Confident	85.6	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-94.4	-5.6	-174	-42.4	0	0	0	0	115.1	E163 S186 N190 A467 A468 D474 C475	E163-S471 PolarHBondContact OE1-OG 3.46Å; S186-S471 PolarHBondContact OG-OG 3.14Å; N190-S471 WeakPolarHBondContact OD1-CB 3.27Å; A467-S471 WeakPolarHBondContact O-CB 3.28Å; A467-S471 PolarHBondContact O-N 3.49Å; A467-S471 VanDerWaalsContact O-N 3.15Å; A467-S471 PolarHBondContact O-OG 2.96Å; A468-S471 PolarHBondContact O-N 2.82Å; S471-D474 PolarHBondContact O-N 2.92Å; S471-C475 PolarHBondContact O-N 3.17Å
472	V	83.4	Confident	85.3	Confident	5 Å²	5	11.6 Å²	11.6	3%	0.03	7%	0.072	C	C	.	.	H	α-helix	trans	-61.6	-42.4	175	175.3	0	0	0	0	113.7	Q33 F36 F189 A468 D474 C475 I476	Q33-V472 HydrophobicContact CB-CG1 4.37Å; Q33-V472 HydrophobicContact CG-CB 3.73Å; Q33-V472 HydrophobicContact CG-CG1 3.23Å; Q33-V472 HydrophobicContact CG-CG2 4.32Å; F36-V472 HydrophobicContact CD1-CG2 4.24Å; F189-V472 HydrophobicContact CZ-CG2 4.22Å; A468-V472 WeakPolarHBondContact O-CG2 3.34Å; A468-V472 PolarHBondContact O-N 3.24Å; A468-V472 VanDerWaalsContact O-N 3.11Å; V472-D474 PolarHBondContact O-N 2.92Å; V472-C475 WeakPolarHBondContact O-CB 3.3Å; V472-C475 PolarHBondContact O-N 2.67Å; V472-I476 HydrophobicContact CG1-CD1 3.92Å; V472-I476 HydrophobicContact CG1-CG1 4.43Å; V472-I476 WeakPolarHBondContact O-CG1 3.32Å; V472-I476 PolarHBondContact O-N 2.85Å
473	P	79.5	Confident	85	Confident	15 Å²	15	17.3 Å²	17.3	10%	0.097	9%	0.093	C	C	.	.	H	α-helix	trans	-53	-44.1	173.3	-26.2	36.3	0	0	0	112.1	M29 A125 T470 I476 A477	M29-P473 HydrophobicContact CE-CB 4.11Å; A125-P473 HydrophobicContact CB-CG 3.81Å; T470-P473 WeakPolarHBondContact O-CD 3.28Å; P473-I476 PolarHBondContact O-N 2.91Å; P473-A477 PolarHBondContact O-N 3Å
474	D	83.1	Confident	84.5	Confident	12 Å²	12	21.5 Å²	21.5	6%	0.064	11%	0.113	C	C	.	.	H	α-helix	trans	-66.9	-41	178.8	-62.7	-26.5	0	0	0	112.1	S159 I194 S471 V472 I476 A477 S478	S159-D474 WeakPolarHBondContact CB-OD1 3.4Å; I194-D474 HydrophobicContact CD1-CB 4.14Å; S471-D474 PolarHBondContact O-N 2.92Å; V472-D474 PolarHBondContact O-N 2.92Å; D474-I476 PolarHBondContact O-N 3.5Å; D474-A477 PolarHBondContact O-N 3.22Å; D474-S478 WeakPolarHBondContact O-CB 3.4Å; D474-S478 PolarHBondContact O-N 3.31Å; D474-S478 PolarHBondContact O-OG 3.42Å
475	C	85.6	Confident	83.9	Confident	12 Å²	12	23.2 Å²	23.2	8%	0.081	13%	0.131	C	C	.	.	H	α-helix	trans	-54.8	-43.9	173.2	-175.6	0	0	0	0	111.8	F189 I194 S471 V472 L479	F189-C475 HydrophobicContact CE1-CB 4.1Å; I194-C475 HydrophobicContact CD1-CB 4.1Å; I194-C475 HydrophobicContact CG1-CB 3.74Å; S471-C475 PolarHBondContact O-N 3.17Å; V472-C475 WeakPolarHBondContact O-CB 3.3Å; V472-C475 PolarHBondContact O-N 2.67Å; C475-L479 VanDerWaalsContact O-CB 3.24Å; C475-L479 WeakPolarHBondContact O-CB 3.34Å; C475-L479 PolarHBondContact O-N 3.31Å
476	I	81.8	Confident	83.4	Confident	28 Å²	28	26.6 Å²	26.6	14%	0.144	15%	0.149	C	C	.	.	H	α-helix	trans	-70.4	-42.6	179.7	-67.3	170.1	0	0	0	110.7	M29 V472 P473 D474 L479 I480	M29-I476 HydrophobicContact CB-CD1 4.3Å; M29-I476 HydrophobicContact CG-CD1 3.97Å; M29-I476 HydrophobicContact SD-CB 3.87Å; M29-I476 HydrophobicContact SD-CD1 3.33Å; M29-I476 WeakPolarHBondContact SD-CD1 3.43Å; M29-I476 HydrophobicContact SD-CG1 4.17Å; M29-I476 HydrophobicContact SD-CG2 3.77Å; V472-I476 HydrophobicContact CG1-CD1 3.92Å; V472-I476 HydrophobicContact CG1-CG1 4.43Å; V472-I476 WeakPolarHBondContact O-CG1 3.32Å; V472-I476 PolarHBondContact O-N 2.85Å; P473-I476 PolarHBondContact O-N 2.91Å; D474-I476 PolarHBondContact O-N 3.5Å; I476-L479 PolarHBondContact O-N 3.31Å; I476-I480 HydrophobicContact CG2-CD1 3.89Å; I476-I480 WeakPolarHBondContact O-CD1 3.49Å; I476-I480 VanDerWaalsContact O-CG1 3.22Å; I476-I480 WeakPolarHBondContact O-CG1 3.27Å; I476-I480 PolarHBondContact O-N 2.92Å
477	A	80.4	Confident	82.8	Confident	46 Å²	46	26.7 Å²	26.7	38%	0.38	15%	0.15	S	C	.	.	H	α-helix	trans	-60	-50.3	176.2	0	0	0	0	0	111.6	P473 D474 L479 I480 V481	P473-A477 PolarHBondContact O-N 3Å; D474-A477 PolarHBondContact O-N 3.22Å; A477-L479 PolarHBondContact O-N 3.44Å; A477-I480 PolarHBondContact O-N 3.16Å; A477-V481 WeakPolarHBondContact O-CG2 3.41Å; A477-V481 PolarHBondContact O-N 2.88Å; A477-V481 VanDerWaalsContact O-N 3.08Å
478	S	84.6	Confident	82.2	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-40.3	177.3	-71.1	0	0	0	0	112.3	I194 D474 I480 V481 A482 T494	I194-S478 VanDerWaalsContact CG2-CB 3.46Å; D474-S478 WeakPolarHBondContact O-CB 3.4Å; D474-S478 PolarHBondContact O-N 3.31Å; D474-S478 PolarHBondContact O-OG 3.42Å; S478-I480 VanDerWaalsContact C-N 3.34Å; S478-I480 PolarHBondContact O-N 3.16Å; S478-V481 PolarHBondContact O-N 3.32Å; S478-A482 WeakPolarHBondContact O-CB 3.41Å; S478-A482 PolarHBondContact O-N 3.45Å; S478-T494 PolarHBondContact OG-OG1 2.66Å
479	L	84.4	Confident	81.7	Confident	22 Å²	22	34.9 Å²	34.9	12%	0.115	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-40.6	174.8	175.5	62.6	0	0	0	112.2	V197 F201 C475 I476 A477 V481 A482 R483	V197-L479 HydrophobicContact CG1-CD1 4.45Å; V197-L479 HydrophobicContact CG1-CD2 4.04Å; F201-L479 HydrophobicContact CB-CD1 3.71Å; F201-L479 HydrophobicContact CB-CD2 4.06Å; C475-L479 VanDerWaalsContact O-CB 3.24Å; C475-L479 WeakPolarHBondContact O-CB 3.34Å; C475-L479 PolarHBondContact O-N 3.31Å; I476-L479 PolarHBondContact O-N 3.31Å; A477-L479 PolarHBondContact O-N 3.44Å; L479-V481 VanDerWaalsContact C-N 3.34Å; L479-A482 PolarHBondContact O-N 3.28Å; L479-R483 HydrophobicContact CD1-CG 4.49Å; L479-R483 WeakPolarHBondContact O-CG 3.31Å; L479-R483 PolarHBondContact O-N 3.08Å
480	I	78.8	Confident	81.3	Confident	44 Å²	44	35.1 Å²	35.1	23%	0.226	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-42.7	178	-70.1	163	0	0	0	110.4	I476 A477 S478 R483 Q484	I476-I480 HydrophobicContact CG2-CD1 3.89Å; I476-I480 WeakPolarHBondContact O-CD1 3.49Å; I476-I480 VanDerWaalsContact O-CG1 3.22Å; I476-I480 WeakPolarHBondContact O-CG1 3.27Å; I476-I480 PolarHBondContact O-N 2.92Å; A477-I480 PolarHBondContact O-N 3.16Å; S478-I480 VanDerWaalsContact C-N 3.34Å; S478-I480 PolarHBondContact O-N 3.16Å; I480-R483 WeakPolarHBondContact O-CB 3.39Å; I480-R483 PolarHBondContact O-N 3.49Å; I480-Q484 WeakPolarHBondContact O-CG 3.41Å; I480-Q484 PolarHBondContact O-N 3.22Å
481	V	78.5	Confident	81	Confident	33 Å²	33	35.2 Å²	35.2	20%	0.2	19%	0.194	C	C	.	.	H	α-helix	trans	-66.9	-41.4	177.7	175.8	0	0	0	0	110.9	A477 S478 L479 R483 Q484 L486 M489 A490	A477-V481 WeakPolarHBondContact O-CG2 3.41Å; A477-V481 PolarHBondContact O-N 2.88Å; A477-V481 VanDerWaalsContact O-N 3.08Å; S478-V481 PolarHBondContact O-N 3.32Å; L479-V481 VanDerWaalsContact C-N 3.34Å; V481-R483 VanDerWaalsContact C-N 3.32Å; V481-R483 PolarHBondContact O-N 3.4Å; V481-Q484 WeakPolarHBondContact O-CB 3.47Å; V481-Q484 PolarHBondContact O-N 2.95Å; V481-L486 HydrophobicContact CG1-CB 3.72Å; V481-L486 WeakPolarHBondContact CG1-O 3.23Å; V481-L486 PolarHBondContact O-N 3.2Å; V481-M489 HydrophobicContact CG1-CB 4.06Å; V481-M489 HydrophobicContact CG1-CG 4.26Å; V481-M489 HydrophobicContact CG1-SD 4.18Å; V481-A490 HydrophobicContact CB-CB 4.28Å; V481-A490 HydrophobicContact CG1-CB 4.14Å
482	A	82.3	Confident	80.4	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-38.2	174.9	0	0	0	0	0	112.5	C198 A202 Q204 S478 L479 Q484 G485 A490	C198-A482 HydrophobicContact CB-CB 4.07Å; A202-A482 HydrophobicContact CB-CB 4.27Å; Q204-A482 PolarHBondContact NE2-O 3.45Å; S478-A482 WeakPolarHBondContact O-CB 3.41Å; S478-A482 PolarHBondContact O-N 3.45Å; L479-A482 PolarHBondContact O-N 3.28Å; A482-Q484 PolarHBondContact O-N 2.84Å; A482-G485 PolarHBondContact O-N 3.02Å; A482-A490 HydrophobicContact CB-CB 4.32Å
483	R	83.8	Confident	80.1	Confident	121 Å²	121	38.8 Å²	38.8	46%	0.457	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.7	172.8	-78.3	-175.5	172.4	-162.9	-0.2	114.1	F201 A202 Q204 L479 I480 V481	F201-R483 VanDerWaalsContact O-CZ 3.29Å; F201-R483 PolarHBondContact O-NE 2.93Å; F201-R483 PolarHBondContact O-NH2 3.2Å; A202-R483 WeakPolarHBondContact O-CG 3.11Å; Q204-R483 PolarHBondContact NE2-O 2.73Å; L479-R483 HydrophobicContact CD1-CG 4.49Å; L479-R483 WeakPolarHBondContact O-CG 3.31Å; L479-R483 PolarHBondContact O-N 3.08Å; I480-R483 WeakPolarHBondContact O-CB 3.39Å; I480-R483 PolarHBondContact O-N 3.49Å; V481-R483 VanDerWaalsContact C-N 3.32Å; V481-R483 PolarHBondContact O-N 3.4Å
484	Q	80.2	Confident	80.2	Confident	90 Å²	90	38.3 Å²	38.3	42%	0.421	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-2.9	175.4	-62.9	171.2	19.3	0	0	112.8	I480 V481 A482 L486	I480-Q484 WeakPolarHBondContact O-CG 3.41Å; I480-Q484 PolarHBondContact O-N 3.22Å; V481-Q484 WeakPolarHBondContact O-CB 3.47Å; V481-Q484 PolarHBondContact O-N 2.95Å; A482-Q484 PolarHBondContact O-N 2.84Å; Q484-L486 VanDerWaalsContact C-N 3.31Å; Q484-L486 HydrophobicContact CB-CD1 4.39Å; Q484-L486 HydrophobicContact CB-CG 4.42Å
485	G	76.5	Confident	80.3	Confident	40 Å²	40	38 Å²	38	41%	0.412	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	6	-178.9	0	0	0	0	0	112.9	Q204 A482 G487	Q204-G485 VanDerWaalsContact NE2-CA 3.28Å; A482-G485 PolarHBondContact O-N 3.02Å; G485-G487 VanDerWaalsContact C-N 3.27Å; G485-G487 PolarHBondContact O-N 2.93Å
486	L	76.8	Confident	80.2	Confident	74 Å²	74	37.5 Å²	37.5	39%	0.387	21%	0.207	S	C	.	.			trans	-91.8	55.7	-179.5	-61.6	173.5	0	0	0	110.6	V481 Q484 D488 M489 A490	V481-L486 HydrophobicContact CG1-CB 3.72Å; V481-L486 WeakPolarHBondContact CG1-O 3.23Å; V481-L486 PolarHBondContact O-N 3.2Å; Q484-L486 VanDerWaalsContact C-N 3.31Å; Q484-L486 HydrophobicContact CB-CD1 4.39Å; Q484-L486 HydrophobicContact CB-CG 4.42Å; L486-D488 PolarHBondContact O-N 3.49Å; L486-M489 HydrophobicContact CB-CB 4.34Å; L486-M489 WeakPolarHBondContact O-CB 3.48Å; L486-M489 PolarHBondContact O-N 2.92Å; L486-A490 PolarHBondContact O-N 2.86Å
487	G	79.3	Confident	80.4	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-58	-46.2	-175.5	0	0	0	0	0	115.5	G485 M489 A490 V491	G485-G487 VanDerWaalsContact C-N 3.27Å; G485-G487 PolarHBondContact O-N 2.93Å; G487-M489 PolarHBondContact O-N 3.5Å; G487-A490 PolarHBondContact O-N 2.94Å; G487-A490 VanDerWaalsContact O-N 3.09Å; G487-V491 PolarHBondContact O-N 3.09Å
488	D	78.2	Confident	80.9	Confident	51 Å²	51	34.1 Å²	34.1	27%	0.273	18%	0.183	S	C	.	.	H	α-helix	trans	-56.7	-38.8	179.1	-76.2	-13.9	0	0	0	111.3	L208 T209 L486 S492	L208-D488 WeakPolarHBondContact CA-OD1 3.44Å; L208-D488 WeakPolarHBondContact CD2-OD1 3.43Å; T209-D488 WeakPolarHBondContact CB-OD2 3.42Å; T209-D488 WeakPolarHBondContact CG2-OD2 3.33Å; T209-D488 PolarHBondContact N-OD1 3.48Å; T209-D488 PolarHBondContact N-OD2 3.26Å; T209-D488 VanDerWaalsContact OG1-CG 3.28Å; T209-D488 PolarHBondContact OG1-OD1 3.16Å; T209-D488 PolarHBondContact OG1-OD2 3Å; L486-D488 PolarHBondContact O-N 3.49Å; D488-S492 WeakPolarHBondContact O-CB 3.07Å; D488-S492 PolarHBondContact O-N 3.49Å
489	M	76.8	Confident	81.2	Confident	122 Å²	122	34 Å²	34	60%	0.601	18%	0.182	S	C	*	.	H	α-helix	trans	-68.9	-43.3	177.1	-170.7	-178.1	-172.9	0	0	111.5	V481 L486 G487 N493	V481-M489 HydrophobicContact CG1-CB 4.06Å; V481-M489 HydrophobicContact CG1-CG 4.26Å; V481-M489 HydrophobicContact CG1-SD 4.18Å; L486-M489 HydrophobicContact CB-CB 4.34Å; L486-M489 WeakPolarHBondContact O-CB 3.48Å; L486-M489 PolarHBondContact O-N 2.92Å; G487-M489 PolarHBondContact O-N 3.5Å; M489-N493 VanDerWaalsContact O-CB 3.25Å; M489-N493 WeakPolarHBondContact O-CB 3.36Å; M489-N493 PolarHBondContact O-N 3.34Å
490	A	78.2	Confident	81.5	Confident	6 Å²	6	33.7 Å²	33.7	5%	0.05	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-43.6	178.7	0	0	0	0	0	112	V481 A482 L486 G487 T494	V481-A490 HydrophobicContact CB-CB 4.28Å; V481-A490 HydrophobicContact CG1-CB 4.14Å; A482-A490 HydrophobicContact CB-CB 4.32Å; L486-A490 PolarHBondContact O-N 2.86Å; G487-A490 PolarHBondContact O-N 2.94Å; G487-A490 VanDerWaalsContact O-N 3.09Å; A490-T494 PolarHBondContact O-N 3.33Å; A490-T494 PolarHBondContact O-OG1 3.41Å
491	V	80.5	Confident	82.2	Confident	12 Å²	12	31.6 Å²	31.6	7%	0.073	17%	0.169	C	C	.	.	H	α-helix	trans	-72.7	-42.9	179.1	174.9	0	0	0	0	111.4	I195 L208 V213 G487 N493 T494 I495	I195-V491 HydrophobicContact CD1-CG1 4.49Å; L208-V491 HydrophobicContact CD1-CG2 4.27Å; L208-V491 HydrophobicContact CD2-CB 4.08Å; L208-V491 HydrophobicContact CD2-CG2 3.63Å; V213-V491 HydrophobicContact CG2-CG1 4.46Å; G487-V491 PolarHBondContact O-N 3.09Å; V491-N493 PolarHBondContact O-N 2.81Å; V491-T494 PolarHBondContact O-N 3.02Å; V491-I495 HydrophobicContact CG1-CD1 3.69Å; V491-I495 HydrophobicContact CG1-CG1 4.33Å; V491-I495 WeakPolarHBondContact O-CG1 3.37Å; V491-I495 PolarHBondContact O-N 3.42Å
492	S	75.9	Confident	82.9	Confident	31 Å²	31	30 Å²	30	22%	0.217	16%	0.16	C	C	.	.	H	α-helix	trans	-65.7	-37.9	179.3	-169.4	0	0	0	0	112.1	D216 D488 T494 I495 G496	D216-S492 WeakPolarHBondContact OD2-CB 3.44Å; D216-S492 PolarHBondContact OD2-OG 3.49Å; D488-S492 WeakPolarHBondContact O-CB 3.07Å; D488-S492 PolarHBondContact O-N 3.49Å; S492-T494 VanDerWaalsContact C-N 3.32Å; S492-T494 PolarHBondContact O-N 3.27Å; S492-I495 PolarHBondContact O-N 2.8Å; S492-G496 PolarHBondContact O-N 3.4Å
493	N	78	Confident	83.4	Confident	49 Å²	49	30.1 Å²	30.1	26%	0.262	16%	0.16	S	C	.	.	H	α-helix	trans	-58.8	-46.1	173	-174.1	56.5	0	0	0	111.5	M489 V491 G496 S497	M489-N493 VanDerWaalsContact O-CB 3.25Å; M489-N493 WeakPolarHBondContact O-CB 3.36Å; M489-N493 PolarHBondContact O-N 3.34Å; V491-N493 PolarHBondContact O-N 2.81Å; N493-G496 PolarHBondContact O-N 2.96Å; N493-S497 PolarHBondContact O-N 3.2Å; N493-S497 PolarHBondContact O-OG 3.3Å
494	T	81.4	Confident	83.9	Confident	4 Å²	4	25.2 Å²	25.2	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-69.6	-34.5	-177.2	-53.3	0	0	0	0	112.7	N190 I194 S478 A490 V491 S492 S497 N498	N190-T494 VanDerWaalsContact C-CG2 3.41Å; N190-T494 HydrophobicContact CB-CG2 3.52Å; N190-T494 WeakPolarHBondContact O-CG2 3.49Å; I194-T494 HydrophobicContact CB-CG2 4.16Å; I194-T494 HydrophobicContact CD1-CG2 4.06Å; I194-T494 HydrophobicContact CG2-CG2 4.27Å; S478-T494 PolarHBondContact OG-OG1 2.66Å; A490-T494 PolarHBondContact O-N 3.33Å; A490-T494 PolarHBondContact O-OG1 3.41Å; V491-T494 PolarHBondContact O-N 3.02Å; S492-T494 VanDerWaalsContact C-N 3.32Å; S492-T494 PolarHBondContact O-N 3.27Å; T494-S497 PolarHBondContact O-OG 2.95Å; T494-N498 PolarHBondContact O-ND2 2.98Å; T494-N498 PolarHBondContact O-OD1 3.31Å
495	I	84.3	Confident	84.4	Confident	5 Å²	5	21 Å²	21	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-78	-38.1	175.1	-60.6	170	0	0	0	110.6	I191 D216 Y220 V491 S492 N498 V499	I191-I495 HydrophobicContact CD1-CG1 3.85Å; D216-I495 HydrophobicContact CB-CB 4.12Å; D216-I495 HydrophobicContact CB-CD1 4.16Å; D216-I495 HydrophobicContact CB-CG2 3.68Å; Y220-I495 HydrophobicContact CG-CG2 4.38Å; V491-I495 HydrophobicContact CG1-CD1 3.69Å; V491-I495 HydrophobicContact CG1-CG1 4.33Å; V491-I495 WeakPolarHBondContact O-CG1 3.37Å; V491-I495 PolarHBondContact O-N 3.42Å; S492-I495 PolarHBondContact O-N 2.8Å; I495-N498 PolarHBondContact O-N 2.91Å; I495-V499 WeakPolarHBondContact O-CG2 3.34Å; I495-V499 PolarHBondContact O-N 2.98Å; I495-V499 VanDerWaalsContact O-N 3.11Å
496	G	82.7	Confident	85.2	Confident	2 Å²	2	19 Å²	19	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-64.4	-41.8	179	0	0	0	0	0	113.1	S492 N493 V499 F500	S492-G496 PolarHBondContact O-N 3.4Å; N493-G496 PolarHBondContact O-N 2.96Å; G496-V499 PolarHBondContact O-N 3.4Å; G496-F500 PolarHBondContact O-N 2.78Å; G496-F500 VanDerWaalsContact O-N 3.08Å
497	S	86.8	Confident	86	Confident	3 Å²	3	15.5 Å²	15.5	2%	0.021	9%	0.086	C	C	.	.	H	α-helix	trans	-58.6	-46.3	172.4	59.6	0	0	0	0	110.9	S160 N493 T494 V499 F500 D501	S160-S497 WeakPolarHBondContact OG-CB 3.46Å; N493-S497 PolarHBondContact O-N 3.2Å; N493-S497 PolarHBondContact O-OG 3.3Å; T494-S497 PolarHBondContact O-OG 2.95Å; S497-V499 VanDerWaalsContact C-N 3.32Å; S497-V499 PolarHBondContact O-N 3.08Å; S497-F500 CarbonylContact O-C 3.3Å; S497-F500 WeakPolarHBondContact O-CA 3.43Å; S497-F500 VanDerWaalsContact O-CB 3.27Å; S497-F500 WeakPolarHBondContact O-CB 3.25Å; S497-F500 PolarHBondContact O-N 3.39Å; S497-D501 VanDerWaalsContact C-OD2 3.32Å; S497-D501 PolarHBondContact O-N 2.98Å; S497-D501 VanDerWaalsContact O-OD2 3.04Å
498	N	90.6	Very high	86.7	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62	-36.1	178.8	-66.7	-5	0	0	0	114	A187 N190 I191 Y220 T494 I495 F500 D501 I502	A187-N498 HydrophobicContact CB-CB 4.41Å; A187-N498 PolarHBondContact O-ND2 3.25Å; A187-N498 VanDerWaalsContact O-ND2 3.09Å; N190-N498 WeakPolarHBondContact CB-OD1 3.14Å; N190-N498 PolarHBondContact ND2-OD1 2.95Å; I191-N498 WeakPolarHBondContact CG1-ND2 3.39Å; Y220-N498 HydrophobicContact CD2-CB 4.12Å; Y220-N498 HydrophobicContact CE2-CB 3.57Å; T494-N498 PolarHBondContact O-ND2 2.98Å; T494-N498 PolarHBondContact O-OD1 3.31Å; I495-N498 PolarHBondContact O-N 2.91Å; N498-F500 VanDerWaalsContact C-N 3.33Å; N498-D501 WeakPolarHBondContact CA-OD2 3.25Å; N498-D501 PolarHBondContact O-N 2.95Å; N498-I502 WeakPolarHBondContact O-CG1 3.23Å; N498-I502 PolarHBondContact O-N 3.06Å; N498-I502 VanDerWaalsContact O-N 3.09Å
499	V	90.8	Very high	87.3	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.006	9%	0.085	C	C	.	.	H	α-helix	trans	-65.7	-40.2	173.6	173.8	0	0	0	0	110.3	Y220 Y248 Y251 I495 G496 S497 L503	Y220-V499 HydrophobicContact CD2-CG2 3.9Å; Y220-V499 HydrophobicContact CG-CG2 4.34Å; Y248-V499 HydrophobicContact CD2-CG1 4.43Å; Y251-V499 HydrophobicContact CD1-CG1 3.93Å; Y251-V499 HydrophobicContact CD2-CG1 4.19Å; Y251-V499 HydrophobicContact CE1-CB 4.44Å; Y251-V499 HydrophobicContact CE1-CG1 3.98Å; Y251-V499 HydrophobicContact CE2-CG1 4.23Å; Y251-V499 HydrophobicContact CG-CG1 4Å; I495-V499 WeakPolarHBondContact O-CG2 3.34Å; I495-V499 PolarHBondContact O-N 2.98Å; I495-V499 VanDerWaalsContact O-N 3.11Å; G496-V499 PolarHBondContact O-N 3.4Å; S497-V499 VanDerWaalsContact C-N 3.32Å; S497-V499 PolarHBondContact O-N 3.08Å; V499-L503 HydrophobicContact CG1-CD1 3.71Å; V499-L503 HydrophobicContact CG1-CG 4.34Å; V499-L503 VanDerWaalsContact O-CB 3.32Å; V499-L503 WeakPolarHBondContact O-CB 3.34Å; V499-L503 VanDerWaalsContact O-CG 3.26Å; V499-L503 WeakPolarHBondContact O-CG 3.38Å; V499-L503 PolarHBondContact O-N 3Å
500	F	91.4	Very high	88.1	Confident	15 Å²	15	9.5 Å²	9.5	7%	0.066	6%	0.057	C	C	.	.	H	α-helix	trans	-63.1	-45	172.7	175.5	-87.7	0	0	0	111.5	A157 S160 L164 Y248 G496 S497 N498 I502 L503 V504 G505	A157-F500 HydrophobicContact CB-CD2 3.93Å; A157-F500 HydrophobicContact CB-CE1 4.22Å; A157-F500 HydrophobicContact CB-CE2 3.42Å; A157-F500 VanDerWaalsContact CB-CE2 3.42Å; A157-F500 HydrophobicContact CB-CZ 3.58Å; S160-F500 VanDerWaalsContact CB-CD1 3.44Å; L164-F500 HydrophobicContact CD2-CZ 4.36Å; Y248-F500 HydrophobicContact CE1-CD2 4.17Å; Y248-F500 HydrophobicContact CE2-CB 4.14Å; Y248-F500 HydrophobicContact CE2-CD2 4.12Å; Y248-F500 AromaticContact CZ-CD2 3.67Å; Y248-F500 WeakPolarHBondContact OH-CD2 3.49Å; G496-F500 PolarHBondContact O-N 2.78Å; G496-F500 VanDerWaalsContact O-N 3.08Å; S497-F500 CarbonylContact O-C 3.3Å; S497-F500 WeakPolarHBondContact O-CA 3.43Å; S497-F500 VanDerWaalsContact O-CB 3.27Å; S497-F500 WeakPolarHBondContact O-CB 3.25Å; S497-F500 PolarHBondContact O-N 3.39Å; N498-F500 VanDerWaalsContact C-N 3.33Å; F500-I502 PolarHBondContact O-N 3.5Å; F500-L503 PolarHBondContact O-N 2.88Å; F500-V504 HydrophobicContact CD2-CB 3.85Å; F500-V504 HydrophobicContact CD2-CG1 4.26Å; F500-V504 HydrophobicContact CD2-CG2 3.76Å; F500-V504 HydrophobicContact CE1-CB 4.43Å; F500-V504 HydrophobicContact CE1-CG1 4.42Å; F500-V504 HydrophobicContact CE2-CB 3.75Å; F500-V504 HydrophobicContact CE2-CG1 3.63Å; F500-V504 HydrophobicContact CE2-CG2 3.9Å; F500-V504 HydrophobicContact CG-CB 4.26Å; F500-V504 HydrophobicContact CG-CG2 4.46Å; F500-V504 HydrophobicContact CZ-CB 4.05Å; F500-V504 HydrophobicContact CZ-CG1 3.72Å; F500-V504 WeakPolarHBondContact O-CA 3.37Å; F500-V504 VanDerWaalsContact O-CB 3.27Å; F500-V504 WeakPolarHBondContact O-CB 3.41Å; F500-V504 PolarHBondContact O-N 3.23Å; F500-G505 PolarHBondContact O-N 2.86Å
501	D	92.7	Very high	88.7	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.06	C	C	.	.	I	π-helix	trans	-62.2	-43.1	-177	-58	-28.8	0	0	0	111.8	S160 I183 S497 N498 G505 L506	S160-D501 WeakPolarHBondContact CB-OD1 3.37Å; S160-D501 PolarHBondContact OG-OD1 3.11Å; I183-D501 HydrophobicContact CD1-CB 4.17Å; I183-D501 HydrophobicContact CG2-CB 3.93Å; I183-D501 WeakPolarHBondContact CG2-O 3.17Å; S497-D501 VanDerWaalsContact C-OD2 3.32Å; S497-D501 PolarHBondContact O-N 2.98Å; S497-D501 VanDerWaalsContact O-OD2 3.04Å; N498-D501 WeakPolarHBondContact CA-OD2 3.25Å; N498-D501 PolarHBondContact O-N 2.95Å; D501-G505 CarbonylContact O-C 3.56Å; D501-G505 VanDerWaalsContact O-C 3.3Å; D501-G505 WeakPolarHBondContact O-CA 3.2Å; D501-G505 PolarHBondContact O-N 2.73Å; D501-L506 PolarHBondContact O-N 3.06Å; D501-L506 VanDerWaalsContact O-N 3.13Å
502	I	93.2	Very high	89.2	Confident	1 Å²	1	12.8 Å²	12.8	1%	0.005	8%	0.075	C	C	.	.	I	π-helix	trans	-71.7	-49	177.8	-65.8	-179.2	0	0	0	111	I183 Y220 V224 L227 N498 F500 L506	I183-I502 HydrophobicContact CG2-CG1 4.33Å; Y220-I502 HydrophobicContact CD2-CD1 4.38Å; Y220-I502 HydrophobicContact CE2-CD1 3.56Å; V224-I502 HydrophobicContact CG2-CD1 3.64Å; L227-I502 HydrophobicContact CB-CG2 4.19Å; L227-I502 HydrophobicContact CD2-CG2 4.05Å; L227-I502 HydrophobicContact CG-CG2 4.49Å; N498-I502 WeakPolarHBondContact O-CG1 3.23Å; N498-I502 PolarHBondContact O-N 3.06Å; N498-I502 VanDerWaalsContact O-N 3.09Å; F500-I502 PolarHBondContact O-N 3.5Å; I502-L506 WeakPolarHBondContact O-CB 3.43Å
503	L	93.9	Very high	89.8	Confident	3 Å²	3	12 Å²	12	2%	0.016	7%	0.068	C	C	.	.	I	π-helix	trans	-83.2	-37.7	-169.2	-58.6	-176	0	0	0	113.9	L244 M247 Y248 V499 F500 G507	L244-L503 HydrophobicContact CB-CD2 4.34Å; L244-L503 HydrophobicContact CD2-CD2 3.77Å; M247-L503 HydrophobicContact CB-CD1 4.36Å; M247-L503 HydrophobicContact CE-CD1 4.15Å; M247-L503 HydrophobicContact CE-CD2 3.18Å; M247-L503 HydrophobicContact CE-CG 4.3Å; M247-L503 HydrophobicContact CG-CD1 4.26Å; Y248-L503 HydrophobicContact CD2-CB 4.25Å; Y248-L503 HydrophobicContact CD2-CD1 4.28Å; Y248-L503 HydrophobicContact CG-CB 4.34Å; V499-L503 HydrophobicContact CG1-CD1 3.71Å; V499-L503 HydrophobicContact CG1-CG 4.34Å; V499-L503 VanDerWaalsContact O-CB 3.32Å; V499-L503 WeakPolarHBondContact O-CB 3.34Å; V499-L503 VanDerWaalsContact O-CG 3.26Å; V499-L503 WeakPolarHBondContact O-CG 3.38Å; V499-L503 PolarHBondContact O-N 3Å; F500-L503 PolarHBondContact O-N 2.88Å; L503-G507 WeakPolarHBondContact O-CA 3.37Å; L503-G507 PolarHBondContact O-N 3.06Å
504	V	93.4	Very high	90.3	Very high	18 Å²	18	9.7 Å²	9.7	11%	0.109	6%	0.055	C	C	.	.	I	π-helix	trans	-98.8	-46.5	177.9	-177	0	0	0	0	109.9	Y248 F500 L506 V508 P509	Y248-V504 HydrophobicContact CD1-CG2 3.25Å; Y248-V504 HydrophobicContact CD2-CG2 3.96Å; Y248-V504 HydrophobicContact CE1-CG2 3.55Å; Y248-V504 HydrophobicContact CE2-CG2 4.25Å; Y248-V504 HydrophobicContact CG-CG2 3.49Å; Y248-V504 VanDerWaalsContact CG-CG2 3.49Å; F500-V504 HydrophobicContact CD2-CB 3.85Å; F500-V504 HydrophobicContact CD2-CG1 4.26Å; F500-V504 HydrophobicContact CD2-CG2 3.76Å; F500-V504 HydrophobicContact CE1-CB 4.43Å; F500-V504 HydrophobicContact CE1-CG1 4.42Å; F500-V504 HydrophobicContact CE2-CB 3.75Å; F500-V504 HydrophobicContact CE2-CG1 3.63Å; F500-V504 HydrophobicContact CE2-CG2 3.9Å; F500-V504 HydrophobicContact CG-CB 4.26Å; F500-V504 HydrophobicContact CG-CG2 4.46Å; F500-V504 HydrophobicContact CZ-CB 4.05Å; F500-V504 HydrophobicContact CZ-CG1 3.72Å; F500-V504 WeakPolarHBondContact O-CA 3.37Å; F500-V504 VanDerWaalsContact O-CB 3.27Å; F500-V504 WeakPolarHBondContact O-CB 3.41Å; F500-V504 PolarHBondContact O-N 3.23Å; V504-L506 VanDerWaalsContact C-N 3.31Å; V504-L506 PolarHBondContact O-N 2.96Å; V504-V508 HydrophobicContact CB-CG2 4.49Å; V504-V508 HydrophobicContact CG1-CB 4.39Å; V504-V508 HydrophobicContact CG1-CG2 3.7Å; V504-V508 VanDerWaalsContact O-CB 3.28Å; V504-V508 WeakPolarHBondContact O-CB 3.15Å; V504-V508 PolarHBondContact O-N 3.33Å; V504-P509 WeakPolarHBondContact O-CD 3.39Å
505	G	92.1	Very high	90.7	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.072	C	C	.	.	I	π-helix	trans	-61.2	-33.2	-177.9	0	0	0	0	0	114	S167 F500 D501 P509	S167-G505 WeakPolarHBondContact CB-O 3.12Å; S167-G505 PolarHBondContact OG-O 3.45Å; F500-G505 PolarHBondContact O-N 2.86Å; D501-G505 CarbonylContact O-C 3.56Å; D501-G505 VanDerWaalsContact O-C 3.3Å; D501-G505 WeakPolarHBondContact O-CA 3.2Å; D501-G505 PolarHBondContact O-N 2.73Å; G505-P509 VanDerWaalsContact O-CD 3.24Å; G505-P509 WeakPolarHBondContact O-CD 3.39Å; G505-P509 WeakPolarHBondContact O-CG 3.38Å
506	L	92.1	Very high	90.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.102	C	C	.	.	I	π-helix	trans	-99.3	-44.6	171.4	-59.4	173.6	0	0	0	112.2	V180 I183 L227 D501 I502 V504 V508 P509 W510	V180-L506 HydrophobicContact CB-CD2 4.14Å; V180-L506 HydrophobicContact CG1-CD1 4.02Å; V180-L506 HydrophobicContact CG1-CD2 3.85Å; V180-L506 HydrophobicContact CG2-CD2 4.07Å; I183-L506 HydrophobicContact CB-CD1 4.41Å; I183-L506 HydrophobicContact CB-CD2 3.95Å; I183-L506 HydrophobicContact CB-CG 4.17Å; I183-L506 HydrophobicContact CG1-CD2 3.67Å; I183-L506 HydrophobicContact CG1-CG 4.09Å; I183-L506 HydrophobicContact CG2-CD1 3.94Å; I183-L506 HydrophobicContact CG2-CD2 4.26Å; I183-L506 HydrophobicContact CG2-CG 3.9Å; L227-L506 HydrophobicContact CD1-CD1 3.67Å; L227-L506 HydrophobicContact CD2-CD1 3.98Å; L227-L506 HydrophobicContact CG-CD1 4.5Å; D501-L506 PolarHBondContact O-N 3.06Å; D501-L506 VanDerWaalsContact O-N 3.13Å; I502-L506 WeakPolarHBondContact O-CB 3.43Å; V504-L506 VanDerWaalsContact C-N 3.31Å; V504-L506 PolarHBondContact O-N 2.96Å; L506-V508 PolarHBondContact O-N 3.46Å; L506-P509 WeakPolarHBondContact O-CD 3.28Å; L506-W510 HydrophobicContact CB-CD2 4.15Å; L506-W510 HydrophobicContact CB-CE3 3.92Å; L506-W510 HydrophobicContact CB-CH2 3.71Å; L506-W510 HydrophobicContact CB-CZ2 3.9Å; L506-W510 HydrophobicContact CB-CZ3 3.7Å; L506-W510 HydrophobicContact CD1-CH2 3.84Å; L506-W510 HydrophobicContact CD1-CZ2 4.25Å; L506-W510 HydrophobicContact CD1-CZ3 4.44Å; L506-W510 HydrophobicContact CD2-CH2 4.36Å; L506-W510 HydrophobicContact CD2-CZ2 3.95Å; L506-W510 HydrophobicContact CG-CH2 4.18Å; L506-W510 HydrophobicContact CG-CZ2 4.25Å; L506-W510 WeakPolarHBondContact O-CB 3.28Å; L506-W510 VanDerWaalsContact O-CD2 3.24Å; L506-W510 PolarHBondContact O-N 3.09Å; L506-W510 VanDerWaalsContact O-N 3.11Å
507	G	93.4	Very high	91	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-40.7	-175.2	0	0	0	0	0	113.9	L503 A511	L503-G507 WeakPolarHBondContact O-CA 3.37Å; L503-G507 PolarHBondContact O-N 3.06Å; G507-A511 WeakPolarHBondContact O-CB 3.13Å; G507-A511 PolarHBondContact O-N 3.32Å
508	V	93.4	Very high	90.7	Very high	47 Å²	47	25.4 Å²	25.4	29%	0.285	15%	0.146	S	C	.	.	H	α-helix	trans	-71	-50.4	-179.9	172	0	0	0	0	112.1	V245 V504 L506 W510 A511 L512	V245-V508 HydrophobicContact CG2-CG2 3.94Å; V504-V508 HydrophobicContact CB-CG2 4.49Å; V504-V508 HydrophobicContact CG1-CB 4.39Å; V504-V508 HydrophobicContact CG1-CG2 3.7Å; V504-V508 VanDerWaalsContact O-CB 3.28Å; V504-V508 WeakPolarHBondContact O-CB 3.15Å; V504-V508 PolarHBondContact O-N 3.33Å; L506-V508 PolarHBondContact O-N 3.46Å; V508-W510 VanDerWaalsContact C-N 3.32Å; V508-W510 PolarHBondContact O-N 3.16Å; V508-A511 PolarHBondContact O-N 3.34Å; V508-L512 HydrophobicContact CG1-CD1 3.72Å; V508-L512 HydrophobicContact CG1-CG 4.09Å; V508-L512 WeakPolarHBondContact O-CB 3.49Å; V508-L512 VanDerWaalsContact O-CG 3.27Å; V508-L512 WeakPolarHBondContact O-CG 3.29Å; V508-L512 PolarHBondContact O-N 2.89Å
509	P	92.6	Very high	90.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-56	-44.1	175.7	-29.8	38.5	0	0	0	113.3	L164 V168 V171 V504 G505 L506 L512 Q513	L164-P509 HydrophobicContact CD1-CG 4.42Å; V168-P509 HydrophobicContact CG2-CB 4.32Å; V168-P509 HydrophobicContact CG2-CG 3.67Å; V171-P509 HydrophobicContact CB-CB 4.25Å; V171-P509 HydrophobicContact CG2-CB 3.96Å; V504-P509 WeakPolarHBondContact O-CD 3.39Å; G505-P509 VanDerWaalsContact O-CD 3.24Å; G505-P509 WeakPolarHBondContact O-CD 3.39Å; G505-P509 WeakPolarHBondContact O-CG 3.38Å; L506-P509 WeakPolarHBondContact O-CD 3.28Å; P509-L512 PolarHBondContact O-N 3.43Å; P509-Q513 WeakPolarHBondContact O-CB 3.49Å; P509-Q513 PolarHBondContact O-N 3.24Å
510	W	92.1	Very high	89.6	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-41.8	177.1	-61.4	-27.6	0	0	0	112.3	V180 L227 I231 I236 S241 L244 L506 V508 L512 Q513 T514	V180-W510 HydrophobicContact CG1-CZ2 4.24Å; V180-W510 HydrophobicContact CG2-CZ2 3.78Å; L227-W510 HydrophobicContact CD1-CH2 3.7Å; L227-W510 HydrophobicContact CD1-CZ3 3.93Å; I231-W510 HydrophobicContact CD1-CH2 4.44Å; I231-W510 HydrophobicContact CG1-CH2 4.49Å; I236-W510 HydrophobicContact CD1-CD2 3.45Å; I236-W510 VanDerWaalsContact CD1-CD2 3.45Å; I236-W510 HydrophobicContact CD1-CE3 3.64Å; I236-W510 HydrophobicContact CD1-CG 4.17Å; I236-W510 HydrophobicContact CD1-CH2 3.36Å; I236-W510 HydrophobicContact CD1-CZ2 3.18Å; I236-W510 HydrophobicContact CD1-CZ3 3.59Å; I236-W510 HydrophobicContact CG2-CB 4.32Å; I236-W510 HydrophobicContact CG2-CD2 4.12Å; I236-W510 HydrophobicContact CG2-CE3 3.93Å; I236-W510 HydrophobicContact CG2-CG 4.33Å; S241-W510 WeakPolarHBondContact OG-CB 3.45Å; L244-W510 HydrophobicContact CD1-CE3 3.84Å; L244-W510 HydrophobicContact CD1-CZ3 3.63Å; L506-W510 HydrophobicContact CB-CD2 4.15Å; L506-W510 HydrophobicContact CB-CE3 3.92Å; L506-W510 HydrophobicContact CB-CH2 3.71Å; L506-W510 HydrophobicContact CB-CZ2 3.9Å; L506-W510 HydrophobicContact CB-CZ3 3.7Å; L506-W510 HydrophobicContact CD1-CH2 3.84Å; L506-W510 HydrophobicContact CD1-CZ2 4.25Å; L506-W510 HydrophobicContact CD1-CZ3 4.44Å; L506-W510 HydrophobicContact CD2-CH2 4.36Å; L506-W510 HydrophobicContact CD2-CZ2 3.95Å; L506-W510 HydrophobicContact CG-CH2 4.18Å; L506-W510 HydrophobicContact CG-CZ2 4.25Å; L506-W510 WeakPolarHBondContact O-CB 3.28Å; L506-W510 VanDerWaalsContact O-CD2 3.24Å; L506-W510 PolarHBondContact O-N 3.09Å; L506-W510 VanDerWaalsContact O-N 3.11Å; V508-W510 VanDerWaalsContact C-N 3.32Å; V508-W510 PolarHBondContact O-N 3.16Å; W510-L512 PolarHBondContact O-N 3.33Å; W510-Q513 PolarHBondContact O-N 3.39Å; W510-T514 WeakPolarHBondContact O-CB 2.97Å; W510-T514 VanDerWaalsContact O-CG2 3.28Å; W510-T514 WeakPolarHBondContact O-CG2 3.28Å; W510-T514 PolarHBondContact O-N 2.8Å; W510-T514 PolarHBondContact O-OG1 3.34Å
511	A	91.9	Very high	89.3	Confident	15 Å²	15	38 Å²	38	12%	0.124	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-41.8	175.5	0	0	0	0	0	111.6	G507 V508 M515	G507-A511 WeakPolarHBondContact O-CB 3.13Å; G507-A511 PolarHBondContact O-N 3.32Å; V508-A511 PolarHBondContact O-N 3.34Å; A511-M515 HydrophobicContact CB-SD 4.3Å; A511-M515 WeakPolarHBondContact O-CA 3.5Å; A511-M515 WeakPolarHBondContact O-CB 3.28Å; A511-M515 WeakPolarHBondContact O-CG 3.45Å; A511-M515 PolarHBondContact O-N 2.94Å
512	L	90.9	Very high	88.9	Confident	72 Å²	72	42.4 Å²	42.4	38%	0.377	24%	0.235	S	C	.	.	I	π-helix	trans	-63.2	-43.6	177.4	-72.3	172	0	0	0	111.5	F172 V508 P509 W510 C516 V517	F172-L512 HydrophobicContact CE2-CB 4.19Å; F172-L512 HydrophobicContact CZ-CB 3.69Å; V508-L512 HydrophobicContact CG1-CD1 3.72Å; V508-L512 HydrophobicContact CG1-CG 4.09Å; V508-L512 WeakPolarHBondContact O-CB 3.49Å; V508-L512 VanDerWaalsContact O-CG 3.27Å; V508-L512 WeakPolarHBondContact O-CG 3.29Å; V508-L512 PolarHBondContact O-N 2.89Å; P509-L512 PolarHBondContact O-N 3.43Å; W510-L512 PolarHBondContact O-N 3.33Å; L512-C516 WeakPolarHBondContact O-CA 3.47Å; L512-C516 VanDerWaalsContact O-CB 3.28Å; L512-C516 WeakPolarHBondContact O-CB 3.4Å; L512-C516 PolarHBondContact O-N 3.23Å; L512-V517 PolarHBondContact O-N 3.45Å
513	Q	89.1	Confident	88.4	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.075	24%	0.241	C	C	.	.	I	π-helix	trans	-65.3	-47.4	178.6	-178.9	57.6	49.9	0	0	111.8	V171 F172 P509 W510 N518 V523	V171-Q513 HydrophobicContact CG1-CB 3.81Å; V171-Q513 HydrophobicContact CG1-CG 4.05Å; F172-Q513 HydrophobicContact CE1-CB 4.09Å; F172-Q513 HydrophobicContact CZ-CB 4.08Å; P509-Q513 WeakPolarHBondContact O-CB 3.49Å; P509-Q513 PolarHBondContact O-N 3.24Å; W510-Q513 PolarHBondContact O-N 3.39Å; Q513-N518 PolarHBondContact NE2-ND2 3.45Å; Q513-N518 PolarHBondContact O-N 3.02Å; Q513-V523 HydrophobicContact CB-CG2 4.22Å; Q513-V523 HydrophobicContact CG-CG2 3.81Å
514	T	88.6	Confident	87.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	I	π-helix	trans	-82.7	-24.4	-173	59.2	0	0	0	0	114.7	W238 W510 N518 Y519 G520 S521 V523	W238-T514 WeakPolarHBondContact CA-OG1 3.44Å; W510-T514 WeakPolarHBondContact O-CB 2.97Å; W510-T514 VanDerWaalsContact O-CG2 3.28Å; W510-T514 WeakPolarHBondContact O-CG2 3.28Å; W510-T514 PolarHBondContact O-N 2.8Å; W510-T514 PolarHBondContact O-OG1 3.34Å; T514-N518 CarbonylContact C-O 3.5Å; T514-N518 VanDerWaalsContact O-O 3.06Å; T514-Y519 WeakPolarHBondContact O-CA 3.32Å; T514-G520 PolarHBondContact O-N 3.06Å; T514-S521 VanDerWaalsContact CG2-O 3.27Å; T514-S521 WeakPolarHBondContact CG2-O 3.47Å; T514-V523 HydrophobicContact CG2-CG2 3.89Å
515	M	88.7	Confident	87.3	Confident	76 Å²	76	47.8 Å²	47.8	37%	0.374	26%	0.262	S	S	.	.	I	π-helix	trans	-105.9	-40	-179.6	-59.6	177	57.2	0	0	113.6	W238 A511	W238-M515 HydrophobicContact CB-CG 3.98Å; A511-M515 HydrophobicContact CB-SD 4.3Å; A511-M515 WeakPolarHBondContact O-CA 3.5Å; A511-M515 WeakPolarHBondContact O-CB 3.28Å; A511-M515 WeakPolarHBondContact O-CG 3.45Å; A511-M515 PolarHBondContact O-N 2.94Å
516	C	86.8	Confident	86.4	Confident	96 Å²	96	52.8 Å²	52.8	65%	0.649	29%	0.289	S	S	*	.	I	π-helix	trans	-99.7	-41.5	-170.6	-61.5	0	0	0	0	113.3	L512	L512-C516 WeakPolarHBondContact O-CA 3.47Å; L512-C516 VanDerWaalsContact O-CB 3.28Å; L512-C516 WeakPolarHBondContact O-CB 3.4Å; L512-C516 PolarHBondContact O-N 3.23Å
517	V	85.7	Confident	85.5	Confident	82 Å²	82	53 Å²	53	50%	0.497	29%	0.29	S	S	.	.	I	π-helix	trans	-86.4	-59.3	-176.5	178.1	0	0	0	0	110.9	F172 L512	F172-V517 HydrophobicContact CE1-CB 4.31Å; F172-V517 HydrophobicContact CE1-CG2 3.6Å; F172-V517 HydrophobicContact CZ-CG2 4.32Å; L512-V517 PolarHBondContact O-N 3.45Å
518	N	81.9	Confident	84.8	Confident	89 Å²	89	59.8 Å²	59.8	48%	0.476	32%	0.316	S	S	.	.	S	Bend	trans	-123.3	91.5	179.6	-69	-31.9	0	0	0	109.3	Q513 T514 G520 S521	Q513-N518 PolarHBondContact NE2-ND2 3.45Å; Q513-N518 PolarHBondContact O-N 3.02Å; T514-N518 CarbonylContact C-O 3.5Å; T514-N518 VanDerWaalsContact O-O 3.06Å; N518-G520 PolarHBondContact O-N 3.44Å; N518-S521 WeakPolarHBondContact CB-OG 3.46Å; N518-S521 WeakPolarHBondContact O-CB 3.38Å; N518-S521 PolarHBondContact O-N 3.11Å; N518-S521 PolarHBondContact O-OG 3.04Å
519	Y	81.9	Confident	84.1	Confident	199 Å²	199	57.5 Å²	57.5	78%	0.78	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	116.5	-176.9	-172.3	-93.6	0	0	0	111.3	T514	T514-Y519 WeakPolarHBondContact O-CA 3.32Å
520	G	76.4	Confident	83.7	Confident	49 Å²	49	57.5 Å²	57.5	51%	0.505	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	10.5	-179.6	0	0	0	0	0	115	T514 N518	T514-G520 PolarHBondContact O-N 3.06Å; N518-G520 PolarHBondContact O-N 3.44Å
521	S	83.8	Confident	83.5	Confident	33 Å²	33	58.7 Å²	58.7	23%	0.231	31%	0.309	C	S	.	.			trans	-70.6	154.7	167.5	67.3	0	0	0	0	111.4	T514 N518	T514-S521 VanDerWaalsContact CG2-O 3.27Å; T514-S521 WeakPolarHBondContact CG2-O 3.47Å; N518-S521 WeakPolarHBondContact CB-OG 3.46Å; N518-S521 WeakPolarHBondContact O-CB 3.38Å; N518-S521 PolarHBondContact O-N 3.11Å; N518-S521 PolarHBondContact O-OG 3.04Å
522	E	84.4	Confident	83.3	Confident	92 Å²	92	63.3 Å²	63.3	43%	0.43	32%	0.324	S	S	.	.			trans	-102.1	138.4	172.3	-61.9	172.1	-173.6	0	0	108.6	K235 V237	K235-E522 WeakPolarHBondContact CD-OE2 3.3Å; K235-E522 IonicContact NZ-OE2 2.73Å; K235-E522 PolarHBondContact NZ-OE2 2.91Å; V237-E522 HydrophobicContact CG1-CG 4.17Å
523	V	83.6	Confident	83.2	Confident	22 Å²	22	59.9 Å²	59.9	13%	0.133	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	115.4	168.6	178.8	0	0	0	0	107.4	I236 Q513 T514	I236-V523 HydrophobicContact CB-CB 4.26Å; I236-V523 PolarHBondContact N-O 3.01Å; I236-V523 PolarHBondContact O-N 3.37Å; Q513-V523 HydrophobicContact CB-CG2 4.22Å; Q513-V523 HydrophobicContact CG-CG2 3.81Å; T514-V523 HydrophobicContact CG2-CG2 3.89Å
524	M	81.4	Confident	83.3	Confident	104 Å²	104	59.1 Å²	59.1	51%	0.512	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	137.8	180	-62.6	-86.3	-68.9	0	0	109.6	K235	K235-M524 HydrophobicContact CD-SD 4.46Å; K235-M524 HydrophobicContact CG-SD 3.76Å
525	I	82.7	Confident	83.4	Confident	9 Å²	9	62.4 Å²	62.4	5%	0.046	32%	0.323	C	S	.	.			trans	-98.4	123.1	172.2	-58.6	179.3	0	0	0	107.7	I231 E234 I236 L530	I231-I525 HydrophobicContact CB-CD1 3.83Å; I231-I525 HydrophobicContact CD1-CD1 4.3Å; I231-I525 HydrophobicContact CG1-CD1 3.64Å; I231-I525 HydrophobicContact CG2-CD1 3.47Å; I231-I525 VanDerWaalsContact CG2-CD1 3.47Å; E234-I525 PolarHBondContact O-N 2.88Å; I236-I525 HydrophobicContact CD1-CD1 3.94Å; I236-I525 HydrophobicContact CD1-CG1 4.25Å; I236-I525 HydrophobicContact CG1-CD1 4.12Å; I236-I525 HydrophobicContact CG1-CG1 4.39Å; I525-L530 HydrophobicContact CG2-CB 4.44Å; I525-L530 HydrophobicContact CG2-CD2 3.65Å
526	N	72.9	Confident	83.5	Confident	106 Å²	106	61.6 Å²	61.6	57%	0.567	32%	0.32	S	S	*	.			trans	-83.6	-23.1	-170.2	-67	-27	0	0	0	113	H175 D177	H175-N526 PolarHBondContact O-ND2 3.47Å; D177-N526 PolarHBondContact OD1-N 3.42Å; D177-N526 VanDerWaalsContact OD1-N 3.15Å; D177-N526 WeakPolarHBondContact OD2-CA 3.32Å; D177-N526 WeakPolarHBondContact OD2-CB 3.48Å; D177-N526 PolarHBondContact OD2-N 3.43Å
527	S	72.4	Confident	83.7	Confident	3 Å²	3	57 Å²	57	2%	0.021	29%	0.289	C	S	.	.			trans	-116	116.6	-173.5	174.6	0	0	0	0	112.4	D177 G529 L530 E578 N586	D177-S527 WeakPolarHBondContact OD2-CB 3.43Å; D177-S527 PolarHBondContact OD2-N 3.43Å; S527-G529 PolarHBondContact O-N 2.91Å; S527-G529 WeakPolarHBondContact OG-CA 3.39Å; S527-G529 PolarHBondContact OG-N 3.39Å; S527-G529 VanDerWaalsContact OG-N 3.1Å; S527-L530 WeakPolarHBondContact O-CB 3.47Å; S527-L530 PolarHBondContact O-N 2.9Å; S527-E578 PolarHBondContact OG-OE1 3.28Å; S527-E578 PolarHBondContact OG-OE2 3.09Å; S527-N586 VanDerWaalsContact CA-OD1 3.23Å; S527-N586 WeakPolarHBondContact CA-OD1 3.22Å; S527-N586 VanDerWaalsContact CB-OD1 3.24Å; S527-N586 WeakPolarHBondContact CB-OD1 3.32Å; S527-N586 PolarHBondContact OG-ND2 2.95Å; S527-N586 VanDerWaalsContact OG-ND2 3.11Å; S527-N586 PolarHBondContact OG-OD1 3.19Å
528	R	78.7	Confident	84	Confident	143 Å²	143	55.3 Å²	55.3	54%	0.54	28%	0.277	S	S	.	.	H	α-helix	trans	-61.4	-21.1	165.9	-74.2	-178.1	177.7	-170.4	-2.6	111.9	E234 L530 V531 Y532 V585	E234-R528 WeakPolarHBondContact OE1-CD 3.14Å; E234-R528 WeakPolarHBondContact OE1-CG 3.25Å; E234-R528 IonicContact OE1-CZ 3.38Å; E234-R528 IonicContact OE1-NE 2.67Å; E234-R528 PolarHBondContact OE1-NE 2.95Å; E234-R528 IonicContact OE1-NH2 3.27Å; E234-R528 PolarHBondContact OE1-NH2 3.48Å; R528-L530 PolarHBondContact O-N 3.3Å; R528-V531 WeakPolarHBondContact O-CB 3.46Å; R528-V531 PolarHBondContact O-N 3.43Å; R528-Y532 VanDerWaalsContact O-CD2 3.25Å; R528-Y532 WeakPolarHBondContact O-CD2 3.3Å; R528-V585 HydrophobicContact CB-CG1 3.82Å
529	G	80.3	Confident	84.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-27.9	179.5	0	0	0	0	0	112.3	S527 Y532 S533 E578	S527-G529 PolarHBondContact O-N 2.91Å; S527-G529 WeakPolarHBondContact OG-CA 3.39Å; S527-G529 PolarHBondContact OG-N 3.39Å; S527-G529 VanDerWaalsContact OG-N 3.1Å; G529-Y532 PolarHBondContact O-N 2.91Å; G529-S533 PolarHBondContact O-N 3.46Å; G529-S533 PolarHBondContact O-OG 3.13Å; G529-E578 WeakPolarHBondContact CA-OE2 3.45Å
530	L	83.2	Confident	84.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-42.4	174.5	-169	69.7	0	0	0	112	V180 V184 I525 S527 R528 Y532 S533 V534	V180-L530 HydrophobicContact CB-CD1 4.36Å; V180-L530 HydrophobicContact CB-CD2 3.8Å; V180-L530 HydrophobicContact CG1-CD1 4.2Å; V180-L530 HydrophobicContact CG1-CD2 3.63Å; V180-L530 HydrophobicContact CG1-CG 4.32Å; V180-L530 HydrophobicContact CG2-CD2 4.45Å; V184-L530 HydrophobicContact CG2-CD1 4.49Å; I525-L530 HydrophobicContact CG2-CB 4.44Å; I525-L530 HydrophobicContact CG2-CD2 3.65Å; S527-L530 WeakPolarHBondContact O-CB 3.47Å; S527-L530 PolarHBondContact O-N 2.9Å; R528-L530 PolarHBondContact O-N 3.3Å; L530-Y532 VanDerWaalsContact C-N 3.34Å; L530-Y532 PolarHBondContact O-N 3.38Å; L530-S533 WeakPolarHBondContact O-CB 3.21Å; L530-S533 PolarHBondContact O-N 3.03Å; L530-S533 VanDerWaalsContact O-N 3.13Å; L530-V534 WeakPolarHBondContact O-CG2 3.39Å; L530-V534 PolarHBondContact O-N 3.25Å
531	V	87.8	Confident	85.6	Confident	26 Å²	26	41.1 Å²	41.1	16%	0.158	21%	0.211	C	C	.	.	H	α-helix	trans	-57.5	-48.7	176.4	178.4	0	0	0	0	110.2	I231 R528 S533 V534 V535	I231-V531 HydrophobicContact CG2-CB 4.45Å; I231-V531 HydrophobicContact CG2-CG2 3.47Å; I231-V531 VanDerWaalsContact CG2-CG2 3.47Å; R528-V531 WeakPolarHBondContact O-CB 3.46Å; R528-V531 PolarHBondContact O-N 3.43Å; V531-S533 VanDerWaalsContact C-N 3.3Å; V531-S533 PolarHBondContact O-N 2.69Å; V531-V534 PolarHBondContact O-N 3.34Å; V531-V535 WeakPolarHBondContact O-CG2 3.2Å; V531-V535 PolarHBondContact O-N 3.5Å
532	Y	88.6	Confident	86	Confident	112 Å²	112	42 Å²	42	44%	0.439	22%	0.22	S	C	.	.	H	α-helix	trans	-61.9	-39.3	177.9	-66.7	-69.4	0	0	0	112	R528 G529 L530 V534 V535 L536 I577 V585	R528-Y532 VanDerWaalsContact O-CD2 3.25Å; R528-Y532 WeakPolarHBondContact O-CD2 3.3Å; G529-Y532 PolarHBondContact O-N 2.91Å; L530-Y532 VanDerWaalsContact C-N 3.34Å; L530-Y532 PolarHBondContact O-N 3.38Å; Y532-V534 PolarHBondContact O-N 2.86Å; Y532-V535 PolarHBondContact O-N 3.49Å; Y532-L536 WeakPolarHBondContact O-CB 3.44Å; Y532-L536 VanDerWaalsContact O-CG 3.31Å; Y532-L536 WeakPolarHBondContact O-CG 3.34Å; Y532-L536 PolarHBondContact O-N 3.05Å; Y532-I577 HydrophobicContact CD2-CG2 4.18Å; Y532-I577 HydrophobicContact CG-CG2 4.4Å; Y532-V585 HydrophobicContact CD2-CG1 4.32Å; Y532-V585 HydrophobicContact CD2-CG2 4.36Å; Y532-V585 HydrophobicContact CE2-CG1 4.42Å; Y532-V585 HydrophobicContact CE2-CG2 3.98Å
533	S	88.4	Confident	86.4	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-40.4	177	-60.4	0	0	0	0	112.2	G529 L530 V531 L536 L537	G529-S533 PolarHBondContact O-N 3.46Å; G529-S533 PolarHBondContact O-OG 3.13Å; L530-S533 WeakPolarHBondContact O-CB 3.21Å; L530-S533 PolarHBondContact O-N 3.03Å; L530-S533 VanDerWaalsContact O-N 3.13Å; V531-S533 VanDerWaalsContact C-N 3.3Å; V531-S533 PolarHBondContact O-N 2.69Å; S533-L536 PolarHBondContact O-N 3.3Å; S533-L537 PolarHBondContact O-N 3.09Å
534	V	90.6	Very high	86.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.7	-36.9	175.9	-178	0	0	0	0	111.7	V184 V224 L227 I228 I231 L530 V531 Y532 L537 L538	V184-V534 HydrophobicContact CG1-CG2 4.12Å; V184-V534 HydrophobicContact CG2-CG2 3.65Å; V224-V534 HydrophobicContact CG1-CG1 4.09Å; L227-V534 HydrophobicContact CD2-CG1 3.91Å; L227-V534 HydrophobicContact CD2-CG2 4.22Å; L227-V534 HydrophobicContact CG-CG1 4.3Å; I228-V534 HydrophobicContact CD1-CG1 4.27Å; I228-V534 HydrophobicContact CG1-CB 4.3Å; I228-V534 HydrophobicContact CG1-CG1 3.49Å; I228-V534 VanDerWaalsContact CG1-CG1 3.49Å; I231-V534 HydrophobicContact CD1-CG2 4.29Å; L530-V534 WeakPolarHBondContact O-CG2 3.39Å; L530-V534 PolarHBondContact O-N 3.25Å; V531-V534 PolarHBondContact O-N 3.34Å; Y532-V534 PolarHBondContact O-N 2.86Å; V534-L537 WeakPolarHBondContact O-CB 3.39Å; V534-L537 PolarHBondContact O-N 2.97Å; V534-L538 PolarHBondContact O-N 3.4Å
535	V	91.8	Very high	87.1	Confident	69 Å²	69	37 Å²	37	42%	0.418	20%	0.199	S	C	.	.	H	α-helix	trans	-64.3	-42.3	173.2	172.4	0	0	0	0	111.1	I228 V531 Y532 L537 L538 G539	I228-V535 HydrophobicContact CD1-CG2 4.12Å; I228-V535 HydrophobicContact CG1-CG2 4.44Å; I228-V535 HydrophobicContact CG2-CG2 4.35Å; V531-V535 WeakPolarHBondContact O-CG2 3.2Å; V531-V535 PolarHBondContact O-N 3.5Å; Y532-V535 PolarHBondContact O-N 3.49Å; V535-L537 VanDerWaalsContact C-N 3.29Å; V535-L537 PolarHBondContact O-N 2.9Å; V535-L538 WeakPolarHBondContact O-CB 3.47Å; V535-L538 PolarHBondContact O-N 3.46Å; V535-G539 PolarHBondContact O-N 2.95Å; V535-G539 VanDerWaalsContact O-N 3.09Å
536	L	90.6	Very high	87.5	Confident	58 Å²	58	41 Å²	41	30%	0.304	22%	0.22	S	C	.	.	H	α-helix	trans	-63.1	-36.4	173.9	-73	175.9	0	0	0	111.7	Y532 S533 G539 S540 F570 F573 I577	Y532-L536 WeakPolarHBondContact O-CB 3.44Å; Y532-L536 VanDerWaalsContact O-CG 3.31Å; Y532-L536 WeakPolarHBondContact O-CG 3.34Å; Y532-L536 PolarHBondContact O-N 3.05Å; S533-L536 PolarHBondContact O-N 3.3Å; L536-G539 PolarHBondContact O-N 3.4Å; L536-S540 PolarHBondContact O-N 2.78Å; L536-F570 HydrophobicContact CB-CD2 3.85Å; L536-F570 HydrophobicContact CB-CE2 3.57Å; L536-F573 HydrophobicContact CD1-CB 4.18Å; L536-I577 HydrophobicContact CD1-CD1 3.78Å
537	L	91.1	Very high	88.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.4	-50.5	172.3	167.1	65.3	0	0	0	110.5	V184 A187 V188 Y220 V224 S533 V534 V535 G539 S540 V541	V184-L537 HydrophobicContact CG1-CD2 4.33Å; A187-L537 HydrophobicContact CB-CD1 4.39Å; A187-L537 HydrophobicContact CB-CD2 4.16Å; V188-L537 HydrophobicContact CB-CD1 4.37Å; V188-L537 HydrophobicContact CG2-CB 4.05Å; V188-L537 HydrophobicContact CG2-CD1 3.45Å; V188-L537 VanDerWaalsContact CG2-CD1 3.45Å; V188-L537 HydrophobicContact CG2-CG 4.24Å; Y220-L537 WeakPolarHBondContact OH-CD1 3.46Å; V224-L537 HydrophobicContact CG2-CD2 4.18Å; S533-L537 PolarHBondContact O-N 3.09Å; V534-L537 WeakPolarHBondContact O-CB 3.39Å; V534-L537 PolarHBondContact O-N 2.97Å; V535-L537 VanDerWaalsContact C-N 3.29Å; V535-L537 PolarHBondContact O-N 2.9Å; L537-G539 VanDerWaalsContact C-N 3.28Å; L537-G539 PolarHBondContact O-N 3.36Å; L537-S540 PolarHBondContact O-N 2.96Å; L537-S540 PolarHBondContact O-OG 3.31Å; L537-V541 HydrophobicContact CD1-CG2 4.14Å; L537-V541 WeakPolarHBondContact O-CG2 3.34Å; L537-V541 PolarHBondContact O-N 3.07Å
538	L	92.3	Very high	89.2	Confident	46 Å²	46	36.4 Å²	36.4	24%	0.241	20%	0.197	C	C	.	.	H	α-helix	trans	-55.4	-44.1	177.1	-177.5	64.3	0	0	0	112	I221 V224 V225 I228 V534 V535 S540 V541 A542	I221-L538 HydrophobicContact CG1-CD1 4.38Å; I221-L538 HydrophobicContact CG2-CD1 4.09Å; V224-L538 HydrophobicContact CB-CD1 4.34Å; V224-L538 HydrophobicContact CG1-CB 3.82Å; V224-L538 HydrophobicContact CG1-CD1 4.08Å; V224-L538 HydrophobicContact CG1-CG 4.47Å; V225-L538 HydrophobicContact CG2-CD1 4.33Å; V225-L538 HydrophobicContact CG2-CD2 4.19Å; I228-L538 HydrophobicContact CD1-CB 4.24Å; I228-L538 HydrophobicContact CD1-CD2 3.92Å; V534-L538 PolarHBondContact O-N 3.4Å; V535-L538 WeakPolarHBondContact O-CB 3.47Å; V535-L538 PolarHBondContact O-N 3.46Å; L538-S540 PolarHBondContact O-N 2.79Å; L538-V541 PolarHBondContact O-N 3.4Å; L538-A542 PolarHBondContact O-N 3.43Å; L538-A542 VanDerWaalsContact O-N 3.13Å
539	G	92	Very high	89.7	Confident	33 Å²	33	34.4 Å²	34.4	34%	0.34	19%	0.194	S	C	.	.	H	α-helix	trans	-60.4	-43.4	175.3	0	0	0	0	0	112.7	V535 L536 L537 V541 A542 L543	V535-G539 PolarHBondContact O-N 2.95Å; V535-G539 VanDerWaalsContact O-N 3.09Å; L536-G539 PolarHBondContact O-N 3.4Å; L537-G539 VanDerWaalsContact C-N 3.28Å; L537-G539 PolarHBondContact O-N 3.36Å; G539-V541 VanDerWaalsContact C-N 3.33Å; G539-V541 PolarHBondContact O-N 2.96Å; G539-A542 PolarHBondContact O-N 2.82Å; G539-L543 WeakPolarHBondContact O-CB 3.28Å; G539-L543 VanDerWaalsContact O-CG 3.3Å; G539-L543 WeakPolarHBondContact O-CG 3.24Å; G539-L543 PolarHBondContact O-N 3.44Å
540	S	91	Very high	90.3	Very high	5 Å²	5	40.2 Å²	40.2	4%	0.035	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-35.8	179.5	78	0	0	0	0	113	L536 L537 L538 T544	L536-S540 PolarHBondContact O-N 2.78Å; L537-S540 PolarHBondContact O-N 2.96Å; L537-S540 PolarHBondContact O-OG 3.31Å; L538-S540 PolarHBondContact O-N 2.79Å; S540-T544 WeakPolarHBondContact O-CB 3.27Å; S540-T544 PolarHBondContact O-N 2.75Å; S540-T544 PolarHBondContact O-OG1 2.96Å
541	V	90.6	Very high	90.6	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-65.6	-49.3	175.3	176.6	0	0	0	0	110.4	I191 Y220 I221 L537 L538 G539 L543 T544 V545	I191-V541 HydrophobicContact CG1-CG2 4.38Å; Y220-V541 HydrophobicContact CD1-CG1 3.91Å; Y220-V541 HydrophobicContact CD1-CG2 3.91Å; Y220-V541 HydrophobicContact CE1-CB 4.41Å; Y220-V541 HydrophobicContact CE1-CG1 4.18Å; Y220-V541 HydrophobicContact CE1-CG2 3.32Å; I221-V541 HydrophobicContact CG1-CG1 4.1Å; L537-V541 HydrophobicContact CD1-CG2 4.14Å; L537-V541 WeakPolarHBondContact O-CG2 3.34Å; L537-V541 PolarHBondContact O-N 3.07Å; L538-V541 PolarHBondContact O-N 3.4Å; G539-V541 VanDerWaalsContact C-N 3.33Å; G539-V541 PolarHBondContact O-N 2.96Å; V541-L543 VanDerWaalsContact C-N 3.32Å; V541-L543 PolarHBondContact O-N 3.27Å; V541-T544 PolarHBondContact O-N 3.36Å; V541-V545 HydrophobicContact CG1-CG2 4.46Å; V541-V545 WeakPolarHBondContact O-CG2 3.49Å; V541-V545 PolarHBondContact O-N 3.12Å
542	A	91.4	Very high	90.7	Very high	51 Å²	51	49.1 Å²	49.1	42%	0.421	26%	0.262	S	S	.	.	H	α-helix	trans	-58.9	-44	178.1	0	0	0	0	0	111.7	L538 G539 L546	L538-A542 PolarHBondContact O-N 3.43Å; L538-A542 VanDerWaalsContact O-N 3.13Å; G539-A542 PolarHBondContact O-N 2.82Å; A542-L546 WeakPolarHBondContact O-CB 3.43Å; A542-L546 PolarHBondContact O-N 3.23Å
543	L	92.8	Very high	90.8	Very high	73 Å²	73	45.7 Å²	45.7	38%	0.382	25%	0.248	S	C	.	.	H	α-helix	trans	-65	-38.7	177	-71.6	174.6	0	0	0	112.6	G539 V541 G547 L566	G539-L543 WeakPolarHBondContact O-CB 3.28Å; G539-L543 VanDerWaalsContact O-CG 3.3Å; G539-L543 WeakPolarHBondContact O-CG 3.24Å; G539-L543 PolarHBondContact O-N 3.44Å; V541-L543 VanDerWaalsContact C-N 3.32Å; V541-L543 PolarHBondContact O-N 3.27Å; L543-G547 PolarHBondContact O-N 3.13Å; L543-L566 HydrophobicContact CB-CD2 3.76Å; L543-L566 HydrophobicContact CD1-CD1 3.78Å; L543-L566 HydrophobicContact CD1-CD2 4.28Å
544	T	90.6	Very high	90.8	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-68.3	-46.4	178.7	-56.2	0	0	0	0	111.4	I191 L192 I195 S540 V541 L546 G547 I548 V563	I191-T544 HydrophobicContact CG2-CG2 4.01Å; L192-T544 WeakPolarHBondContact CD2-OG1 3.29Å; I195-T544 HydrophobicContact CD1-CG2 4.36Å; S540-T544 WeakPolarHBondContact O-CB 3.27Å; S540-T544 PolarHBondContact O-N 2.75Å; S540-T544 PolarHBondContact O-OG1 2.96Å; V541-T544 PolarHBondContact O-N 3.36Å; T544-L546 VanDerWaalsContact C-N 3.34Å; T544-L546 PolarHBondContact O-N 3.23Å; T544-G547 PolarHBondContact O-N 3.47Å; T544-I548 HydrophobicContact CG2-CD1 4.17Å; T544-I548 WeakPolarHBondContact O-CG1 3.31Å; T544-I548 PolarHBondContact O-N 3.07Å; T544-V563 HydrophobicContact CG2-CG1 4.39Å; T544-V563 HydrophobicContact CG2-CG2 4.26Å
545	V	89.8	Confident	90.6	Very high	38 Å²	38	49.7 Å²	49.7	23%	0.23	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-43.2	176.1	174.3	0	0	0	0	110.8	S217 V541 G547 I548 H549	S217-V545 WeakPolarHBondContact OG-CG2 3.21Å; V541-V545 HydrophobicContact CG1-CG2 4.46Å; V541-V545 WeakPolarHBondContact O-CG2 3.49Å; V541-V545 PolarHBondContact O-N 3.12Å; V545-G547 VanDerWaalsContact C-N 3.34Å; V545-G547 PolarHBondContact O-N 3.27Å; V545-I548 PolarHBondContact O-N 3.21Å; V545-H549 WeakPolarHBondContact O-CB 3.32Å; V545-H549 PolarHBondContact O-N 3.04Å
546	L	90.8	Very high	90.5	Very high	92 Å²	92	48.1 Å²	48.1	48%	0.482	26%	0.256	S	S	.	.	H	α-helix	trans	-61.7	-42.5	174.8	-179.3	61.7	0	0	0	111.4	A542 T544 H549 I550	A542-L546 WeakPolarHBondContact O-CB 3.43Å; A542-L546 PolarHBondContact O-N 3.23Å; T544-L546 VanDerWaalsContact C-N 3.34Å; T544-L546 PolarHBondContact O-N 3.23Å; L546-H549 PolarHBondContact O-N 3.02Å; L546-I550 HydrophobicContact CD1-CD1 4Å; L546-I550 HydrophobicContact CD1-CG1 4.2Å; L546-I550 HydrophobicContact CD2-CD1 4.48Å; L546-I550 HydrophobicContact CG-CD1 3.8Å; L546-I550 HydrophobicContact CG-CG1 4.42Å; L546-I550 WeakPolarHBondContact O-CB 3.4Å; L546-I550 VanDerWaalsContact O-CG1 3.25Å; L546-I550 WeakPolarHBondContact O-CG1 3.38Å; L546-I550 PolarHBondContact O-N 2.89Å
547	G	90.6	Very high	90.5	Very high	9 Å²	9	50 Å²	50	9%	0.093	27%	0.266	C	S	.	.	H	α-helix	trans	-59.2	-45.9	175.3	0	0	0	0	0	112.6	L543 T544 V545 H549 I550 N551	L543-G547 PolarHBondContact O-N 3.13Å; T544-G547 PolarHBondContact O-N 3.47Å; V545-G547 VanDerWaalsContact C-N 3.34Å; V545-G547 PolarHBondContact O-N 3.27Å; G547-H549 VanDerWaalsContact C-N 3.35Å; G547-H549 PolarHBondContact O-N 3.39Å; G547-I550 PolarHBondContact O-N 3.36Å; G547-N551 WeakPolarHBondContact O-CB 3.16Å; G547-N551 PolarHBondContact O-N 3.24Å
548	I	89.9	Confident	90.6	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.015	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-43	175.6	-66.1	163	0	0	0	110.9	L208 T544 V545 N551 K552 W553 L559	L208-I548 HydrophobicContact CD1-CG2 4.07Å; T544-I548 HydrophobicContact CG2-CD1 4.17Å; T544-I548 WeakPolarHBondContact O-CG1 3.31Å; T544-I548 PolarHBondContact O-N 3.07Å; V545-I548 PolarHBondContact O-N 3.21Å; I548-N551 CarbonylContact O-C 3.59Å; I548-N551 PolarHBondContact O-N 3.48Å; I548-K552 PolarHBondContact O-N 2.58Å; I548-W553 HydrophobicContact CG2-CD2 4.49Å; I548-W553 HydrophobicContact CG2-CE3 3.82Å; I548-W553 HydrophobicContact CG2-CZ3 4.15Å; I548-W553 PolarHBondContact O-N 3.15Å; I548-L559 HydrophobicContact CB-CD2 4.45Å; I548-L559 HydrophobicContact CG1-CD2 3.88Å
549	H	89.8	Confident	90.5	Very high	102 Å²	102	56.4 Å²	56.4	47%	0.472	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-45.4	178	-175.3	-61.9	0	0	0	111.8	V545 L546 G547 N551 K552 W553	V545-H549 WeakPolarHBondContact O-CB 3.32Å; V545-H549 PolarHBondContact O-N 3.04Å; L546-H549 PolarHBondContact O-N 3.02Å; G547-H549 VanDerWaalsContact C-N 3.35Å; G547-H549 PolarHBondContact O-N 3.39Å; H549-N551 VanDerWaalsContact C-N 3.26Å; H549-N551 PolarHBondContact O-N 3.09Å; H549-K552 PolarHBondContact O-N 2.91Å; H549-K552 VanDerWaalsContact O-N 3.09Å; H549-W553 HydrophobicContact CB-CH2 4.48Å; H549-W553 HydrophobicContact CB-CZ2 4Å; H549-W553 AromaticContact CD2-CZ2 3.44Å; H549-W553 VanDerWaalsContact CD2-CZ2 3.44Å; H549-W553 WeakPolarHBondContact CD2-CZ2 3.01Å; H549-W553 AromaticContact CG-CZ2 3.91Å
550	I	91.9	Very high	90.5	Very high	122 Å²	122	54.9 Å²	54.9	63%	0.626	28%	0.276	S	S	*	.	H	α-helix	trans	-63.1	-36.8	177.5	-68.6	167.8	0	0	0	110.3	L546 G547 K552	L546-I550 HydrophobicContact CD1-CD1 4Å; L546-I550 HydrophobicContact CD1-CG1 4.2Å; L546-I550 HydrophobicContact CD2-CD1 4.48Å; L546-I550 HydrophobicContact CG-CD1 3.8Å; L546-I550 HydrophobicContact CG-CG1 4.42Å; L546-I550 WeakPolarHBondContact O-CB 3.4Å; L546-I550 VanDerWaalsContact O-CG1 3.25Å; L546-I550 WeakPolarHBondContact O-CG1 3.38Å; L546-I550 PolarHBondContact O-N 2.89Å; G547-I550 PolarHBondContact O-N 3.36Å; I550-K552 PolarHBondContact O-N 3.4Å; I550-K552 VanDerWaalsContact O-N 3.13Å
551	N	91.1	Very high	90.5	Very high	42 Å²	42	58.8 Å²	58.8	23%	0.225	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	21	175.4	-149	48.3	0	0	0	113.8	G547 I548 H549 W553 Q554 D556 L559	G547-N551 WeakPolarHBondContact O-CB 3.16Å; G547-N551 PolarHBondContact O-N 3.24Å; I548-N551 CarbonylContact O-C 3.59Å; I548-N551 PolarHBondContact O-N 3.48Å; H549-N551 VanDerWaalsContact C-N 3.26Å; H549-N551 PolarHBondContact O-N 3.09Å; N551-W553 PolarHBondContact O-N 2.03Å; N551-W553 VanDerWaalsContact O-N 3.16Å; N551-Q554 PolarHBondContact ND2-O 2.72Å; N551-Q554 PolarHBondContact O-N 2.93Å; N551-Q554 VanDerWaalsContact O-N 3.09Å; N551-D556 PolarHBondContact ND2-OD2 2.9Å; N551-L559 HydrophobicContact CB-CD2 4.1Å
552	K	90	Very high	90.7	Very high	170 Å²	170	63.2 Å²	63.2	74%	0.739	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	38.4	175.4	-56.6	-177.9	-179.9	179.9	0	113.6	I548 H549 I550 Q554	I548-K552 PolarHBondContact O-N 2.58Å; H549-K552 PolarHBondContact O-N 2.91Å; H549-K552 VanDerWaalsContact O-N 3.09Å; I550-K552 PolarHBondContact O-N 3.4Å; I550-K552 VanDerWaalsContact O-N 3.13Å; K552-Q554 PolarHBondContact O-N 2.98Å
553	W	88.9	Confident	90.7	Very high	40 Å²	40	60.8 Å²	60.8	15%	0.152	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	25.9	177.7	-46.8	89.7	0	0	0	114.2	L208 W210 V213 I548 H549 N551	L208-W553 PolarHBondContact N-O 2.84Å; L208-W553 WeakPolarHBondContact O-CB 3.09Å; W210-W553 HydrophobicContact CB-CD2 4.03Å; W210-W553 HydrophobicContact CB-CE3 4.22Å; W210-W553 HydrophobicContact CB-CH2 4.36Å; W210-W553 HydrophobicContact CB-CZ2 4.25Å; W210-W553 HydrophobicContact CB-CZ3 4.37Å; W210-W553 AromaticContact CD1-CE2 3.17Å; W210-W553 AromaticContact CD1-CH2 3.39Å; W210-W553 AromaticContact CD1-CZ2 2.83Å; W210-W553 AromaticContact CD1-NE1 3.56Å; W210-W553 HydrophobicContact CG-CD2 4.38Å; W210-W553 AromaticContact CG-CE2 3.92Å; W210-W553 AromaticContact CG-CH2 3.89Å; W210-W553 HydrophobicContact CG-CH2 3.89Å; W210-W553 AromaticContact CG-CZ2 3.7Å; W210-W553 HydrophobicContact CG-CZ2 3.7Å; W210-W553 HydrophobicContact CG-CZ3 4.35Å; W210-W553 AromaticContact NE1-CH2 3.67Å; W210-W553 AromaticContact NE1-CZ2 3.26Å; W210-W553 VanDerWaalsContact NE1-CZ2 3.26Å; V213-W553 HydrophobicContact CB-CE3 4.44Å; V213-W553 HydrophobicContact CB-CZ3 3.82Å; V213-W553 HydrophobicContact CG1-CZ3 3.89Å; V213-W553 HydrophobicContact CG2-CZ3 4.38Å; I548-W553 HydrophobicContact CG2-CD2 4.49Å; I548-W553 HydrophobicContact CG2-CE3 3.82Å; I548-W553 HydrophobicContact CG2-CZ3 4.15Å; I548-W553 PolarHBondContact O-N 3.15Å; H549-W553 HydrophobicContact CB-CH2 4.48Å; H549-W553 HydrophobicContact CB-CZ2 4Å; H549-W553 AromaticContact CD2-CZ2 3.44Å; H549-W553 VanDerWaalsContact CD2-CZ2 3.44Å; H549-W553 WeakPolarHBondContact CD2-CZ2 3.01Å; H549-W553 AromaticContact CG-CZ2 3.91Å; N551-W553 PolarHBondContact O-N 2.03Å; N551-W553 VanDerWaalsContact O-N 3.16Å
554	Q	88.8	Confident	90.7	Very high	82 Å²	82	59.6 Å²	59.6	38%	0.383	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.8	173.3	-64.2	-176.7	-13.5	0	0	108.9	V205 N551 K552 D556	V205-Q554 HydrophobicContact CG1-CB 3.92Å; V205-Q554 HydrophobicContact CG1-CG 4.28Å; N551-Q554 PolarHBondContact ND2-O 2.72Å; N551-Q554 PolarHBondContact O-N 2.93Å; N551-Q554 VanDerWaalsContact O-N 3.09Å; K552-Q554 PolarHBondContact O-N 2.98Å; Q554-D556 PolarHBondContact O-N 3.34Å
555	L	86.8	Confident	90.8	Very high	3 Å²	3	63.5 Å²	63.5	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	92.5	173.2	-167.7	85.4	0	0	0	108.6	I195 C198 V206 L208 L559	I195-L555 HydrophobicContact CG2-CD1 3.53Å; C198-L555 HydrophobicContact CB-CD2 3.88Å; V206-L555 HydrophobicContact CB-CB 4.1Å; V206-L555 HydrophobicContact CB-CD2 4.42Å; V206-L555 PolarHBondContact N-O 3.3Å; V206-L555 WeakPolarHBondContact O-CB 3.19Å; V206-L555 PolarHBondContact O-N 3.22Å; L208-L555 HydrophobicContact CD1-CB 4.49Å; L555-L559 HydrophobicContact CD1-CD2 4.05Å
556	D	90.7	Very high	90.9	Very high	37 Å²	37	63 Å²	63	20%	0.198	31%	0.306	C	S	.	.			trans	-98.2	164.7	178.3	-66	-42.4	0	0	0	112.3	V205 N551 Q554 K558 L559 G560	V205-D556 VanDerWaalsContact CG1-OD1 3.25Å; V205-D556 WeakPolarHBondContact CG1-OD1 3.24Å; V205-D556 VanDerWaalsContact CG2-OD1 3.27Å; V205-D556 WeakPolarHBondContact CG2-OD1 3.4Å; N551-D556 PolarHBondContact ND2-OD2 2.9Å; Q554-D556 PolarHBondContact O-N 3.34Å; D556-K558 PolarHBondContact O-N 3.1Å; D556-K558 VanDerWaalsContact O-N 3.14Å; D556-L559 PolarHBondContact O-N 3.19Å; D556-G560 PolarHBondContact O-N 3.49Å
557	L	90.3	Very high	90.9	Very high	98 Å²	98	59.4 Å²	59.4	51%	0.513	29%	0.286	S	S	.	.	H	α-helix	trans	-49.2	-40.3	171.2	-179.7	67.9	0	0	0	112.6	G199 I200 G560 I561	G199-L557 WeakPolarHBondContact O-CA 3.37Å; G199-L557 PolarHBondContact O-N 3.41Å; I200-L557 HydrophobicContact CB-CD1 4.05Å; I200-L557 HydrophobicContact CG1-CD1 3.96Å; I200-L557 HydrophobicContact CG2-CD1 3.88Å; L557-G560 PolarHBondContact O-N 2.95Å; L557-I561 HydrophobicContact CD1-CD1 4.39Å; L557-I561 HydrophobicContact CG-CD1 4.18Å; L557-I561 WeakPolarHBondContact O-CG1 3.23Å; L557-I561 PolarHBondContact O-N 3.11Å
558	K	91.6	Very high	90.9	Very high	171 Å²	171	61.7 Å²	61.7	74%	0.743	31%	0.305	S	S	*	.	H	α-helix	trans	-64.1	-45.6	179.9	-66.1	-178.9	-178.4	177.5	0	111.8	D556 G560 I561 Y562	D556-K558 PolarHBondContact O-N 3.1Å; D556-K558 VanDerWaalsContact O-N 3.14Å; K558-G560 VanDerWaalsContact C-N 3.34Å; K558-I561 PolarHBondContact O-N 3.5Å; K558-Y562 PolarHBondContact O-N 3.4Å
559	L	91.3	Very high	90.9	Very high	9 Å²	9	64.6 Å²	64.6	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-40.8	177.1	-176.1	63.5	0	0	0	110.1	I548 N551 L555 D556 I561 Y562 V563	I548-L559 HydrophobicContact CB-CD2 4.45Å; I548-L559 HydrophobicContact CG1-CD2 3.88Å; N551-L559 HydrophobicContact CB-CD2 4.1Å; L555-L559 HydrophobicContact CD1-CD2 4.05Å; D556-L559 PolarHBondContact O-N 3.19Å; L559-I561 PolarHBondContact O-N 2.88Å; L559-Y562 HydrophobicContact CD1-CD1 3.99Å; L559-Y562 WeakPolarHBondContact O-CB 3.32Å; L559-Y562 PolarHBondContact O-N 3.26Å; L559-V563 HydrophobicContact CD1-CG2 4.26Å; L559-V563 HydrophobicContact CG-CG2 4.38Å; L559-V563 VanDerWaalsContact O-CG2 3.31Å; L559-V563 WeakPolarHBondContact O-CG2 3.43Å; L559-V563 PolarHBondContact O-N 3Å
560	G	90.9	Very high	90.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-44.2	175.9	0	0	0	0	0	113.5	G196 D556 L557 K558 V563 L564	G196-G560 WeakPolarHBondContact CA-O 3.15Å; D556-G560 PolarHBondContact O-N 3.49Å; L557-G560 PolarHBondContact O-N 2.95Å; K558-G560 VanDerWaalsContact C-N 3.34Å; G560-V563 PolarHBondContact O-N 3.21Å; G560-L564 PolarHBondContact O-N 3.41Å; G560-L564 VanDerWaalsContact O-N 3.08Å
561	I	92.1	Very high	90.7	Very high	87 Å²	87	55.6 Å²	55.6	45%	0.446	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-44.5	174.9	-66.1	167.2	0	0	0	111	I200 L557 K558 L559 V563 L564 V565	I200-I561 HydrophobicContact CD1-CG1 3.97Å; I200-I561 HydrophobicContact CG1-CG1 4.18Å; L557-I561 HydrophobicContact CD1-CD1 4.39Å; L557-I561 HydrophobicContact CG-CD1 4.18Å; L557-I561 WeakPolarHBondContact O-CG1 3.23Å; L557-I561 PolarHBondContact O-N 3.11Å; K558-I561 PolarHBondContact O-N 3.5Å; L559-I561 PolarHBondContact O-N 2.88Å; I561-V563 VanDerWaalsContact C-N 3.33Å; I561-V563 PolarHBondContact O-N 3.13Å; I561-L564 PolarHBondContact O-N 3.31Å; I561-V565 HydrophobicContact CG2-CG2 4.4Å; I561-V565 WeakPolarHBondContact O-CG2 3.47Å; I561-V565 PolarHBondContact O-N 3.24Å
562	Y	94.4	Very high	90.6	Very high	95 Å²	95	55.9 Å²	55.9	37%	0.373	28%	0.283	S	S	.	.	H	α-helix	trans	-55.5	-47.8	177.2	164.9	-97.3	0	0	0	111.9	K558 L559 V565 L566	K558-Y562 PolarHBondContact O-N 3.4Å; L559-Y562 HydrophobicContact CD1-CD1 3.99Å; L559-Y562 WeakPolarHBondContact O-CB 3.32Å; L559-Y562 PolarHBondContact O-N 3.26Å; Y562-V565 PolarHBondContact O-N 3.05Å; Y562-L566 PolarHBondContact O-N 3.2Å
563	V	92.5	Very high	90.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-68.6	-37.4	-178.5	-177.8	0	0	0	0	111.6	L192 T544 L559 G560 I561 L566 Y567	L192-V563 VanDerWaalsContact CA-CG1 3.43Å; L192-V563 HydrophobicContact CB-CG1 3.97Å; L192-V563 HydrophobicContact CD2-CG1 3.71Å; L192-V563 HydrophobicContact CG-CG1 4.49Å; L192-V563 WeakPolarHBondContact O-CG1 3.36Å; T544-V563 HydrophobicContact CG2-CG1 4.39Å; T544-V563 HydrophobicContact CG2-CG2 4.26Å; L559-V563 HydrophobicContact CD1-CG2 4.26Å; L559-V563 HydrophobicContact CG-CG2 4.38Å; L559-V563 VanDerWaalsContact O-CG2 3.31Å; L559-V563 WeakPolarHBondContact O-CG2 3.43Å; L559-V563 PolarHBondContact O-N 3Å; G560-V563 PolarHBondContact O-N 3.21Å; I561-V563 VanDerWaalsContact C-N 3.33Å; I561-V563 PolarHBondContact O-N 3.13Å; V563-L566 WeakPolarHBondContact O-CB 3.48Å; V563-L566 PolarHBondContact O-N 2.78Å; V563-Y567 PolarHBondContact O-N 2.97Å
564	L	91.2	Very high	90.4	Very high	49 Å²	49	50.2 Å²	50.2	26%	0.257	26%	0.26	S	S	.	.	H	α-helix	trans	-66.4	-36.2	173.3	-81.6	-174.8	0	0	0	113.3	I200 G560 I561 L566 Y567 A568	I200-L564 HydrophobicContact CD1-CD1 3.41Å; I200-L564 VanDerWaalsContact CD1-CD1 3.41Å; I200-L564 HydrophobicContact CD1-CG 4.36Å; G560-L564 PolarHBondContact O-N 3.41Å; G560-L564 VanDerWaalsContact O-N 3.08Å; I561-L564 PolarHBondContact O-N 3.31Å; L564-L566 VanDerWaalsContact C-N 3.31Å; L564-Y567 WeakPolarHBondContact O-CB 3.18Å; L564-Y567 PolarHBondContact O-N 3.37Å; L564-A568 PolarHBondContact O-N 3.26Å; L564-A568 VanDerWaalsContact O-N 3.08Å
565	V	92.5	Very high	90.2	Very high	85 Å²	85	46.8 Å²	46.8	52%	0.515	24%	0.244	S	C	.	.	H	α-helix	trans	-64.3	-41.7	172.9	170.5	0	0	0	0	109.9	I561 Y562 Y567 A568 V569	I561-V565 HydrophobicContact CG2-CG2 4.4Å; I561-V565 WeakPolarHBondContact O-CG2 3.47Å; I561-V565 PolarHBondContact O-N 3.24Å; Y562-V565 PolarHBondContact O-N 3.05Å; V565-Y567 VanDerWaalsContact C-N 3.28Å; V565-Y567 PolarHBondContact O-N 2.89Å; V565-A568 PolarHBondContact O-N 3.36Å; V565-V569 HydrophobicContact CG1-CG2 4.45Å; V565-V569 WeakPolarHBondContact O-CG2 3.35Å; V565-V569 PolarHBondContact O-N 3.04Å
566	L	92.3	Very high	90.1	Very high	26 Å²	26	47.8 Å²	47.8	14%	0.136	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-38.6	175.1	-174	62.3	0	0	0	111.9	L192 L543 Y562 V563 L564 V569 F570	L192-L566 HydrophobicContact CD1-CG 4.35Å; L192-L566 HydrophobicContact CD2-CB 4.41Å; L192-L566 HydrophobicContact CD2-CD2 3.71Å; L192-L566 HydrophobicContact CD2-CG 4.07Å; L543-L566 HydrophobicContact CB-CD2 3.76Å; L543-L566 HydrophobicContact CD1-CD1 3.78Å; L543-L566 HydrophobicContact CD1-CD2 4.28Å; Y562-L566 PolarHBondContact O-N 3.2Å; V563-L566 WeakPolarHBondContact O-CB 3.48Å; V563-L566 PolarHBondContact O-N 2.78Å; L564-L566 VanDerWaalsContact C-N 3.31Å; L566-V569 PolarHBondContact O-N 3.46Å; L566-F570 WeakPolarHBondContact O-CB 3.49Å; L566-F570 PolarHBondContact O-N 3.11Å
567	Y	91.9	Very high	89.8	Confident	17 Å²	17	47 Å²	47	7%	0.067	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-47.9	172.8	-178.8	-116.9	0	0	0	112.6	V188 F189 L192 V563 L564 V565 V569 F570 L571	V188-Y567 HydrophobicContact CG1-CD2 3.98Å; V188-Y567 HydrophobicContact CG1-CE2 4.14Å; F189-Y567 HydrophobicContact CD2-CE2 4.36Å; F189-Y567 AromaticContact CD2-CZ 3.94Å; F189-Y567 WeakPolarHBondContact CD2-OH 3.48Å; L192-Y567 HydrophobicContact CB-CD2 4.02Å; L192-Y567 HydrophobicContact CB-CG 4.26Å; L192-Y567 HydrophobicContact CD1-CD2 4.21Å; V563-Y567 PolarHBondContact O-N 2.97Å; L564-Y567 WeakPolarHBondContact O-CB 3.18Å; L564-Y567 PolarHBondContact O-N 3.37Å; V565-Y567 VanDerWaalsContact C-N 3.28Å; V565-Y567 PolarHBondContact O-N 2.89Å; Y567-V569 VanDerWaalsContact C-N 3.31Å; Y567-V569 PolarHBondContact O-N 3.39Å; Y567-F570 PolarHBondContact O-N 3.07Å; Y567-L571 HydrophobicContact CD1-CD1 4.1Å; Y567-L571 HydrophobicContact CD2-CG 4.42Å; Y567-L571 HydrophobicContact CE1-CD1 3.47Å; Y567-L571 VanDerWaalsContact CE1-CD1 3.47Å; Y567-L571 HydrophobicContact CE1-CG 4.19Å; Y567-L571 HydrophobicContact CE2-CD1 4.12Å; Y567-L571 HydrophobicContact CE2-CD2 4.21Å; Y567-L571 HydrophobicContact CE2-CG 3.99Å; Y567-L571 VanDerWaalsContact CZ-CD1 3.47Å; Y567-L571 PolarHBondContact O-N 3.07Å
568	A	89.6	Confident	89.4	Confident	58 Å²	58	42.6 Å²	42.6	48%	0.479	22%	0.222	S	C	.	.	H	α-helix	trans	-62.8	-38.8	178.6	0	0	0	0	0	112	L564 V565 C572	L564-A568 PolarHBondContact O-N 3.26Å; L564-A568 VanDerWaalsContact O-N 3.08Å; V565-A568 PolarHBondContact O-N 3.36Å; A568-C572 WeakPolarHBondContact O-CB 3.31Å; A568-C572 PolarHBondContact O-N 3.1Å
569	V	90.3	Very high	89	Confident	63 Å²	63	37.3 Å²	37.3	38%	0.382	20%	0.197	S	C	.	.	H	α-helix	trans	-63.7	-48.3	174.5	171.2	0	0	0	0	110.7	V565 L566 Y567 L571 C572 F573	V565-V569 HydrophobicContact CG1-CG2 4.45Å; V565-V569 WeakPolarHBondContact O-CG2 3.35Å; V565-V569 PolarHBondContact O-N 3.04Å; L566-V569 PolarHBondContact O-N 3.46Å; Y567-V569 VanDerWaalsContact C-N 3.31Å; Y567-V569 PolarHBondContact O-N 3.39Å; V569-L571 PolarHBondContact O-N 2.95Å; V569-C572 PolarHBondContact O-N 2.73Å; V569-F573 HydrophobicContact CG1-CD2 3.63Å; V569-F573 HydrophobicContact CG1-CE2 3.73Å; V569-F573 WeakPolarHBondContact O-CD2 3.47Å; V569-F573 PolarHBondContact O-N 3.41Å
570	F	90.6	Very high	88.4	Confident	12 Å²	12	39 Å²	39	5%	0.053	21%	0.206	C	C	.	.	H	α-helix	trans	-55.6	-49.4	176.7	171.4	-84	0	0	0	111.8	V188 L192 L536 L566 Y567 C572 F573 S574	V188-F570 HydrophobicContact CB-CD1 4.4Å; V188-F570 HydrophobicContact CB-CE1 4.08Å; V188-F570 HydrophobicContact CB-CZ 4.3Å; V188-F570 HydrophobicContact CG1-CD1 3.52Å; V188-F570 HydrophobicContact CG1-CD2 4.29Å; V188-F570 HydrophobicContact CG1-CE1 3.69Å; V188-F570 HydrophobicContact CG1-CE2 4.42Å; V188-F570 HydrophobicContact CG1-CG 3.86Å; V188-F570 HydrophobicContact CG1-CZ 4.16Å; V188-F570 HydrophobicContact CG2-CD1 4.33Å; V188-F570 HydrophobicContact CG2-CD2 4.42Å; V188-F570 HydrophobicContact CG2-CE1 3.72Å; V188-F570 HydrophobicContact CG2-CE2 3.8Å; V188-F570 HydrophobicContact CG2-CZ 3.44Å; V188-F570 VanDerWaalsContact CG2-CZ 3.44Å; L192-F570 HydrophobicContact CD1-CB 4.35Å; L536-F570 HydrophobicContact CB-CD2 3.85Å; L536-F570 HydrophobicContact CB-CE2 3.57Å; L566-F570 WeakPolarHBondContact O-CB 3.49Å; L566-F570 PolarHBondContact O-N 3.11Å; Y567-F570 PolarHBondContact O-N 3.07Å; F570-C572 VanDerWaalsContact C-N 3.33Å; F570-C572 PolarHBondContact O-N 3.42Å; F570-F573 PolarHBondContact O-N 2.93Å; F570-S574 VanDerWaalsContact CE1-OG 3.32Å; F570-S574 WeakPolarHBondContact CE1-OG 3.39Å; F570-S574 VanDerWaalsContact CZ-OG 3.3Å; F570-S574 WeakPolarHBondContact CZ-OG 3.37Å; F570-S574 WeakPolarHBondContact O-CB 3.24Å; F570-S574 PolarHBondContact O-N 2.91Å; F570-S574 PolarHBondContact O-OG 3.27Å
571	L	88	Confident	87.9	Confident	23 Å²	23	41.9 Å²	41.9	12%	0.12	22%	0.224	C	C	.	.	H	α-helix	trans	-61	-44.3	-180	-76.6	-175.3	0	0	0	111.4	T464 Y567 V569 S574 I575	T464-L571 HydrophobicContact CG2-CD2 3.72Å; Y567-L571 HydrophobicContact CD1-CD1 4.1Å; Y567-L571 HydrophobicContact CD2-CG 4.42Å; Y567-L571 HydrophobicContact CE1-CD1 3.47Å; Y567-L571 VanDerWaalsContact CE1-CD1 3.47Å; Y567-L571 HydrophobicContact CE1-CG 4.19Å; Y567-L571 HydrophobicContact CE2-CD1 4.12Å; Y567-L571 HydrophobicContact CE2-CD2 4.21Å; Y567-L571 HydrophobicContact CE2-CG 3.99Å; Y567-L571 VanDerWaalsContact CZ-CD1 3.47Å; Y567-L571 PolarHBondContact O-N 3.07Å; V569-L571 PolarHBondContact O-N 2.95Å; L571-S574 PolarHBondContact O-N 3.29Å; L571-I575 WeakPolarHBondContact O-CB 3.18Å; L571-I575 WeakPolarHBondContact O-CD1 3.3Å; L571-I575 VanDerWaalsContact O-CG1 3.22Å; L571-I575 WeakPolarHBondContact O-CG1 3.24Å; L571-I575 PolarHBondContact O-N 3.03Å
572	C	87.6	Confident	87	Confident	48 Å²	48	43.4 Å²	43.4	32%	0.324	23%	0.228	S	C	.	.	H	α-helix	trans	-59.8	-50.4	178.1	-173.2	0	0	0	0	111.3	A568 V569 F570 S574 I575 L576	A568-C572 WeakPolarHBondContact O-CB 3.31Å; A568-C572 PolarHBondContact O-N 3.1Å; V569-C572 PolarHBondContact O-N 2.73Å; F570-C572 VanDerWaalsContact C-N 3.33Å; F570-C572 PolarHBondContact O-N 3.42Å; C572-S574 PolarHBondContact O-N 3.28Å; C572-I575 PolarHBondContact O-N 2.73Å; C572-L576 WeakPolarHBondContact O-CB 3.47Å; C572-L576 WeakPolarHBondContact O-CG 3.49Å; C572-L576 PolarHBondContact O-N 3.07Å
573	F	88.4	Confident	85.9	Confident	91 Å²	91	42.2 Å²	42.2	40%	0.399	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-41.7	178.3	-86.6	-75.9	0	0	0	112.6	L536 V569 F570 I575 L576 I577 F582	L536-F573 HydrophobicContact CD1-CB 4.18Å; V569-F573 HydrophobicContact CG1-CD2 3.63Å; V569-F573 HydrophobicContact CG1-CE2 3.73Å; V569-F573 WeakPolarHBondContact O-CD2 3.47Å; V569-F573 PolarHBondContact O-N 3.41Å; F570-F573 PolarHBondContact O-N 2.93Å; F573-I575 PolarHBondContact O-N 3.36Å; F573-L576 PolarHBondContact O-N 3.31Å; F573-I577 WeakPolarHBondContact O-CB 3.47Å; F573-I577 WeakPolarHBondContact O-CD1 3.17Å; F573-I577 VanDerWaalsContact O-CG1 3.24Å; F573-I577 WeakPolarHBondContact O-CG1 3.5Å; F573-I577 PolarHBondContact O-N 3.27Å; F573-F582 AromaticContact CD1-CE2 3.99Å; F573-F582 HydrophobicContact CD1-CE2 3.99Å; F573-F582 HydrophobicContact CD1-CZ 4.37Å; F573-F582 HydrophobicContact CE1-CE2 4.15Å; F573-F582 HydrophobicContact CE1-CZ 4.06Å
574	S	86.3	Confident	84.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-43.6	179.4	-54.2	0	0	0	0	111.4	F570 L571 C572 I577 E578	F570-S574 VanDerWaalsContact CE1-OG 3.32Å; F570-S574 WeakPolarHBondContact CE1-OG 3.39Å; F570-S574 VanDerWaalsContact CZ-OG 3.3Å; F570-S574 WeakPolarHBondContact CZ-OG 3.37Å; F570-S574 WeakPolarHBondContact O-CB 3.24Å; F570-S574 PolarHBondContact O-N 2.91Å; F570-S574 PolarHBondContact O-OG 3.27Å; L571-S574 PolarHBondContact O-N 3.29Å; C572-S574 PolarHBondContact O-N 3.28Å; S574-I577 PolarHBondContact O-N 2.67Å; S574-E578 PolarHBondContact O-N 3.2Å; S574-E578 VanDerWaalsContact O-N 3.1Å
575	I	85.1	Confident	83.9	Confident	10 Å²	10	48 Å²	48	5%	0.051	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-43.7	175.6	-68.1	167.3	0	0	0	110.9	L51 I460 T464 L571 C572 F573 I577 E578 Y579	L51-I575 HydrophobicContact CD1-CG2 4.4Å; I460-I575 HydrophobicContact CG2-CG1 4.28Å; T464-I575 HydrophobicContact CG2-CD1 4.47Å; L571-I575 WeakPolarHBondContact O-CB 3.18Å; L571-I575 WeakPolarHBondContact O-CD1 3.3Å; L571-I575 VanDerWaalsContact O-CG1 3.22Å; L571-I575 WeakPolarHBondContact O-CG1 3.24Å; L571-I575 PolarHBondContact O-N 3.03Å; C572-I575 PolarHBondContact O-N 2.73Å; F573-I575 PolarHBondContact O-N 3.36Å; I575-I577 VanDerWaalsContact C-N 3.34Å; I575-I577 PolarHBondContact O-N 3.05Å; I575-E578 PolarHBondContact O-N 3.04Å; I575-Y579 HydrophobicContact CG2-CD2 3.65Å; I575-Y579 HydrophobicContact CG2-CE2 3.81Å; I575-Y579 VanDerWaalsContact O-CD2 3.32Å; I575-Y579 WeakPolarHBondContact O-CD2 3.11Å; I575-Y579 PolarHBondContact O-N 2.71Å
576	L	85.3	Confident	82.9	Confident	25 Å²	25	44.9 Å²	44.9	13%	0.131	24%	0.235	C	C	.	.	H	α-helix	trans	-64.3	-36.7	179.1	-71.4	171	0	0	0	112.9	L51 C572 F573 V581 F582	L51-L576 HydrophobicContact CD1-CD2 3.79Å; L51-L576 HydrophobicContact CD2-CD2 3.57Å; L51-L576 HydrophobicContact CG-CD2 4.3Å; C572-L576 WeakPolarHBondContact O-CB 3.47Å; C572-L576 WeakPolarHBondContact O-CG 3.49Å; C572-L576 PolarHBondContact O-N 3.07Å; F573-L576 PolarHBondContact O-N 3.31Å; L576-V581 HydrophobicContact CB-CB 4.43Å; L576-V581 HydrophobicContact CD2-CB 4.27Å; L576-V581 HydrophobicContact CD2-CG1 4.29Å; L576-V581 HydrophobicContact CD2-CG2 3.92Å; L576-V581 WeakPolarHBondContact O-CB 3.41Å; L576-V581 WeakPolarHBondContact O-CG2 3.38Å; L576-V581 PolarHBondContact O-N 2.97Å; L576-F582 HydrophobicContact CB-CD2 4.08Å; L576-F582 HydrophobicContact CB-CE2 3.6Å; L576-F582 HydrophobicContact CD1-CE2 3.8Å; L576-F582 HydrophobicContact CD1-CZ 4.04Å; L576-F582 HydrophobicContact CG-CE2 4.31Å
577	I	84.3	Confident	81.7	Confident	19 Å²	19	47.1 Å²	47.1	10%	0.097	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-46.7	176.1	-71.7	165.2	0	0	0	110.1	Y532 L536 F573 S574 I575 Y579 N580 F582 V585	Y532-I577 HydrophobicContact CD2-CG2 4.18Å; Y532-I577 HydrophobicContact CG-CG2 4.4Å; L536-I577 HydrophobicContact CD1-CD1 3.78Å; F573-I577 WeakPolarHBondContact O-CB 3.47Å; F573-I577 WeakPolarHBondContact O-CD1 3.17Å; F573-I577 VanDerWaalsContact O-CG1 3.24Å; F573-I577 WeakPolarHBondContact O-CG1 3.5Å; F573-I577 PolarHBondContact O-N 3.27Å; S574-I577 PolarHBondContact O-N 2.67Å; I575-I577 VanDerWaalsContact C-N 3.34Å; I575-I577 PolarHBondContact O-N 3.05Å; I577-Y579 VanDerWaalsContact C-N 3.31Å; I577-Y579 PolarHBondContact O-N 2.83Å; I577-N580 PolarHBondContact O-N 3.23Å; I577-F582 HydrophobicContact CG1-CD2 4.33Å; I577-V585 HydrophobicContact CG2-CG1 4.39Å; I577-V585 HydrophobicContact CG2-CG2 4.42Å
578	E	82.1	Confident	80.7	Confident	7 Å²	7	50 Å²	50	3%	0.033	27%	0.268	C	S	.	.	H	α-helix	trans	-67.4	-32.4	-177.5	-155.9	74.6	-175.3	0	0	112.5	P457 V459 I460 S527 G529 S574 I575 N580 N586	P457-E578 HydrophobicContact CB-CG 4.24Å; P457-E578 HydrophobicContact CG-CG 4.43Å; V459-E578 VanDerWaalsContact CB-OE1 3.32Å; V459-E578 WeakPolarHBondContact CB-OE1 3.39Å; V459-E578 WeakPolarHBondContact CG2-OE1 3.42Å; I460-E578 HydrophobicContact CD1-CB 3.65Å; I460-E578 HydrophobicContact CD1-CG 3.86Å; I460-E578 HydrophobicContact CG1-CB 3.81Å; I460-E578 HydrophobicContact CG1-CG 3.86Å; S527-E578 PolarHBondContact OG-OE1 3.28Å; S527-E578 PolarHBondContact OG-OE2 3.09Å; G529-E578 WeakPolarHBondContact CA-OE2 3.45Å; S574-E578 PolarHBondContact O-N 3.2Å; S574-E578 VanDerWaalsContact O-N 3.1Å; I575-E578 PolarHBondContact O-N 3.04Å; E578-N580 PolarHBondContact O-N 3.39Å; E578-N586 PolarHBondContact OE1-ND2 3.36Å; E578-N586 PolarHBondContact OE2-ND2 3.16Å; E578-N586 VanDerWaalsContact OE2-ND2 3.11Å
579	Y	81.6	Confident	79.8	Confident	60 Å²	60	49.2 Å²	49.2	24%	0.235	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	12.2	173	-82.1	-65.5	0	0	0	114.2	S48 L51 I460 I575 I577 V581	S48-Y579 PolarHBondContact OG-OH 3.19Å; L51-Y579 HydrophobicContact CD1-CD2 4.28Å; I460-Y579 HydrophobicContact CD1-CD2 3.89Å; I460-Y579 HydrophobicContact CD1-CE2 3.6Å; I575-Y579 HydrophobicContact CG2-CD2 3.65Å; I575-Y579 HydrophobicContact CG2-CE2 3.81Å; I575-Y579 VanDerWaalsContact O-CD2 3.32Å; I575-Y579 WeakPolarHBondContact O-CD2 3.11Å; I575-Y579 PolarHBondContact O-N 2.71Å; I577-Y579 VanDerWaalsContact C-N 3.31Å; I577-Y579 PolarHBondContact O-N 2.83Å; Y579-V581 PolarHBondContact O-N 2.77Å
580	N	80.4	Confident	79.1	Confident	43 Å²	43	47.6 Å²	47.6	23%	0.23	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	26.3	178.3	-57.5	-52.1	0	0	0	115.3	I577 E578 T583 V585 N586	I577-N580 PolarHBondContact O-N 3.23Å; E578-N580 PolarHBondContact O-N 3.39Å; N580-T583 VanDerWaalsContact CA-O 3.28Å; N580-T583 WeakPolarHBondContact CA-O 3.25Å; N580-V585 WeakPolarHBondContact OD1-CA 3.48Å; N580-V585 PolarHBondContact OD1-N 3.2Å; N580-N586 PolarHBondContact ND2-O 2.94Å; N580-N586 PolarHBondContact OD1-N 2.97Å; N580-N586 PolarHBondContact OD1-O 3.1Å
581	V	79.4	Confident	78	Confident	62 Å²	62	51.1 Å²	51.1	38%	0.376	26%	0.264	S	S	.	.	S	Bend	trans	-68.8	-39.9	-175.5	178.5	0	0	0	0	111.6	L51 L576 Y579	L51-V581 HydrophobicContact CD2-CG2 3.97Å; L576-V581 HydrophobicContact CB-CB 4.43Å; L576-V581 HydrophobicContact CD2-CB 4.27Å; L576-V581 HydrophobicContact CD2-CG1 4.29Å; L576-V581 HydrophobicContact CD2-CG2 3.92Å; L576-V581 WeakPolarHBondContact O-CB 3.41Å; L576-V581 WeakPolarHBondContact O-CG2 3.38Å; L576-V581 PolarHBondContact O-N 2.97Å; Y579-V581 PolarHBondContact O-N 2.77Å
582	F	74.1	Confident	76.9	Confident	119 Å²	119	55.6 Å²	55.6	52%	0.522	28%	0.284	S	S	.	.	S	Bend	trans	-92.9	-40	-178	-66.1	-67.2	0	0	0	113.2	F573 L576 I577	F573-F582 AromaticContact CD1-CE2 3.99Å; F573-F582 HydrophobicContact CD1-CE2 3.99Å; F573-F582 HydrophobicContact CD1-CZ 4.37Å; F573-F582 HydrophobicContact CE1-CE2 4.15Å; F573-F582 HydrophobicContact CE1-CZ 4.06Å; L576-F582 HydrophobicContact CB-CD2 4.08Å; L576-F582 HydrophobicContact CB-CE2 3.6Å; L576-F582 HydrophobicContact CD1-CE2 3.8Å; L576-F582 HydrophobicContact CD1-CZ 4.04Å; L576-F582 HydrophobicContact CG-CE2 4.31Å; I577-F582 HydrophobicContact CG1-CD2 4.33Å
583	T	69.7	Low	74.9	Confident	69 Å²	69	63.4 Å²	63.4	42%	0.423	32%	0.322	S	S	.	.	S	Bend	trans	-149	147.5	-174.4	45.5	0	0	0	0	108.7	N580 V585	N580-T583 VanDerWaalsContact CA-O 3.28Å; N580-T583 WeakPolarHBondContact CA-O 3.25Å; T583-V585 WeakPolarHBondContact O-CG2 3.48Å; T583-V585 PolarHBondContact O-N 3.01Å; T583-V585 WeakPolarHBondContact OG1-CG2 3.48Å
584	F	71.1	Confident	74.2	Confident	157 Å²	157	62.1 Å²	62.1	69%	0.689	32%	0.319	S	S	*	.			trans	-73.8	108.7	172.3	-170.9	-95.8	0	0	0	109.4	L587	F584-L587 HydrophobicContact CZ-CD2 4.03Å
585	V	71.1	Confident	73.6	Confident	14 Å²	14	65.3 Å²	65.3	9%	0.085	34%	0.335	C	S	.	.			trans	-122.4	-36.4	-168.6	173.5	0	0	0	0	110.7	R528 Y532 I577 N580 T583	R528-V585 HydrophobicContact CB-CG1 3.82Å; Y532-V585 HydrophobicContact CD2-CG1 4.32Å; Y532-V585 HydrophobicContact CD2-CG2 4.36Å; Y532-V585 HydrophobicContact CE2-CG1 4.42Å; Y532-V585 HydrophobicContact CE2-CG2 3.98Å; I577-V585 HydrophobicContact CG2-CG1 4.39Å; I577-V585 HydrophobicContact CG2-CG2 4.42Å; N580-V585 WeakPolarHBondContact OD1-CA 3.48Å; N580-V585 PolarHBondContact OD1-N 3.2Å; T583-V585 WeakPolarHBondContact O-CG2 3.48Å; T583-V585 PolarHBondContact O-N 3.01Å; T583-V585 WeakPolarHBondContact OG1-CG2 3.48Å
586	N	71	Confident	73	Confident	19 Å²	19	68.4 Å²	68.4	10%	0.102	35%	0.351	C	S	.	.	S	Bend	trans	-133	150.7	-179.5	-68.6	-44.8	0	0	0	113.2	S527 E578 N580	S527-N586 VanDerWaalsContact CA-OD1 3.23Å; S527-N586 WeakPolarHBondContact CA-OD1 3.22Å; S527-N586 VanDerWaalsContact CB-OD1 3.24Å; S527-N586 WeakPolarHBondContact CB-OD1 3.32Å; S527-N586 PolarHBondContact OG-ND2 2.95Å; S527-N586 VanDerWaalsContact OG-ND2 3.11Å; S527-N586 PolarHBondContact OG-OD1 3.19Å; E578-N586 PolarHBondContact OE1-ND2 3.36Å; E578-N586 PolarHBondContact OE2-ND2 3.16Å; E578-N586 VanDerWaalsContact OE2-ND2 3.11Å; N580-N586 PolarHBondContact ND2-O 2.94Å; N580-N586 PolarHBondContact OD1-N 2.97Å; N580-N586 PolarHBondContact OD1-O 3.1Å
587	L	68.6	Low	72.2	Confident	73 Å²	73	70.9 Å²	70.9	38%	0.382	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-75.1	147	168.3	-68.5	156.3	0	0	0	109.9	N86 F584	N86-L587 WeakPolarHBondContact O-CD2 3.4Å; F584-L587 HydrophobicContact CZ-CD2 4.03Å
588	P	70	Confident	71.5	Confident	78 Å²	78	74.2 Å²	74.2	51%	0.506	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-62.1	149.4	170.1	28	-33.8	0	0	0	110.3	C87 S88	C87-P588 CarbonylContact C-O 3.53Å; C87-P588 WeakPolarHBondContact CA-O 3.25Å; C87-P588 WeakPolarHBondContact CB-O 3.15Å; S88-P588 PolarHBondContact N-O 3.06Å
589	M	71.3	Confident	70.8	Confident	41 Å²	41	78.7 Å²	78.7	20%	0.202	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-70.2	135.3	175.4	-174.3	-178.9	-78.5	0	0	110.2	P90 Y452 M591	P90-M589 HydrophobicContact CB-CE 4.41Å; P90-M589 HydrophobicContact CB-CG 3.82Å; P90-M589 HydrophobicContact CB-SD 3.82Å; Y452-M589 HydrophobicContact CD2-SD 3.72Å; Y452-M589 HydrophobicContact CE2-SD 4.4Å; M589-M591 HydrophobicContact CG-CE 4.21Å; M589-M591 PolarHBondContact O-N 3.29Å; M589-M591 HydrophobicContact SD-CE 3.78Å
590	C	75.5	Confident	70	Confident	30 Å²	30	80 Å²	80	20%	0.203	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-66.6	116.3	173	-48.5	0	0	0	0	108.7	C87 S88	C87-C590 HydrophobicContact CB-CB 3.98Å; C87-C590 WeakPolarHBondContact CB-SG 3.28Å; C87-C590 WeakPolarHBondContact SG-CB 3.37Å; C87-C590 CovalentContact SG-SG 2.03Å; C87-C590 PolarHBondContact SG-SG 2.95Å; S88-C590 PolarHBondContact O-N 3.46Å; S88-C590 PolarHBondContact O-SG 3.11Å; S88-C590 VanDerWaalsContact O-SG 3.4Å
591	M	67.8	Low	69.2	Low	86 Å²	86	82.8 Å²	82.8	42%	0.424	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-92.8	127.4	171.6	-66.4	-90.5	106	0	0	108.1	Y452 M589	Y452-M591 HydrophobicContact CD2-CE 3.63Å; Y452-M591 HydrophobicContact CE2-CE 3.54Å; Y452-M591 HydrophobicContact CG-CE 4.43Å; Y452-M591 WeakPolarHBondContact O-CE 3.2Å; M589-M591 HydrophobicContact CG-CE 4.21Å; M589-M591 PolarHBondContact O-N 3.29Å; M589-M591 HydrophobicContact SD-CE 3.78Å
592	E	63.8	Low	68.3	Low	116 Å²	116	84.6 Å²	84.6	54%	0.542	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-81.4	129.6	168.4	-62.4	-176.7	150.9	0	0	109.4	H93 Y452	H93-E592 IonicContact CE1-OE1 3.43Å; H93-E592 PolarHBondContact CE1-OE1 3.49Å; H93-E592 IonicContact CE1-OE2 3.43Å; H93-E592 PolarHBondContact CE1-OE2 3.45Å; H93-E592 IonicContact NE2-OE1 3.62Å; H93-E592 IonicContact NE2-OE2 3.97Å; Y452-E592 PolarHBondContact OH-N 3.47Å; Y452-E592 VanDerWaalsContact OH-N 3.09Å
593	D	46.3	Very low	67.8	Low	213 Å²	213	81.5 Å²	81.5	100%	1.139	43%	0.427	S	S	*	.			trans	-72.5	0	178.3	-80.3	-31.3	0	0	0	113.1

Retrieved 593 of 593 residues in 655.9 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).