A0A096MKK4_PAPAN Loading...

Potassium voltage-gated channel subfamily D member 3

AlphaFold DB , UniProt , Accession A0A096MKK4, Species PAPAN (Papio anubis, Olive baboon), Gene KCND3, Length 655 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	40.3	Very low	47.2	Very low	251 Å²	251	116.5 Å²	116.5	100%	1.236	71%	0.705	S	S	*	*				0	47.7	0	-72.7	-169.8	-100.9	0	0	112
2	A	39.8	Very low	47.9	Very low	100 Å²	100	112.2 Å²	112.2	83%	0.826	69%	0.69	S	S	*	*			trans	-129.5	21.5	-178	0	0	0	0	0	113.1
3	A	38.1	Very low	48.5	Very low	95 Å²	95	117.5 Å²	117.5	79%	0.785	69%	0.69	S	S	*	*	S	Bend	trans	-107.5	-2.5	-179.3	0	0	0	0	0	113.7
4	G	41	Very low	48.9	Very low	54 Å²	54	113.5 Å²	113.5	56%	0.557	68%	0.677	S	S	*	*	S	Bend	trans	-89.6	-17.2	-174.7	0	0	0	0	0	115.6
5	V	45.9	Very low	49.5	Very low	121 Å²	121	109.9 Å²	109.9	73%	0.733	66%	0.664	S	S	*	*	S	Bend	trans	-84.7	-25.7	-170.3	-167.3	0	0	0	0	112.2	A7	V5-A7 VanDerWaalsContact C-N 3.34Å; V5-A7 PolarHBondContact O-N 3.5Å
6	A	49.5	Very low	49.9	Very low	76 Å²	76	107.3 Å²	107.3	63%	0.628	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-22.8	-178	0	0	0	0	0	114.1	W8	A6-W8 VanDerWaalsContact C-N 3.32Å; A6-W8 PolarHBondContact O-N 3.39Å
7	A	51.3	Low	50.3	Low	70 Å²	70	108.2 Å²	108.2	58%	0.579	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-17.6	-175.8	0	0	0	0	0	114.1	V5	V5-A7 VanDerWaalsContact C-N 3.34Å; V5-A7 PolarHBondContact O-N 3.5Å
8	W	48.2	Very low	50.5	Low	184 Å²	184	105.6 Å²	105.6	70%	0.697	66%	0.655	S	S	*	*	S	Bend	trans	-102.4	-10.2	-173.3	-69.4	88.6	0	0	0	114.5	A6 P10 F11 A12	A6-W8 VanDerWaalsContact C-N 3.32Å; A6-W8 PolarHBondContact O-N 3.39Å; W8-P10 VanDerWaalsContact C-CD 3.43Å; W8-F11 PolarHBondContact O-N 3.34Å; W8-A12 PolarHBondContact O-N 3.36Å
9	L	55.9	Low	50.4	Low	98 Å²	98	111.8 Å²	111.8	51%	0.513	67%	0.665	S	S	.	*	H	α-helix	trans	-56.6	-37.7	176.6	-96.1	147.2	0	0	0	114.7	R13	L9-R13 PolarHBondContact O-N 3.24Å; L9-R13 VanDerWaalsContact O-N 3.14Å
10	P	54.4	Low	50.3	Low	85 Å²	85	113.5 Å²	113.5	55%	0.552	67%	0.668	S	S	*	*	H	α-helix	trans	-67.3	-37.3	175.8	-19.4	32.1	0	0	0	112.6	W8 A14	W8-P10 VanDerWaalsContact C-CD 3.43Å; P10-A14 WeakPolarHBondContact O-CB 3.46Å; P10-A14 PolarHBondContact O-N 3.11Å
11	F	54.8	Low	50.3	Low	148 Å²	148	113.7 Å²	113.7	65%	0.649	67%	0.673	S	S	*	*	H	α-helix	trans	-73	-37.5	178.2	-81.7	-83	0	0	0	112.3	W8 R13 A14 A15	W8-F11 PolarHBondContact O-N 3.34Å; F11-R13 VanDerWaalsContact C-N 3.35Å; F11-A14 PolarHBondContact O-N 3.37Å; F11-A15 WeakPolarHBondContact O-CB 3.44Å; F11-A15 PolarHBondContact O-N 3.47Å
12	A	55.3	Low	51.2	Low	64 Å²	64	108.2 Å²	108.2	53%	0.529	65%	0.653	S	S	.	*	H	α-helix	trans	-64	-38.8	174	0	0	0	0	0	112.2	W8 A16	W8-A12 PolarHBondContact O-N 3.36Å; A12-A16 PolarHBondContact O-N 2.96Å; A12-A16 VanDerWaalsContact O-N 3.11Å
13	R	55.4	Low	51.7	Low	182 Å²	182	107.4 Å²	107.4	69%	0.687	65%	0.646	S	S	*	*	H	α-helix	trans	-70.1	-39.1	174.6	-79.6	-178.8	167.2	161.3	-2.6	112.8	L9 F11 A16 I17	L9-R13 PolarHBondContact O-N 3.24Å; L9-R13 VanDerWaalsContact O-N 3.14Å; F11-R13 VanDerWaalsContact C-N 3.35Å; R13-A16 PolarHBondContact O-N 3.13Å; R13-I17 WeakPolarHBondContact O-CG1 3.4Å; R13-I17 PolarHBondContact O-N 2.96Å
14	A	54.5	Low	52.6	Low	61 Å²	61	111.1 Å²	111.1	50%	0.504	65%	0.653	S	S	.	*	H	α-helix	trans	-66.8	-38.3	175.5	0	0	0	0	0	112.2	P10 F11 I17 G18	P10-A14 WeakPolarHBondContact O-CB 3.46Å; P10-A14 PolarHBondContact O-N 3.11Å; F11-A14 PolarHBondContact O-N 3.37Å; A14-I17 PolarHBondContact O-N 3.4Å; A14-G18 PolarHBondContact O-N 3Å
15	A	58.1	Low	53.4	Low	59 Å²	59	113.6 Å²	113.6	49%	0.488	66%	0.66	S	S	.	*	H	α-helix	trans	-66.4	-36.4	175.2	0	0	0	0	0	112.3	F11 I17 G18 W19	F11-A15 WeakPolarHBondContact O-CB 3.44Å; F11-A15 PolarHBondContact O-N 3.47Å; A15-I17 VanDerWaalsContact C-N 3.32Å; A15-I17 PolarHBondContact O-N 3.01Å; A15-G18 PolarHBondContact O-N 3.4Å; A15-W19 VanDerWaalsContact O-CD1 3.28Å
16	A	55.2	Low	54	Low	69 Å²	69	113.7 Å²	113.7	57%	0.57	66%	0.663	S	S	*	*	H	α-helix	trans	-66.7	-29.8	176.7	0	0	0	0	0	113.6	A12 R13	A12-A16 PolarHBondContact O-N 2.96Å; A12-A16 VanDerWaalsContact O-N 3.11Å; R13-A16 PolarHBondContact O-N 3.13Å
17	I	57.8	Low	53.9	Low	123 Å²	123	118.1 Å²	118.1	63%	0.631	67%	0.673	S	S	*	*	H	α-helix	trans	-75	-29	177.9	-64.5	165.3	0	0	0	111.3	R13 A14 A15 W19 M20	R13-I17 WeakPolarHBondContact O-CG1 3.4Å; R13-I17 PolarHBondContact O-N 2.96Å; A14-I17 PolarHBondContact O-N 3.4Å; A15-I17 VanDerWaalsContact C-N 3.32Å; A15-I17 PolarHBondContact O-N 3.01Å; I17-W19 VanDerWaalsContact C-N 3.25Å; I17-W19 PolarHBondContact O-N 3.05Å; I17-M20 PolarHBondContact O-N 3.48Å
18	G	52.8	Low	54.1	Low	61 Å²	61	120.6 Å²	120.6	63%	0.629	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-13.7	-179.3	0	0	0	0	0	115.7	A14 A15	A14-G18 PolarHBondContact O-N 3Å; A15-G18 PolarHBondContact O-N 3.4Å
19	W	50	Low	54.6	Low	223 Å²	223	119.9 Å²	119.9	85%	0.845	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	5	-178.6	-71	73.6	0	0	0	114	A15 I17	A15-W19 VanDerWaalsContact O-CD1 3.28Å; I17-W19 VanDerWaalsContact C-N 3.25Å; I17-W19 PolarHBondContact O-N 3.05Å
20	M	48	Very low	54.3	Low	146 Å²	146	119.3 Å²	119.3	72%	0.719	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-71.5	-10.4	-175.8	-74.8	-164.8	90.6	0	0	118.3	I17 V22	I17-M20 PolarHBondContact O-N 3.48Å; M20-V22 PolarHBondContact O-N 3.07Å
21	P	51.2	Low	53.7	Low	118 Å²	118	121.4 Å²	121.4	77%	0.766	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-89.9	18.9	-176.2	33.9	-30.8	0	0	0	116
22	V	57.3	Low	53.5	Low	135 Å²	135	118 Å²	118	82%	0.818	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-119.6	-0.7	-179.1	-171.5	0	0	0	0	114.7	M20 N24	M20-V22 PolarHBondContact O-N 3.07Å; V22-N24 PolarHBondContact O-N 3.3Å
23	A	50.7	Low	53	Low	84 Å²	84	121.8 Å²	121.8	69%	0.694	73%	0.726	S	S	*	*			trans	-99.1	92.6	176.1	0	0	0	0	0	111.1	C25	A23-C25 PolarHBondContact O-N 3.01Å; A23-C25 VanDerWaalsContact O-N 3.12Å
24	N	57.6	Low	52.4	Low	172 Å²	172	122.2 Å²	122.2	92%	0.92	73%	0.733	S	S	*	*			trans	-80.9	29.2	175.9	-121.6	8.6	0	0	0	113.3	V22	V22-N24 PolarHBondContact O-N 3.3Å
25	C	57.5	Low	52	Low	106 Å²	106	125.3 Å²	125.3	72%	0.716	74%	0.741	S	S	*	*	S	Bend	trans	-105.9	130.1	175.6	-63.8	0	0	0	0	109.3	A23 M27	A23-C25 PolarHBondContact O-N 3.01Å; A23-C25 VanDerWaalsContact O-N 3.12Å; C25-M27 PolarHBondContact O-N 3.33Å
26	P	59.5	Low	51.6	Low	123 Å²	123	132.2 Å²	132.2	80%	0.799	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-56.8	136.1	171.4	23.6	-30.8	0	0	0	109
27	M	45.9	Very low	51.7	Low	169 Å²	169	138.5 Å²	138.5	83%	0.833	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-50.9	134.1	177.6	-77.2	-170.9	-73.3	0	0	109.5	C25 L29	C25-M27 PolarHBondContact O-N 3.33Å; M27-L29 PolarHBondContact O-N 2.99Å
28	P	57.2	Low	51.8	Low	122 Å²	122	140.5 Å²	140.5	79%	0.792	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-56.1	136.2	168.2	23	-29.6	0	0	0	108	A30	P28-A30 PolarHBondContact O-N 3.41Å
29	L	58.5	Low	52.9	Low	170 Å²	170	140.8 Å²	140.8	89%	0.89	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-51.8	131.2	175.1	-83.9	106.2	0	0	0	108.5	M27	M27-L29 PolarHBondContact O-N 2.99Å
30	A	48.4	Very low	54.6	Low	85 Å²	85	135 Å²	135	70%	0.702	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-46.9	135.4	172.9	0	0	0	0	0	108.5	P28 A32	P28-A30 PolarHBondContact O-N 3.41Å; A30-A32 PolarHBondContact O-N 2.94Å
31	P	41.8	Very low	56.6	Low	129 Å²	129	132 Å²	132	84%	0.838	73%	0.732	S	S	*	*			trans	-56.2	106.9	179.3	21.3	-30.1	0	0	0	107.8	D33	P31-D33 PolarHBondContact O-N 3.41Å; P31-D33 VanDerWaalsContact O-N 3.16Å
32	A	50.7	Low	58.6	Low	78 Å²	78	126.8 Å²	126.8	65%	0.645	70%	0.697	S	S	*	*			trans	-67.6	114.3	170.1	0	0	0	0	0	105.7	A30 K34	A30-A32 PolarHBondContact O-N 2.94Å; A32-K34 PolarHBondContact O-N 2.91Å
33	D	45.7	Very low	60.5	Low	142 Å²	142	122 Å²	122	76%	0.759	67%	0.668	S	S	*	*			trans	-60	102.4	174.2	-154.4	-16.7	0	0	0	107.8	P31 N35	P31-D33 PolarHBondContact O-N 3.41Å; P31-D33 VanDerWaalsContact O-N 3.16Å; D33-N35 PolarHBondContact O-N 3.33Å
34	K	42.2	Very low	62.7	Low	192 Å²	192	118 Å²	118	84%	0.835	64%	0.635	S	S	*	*			trans	-82	22.4	-175.7	-82.6	-173.6	180	179.4	0	112.2	A32	A32-K34 PolarHBondContact O-N 2.91Å
35	N	46.5	Very low	64.5	Low	126 Å²	126	110.3 Å²	110.3	67%	0.674	59%	0.594	S	S	*	*			trans	-110.5	90.5	160.3	-84.2	-25.4	0	0	0	108.7	D33 R37	D33-N35 PolarHBondContact O-N 3.33Å; N35-R37 PolarHBondContact O-N 3.49Å
36	K	49.3	Very low	66.4	Low	203 Å²	203	105.3 Å²	105.3	88%	0.883	56%	0.56	S	S	*	*			trans	-64.6	77	152.1	-77.6	-176.9	176.7	-179	0	107.4	Q38	K36-Q38 PolarHBondContact O-N 2.94Å
37	R	56.8	Low	68.1	Low	202 Å²	202	102.1 Å²	102.1	76%	0.762	54%	0.541	S	S	*	.			trans	-54.9	120.4	150.3	-79.8	-177.8	171.4	176.6	-3.1	104.1	N35 D39	N35-R37 PolarHBondContact O-N 3.49Å; R37-D39 PolarHBondContact O-N 3.36Å
38	Q	60.7	Low	70.3	Confident	164 Å²	164	96.6 Å²	96.6	77%	0.766	53%	0.527	S	S	*	.			trans	-54.2	128.6	178	-67.7	179.6	-4.9	0	0	106.8	K36 E40	K36-Q38 PolarHBondContact O-N 2.94Å; Q38-E40 PolarHBondContact O-N 2.92Å
39	D	75.3	Confident	72.2	Confident	67 Å²	67	96.2 Å²	96.2	36%	0.358	51%	0.51	S	S	.	.			trans	-66	106.5	178.3	-164.2	2.6	0	0	0	106.9	R37 W54 R55 T56	R37-D39 PolarHBondContact O-N 3.36Å; D39-W54 HydrophobicContact CB-CE3 4.39Å; D39-W54 WeakPolarHBondContact O-CZ3 3.36Å; D39-R55 PolarHBondContact OD1-N 2.85Å; D39-T56 HydrophobicContact CB-CG2 4.24Å; D39-T56 VanDerWaalsContact CG-OG1 3.28Å; D39-T56 VanDerWaalsContact OD1-CG2 3.28Å; D39-T56 WeakPolarHBondContact OD1-CG2 3.44Å; D39-T56 PolarHBondContact OD1-N 3.13Å; D39-T56 VanDerWaalsContact OD1-N 3.17Å; D39-T56 PolarHBondContact OD1-OG1 3.29Å; D39-T56 VanDerWaalsContact OD2-CG2 3.28Å; D39-T56 WeakPolarHBondContact OD2-CG2 3.38Å; D39-T56 PolarHBondContact OD2-OG1 3.31Å
40	E	85.3	Confident	74	Confident	101 Å²	101	95.9 Å²	95.9	47%	0.472	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-91.3	142.4	-173.4	-79.2	169.5	-178.7	0	0	110	Q38 R55	Q38-E40 PolarHBondContact O-N 2.92Å; E40-R55 WeakPolarHBondContact O-CB 3.36Å; E40-R55 PolarHBondContact O-N 3.26Å; E40-R55 IonicContact OE2-CZ 3.59Å; E40-R55 IonicContact OE2-NE 3.2Å; E40-R55 IonicContact OE2-NH2 2.81Å; E40-R55 PolarHBondContact OE2-NH2 3.16Å
41	L	91.3	Very high	76.3	Confident	84 Å²	84	93 Å²	93	44%	0.44	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.2	173.1	-150.1	113	0	0	0	108.8	Q52 W54	L41-Q52 HydrophobicContact CD2-CB 3.84Å; L41-Q52 HydrophobicContact CD2-CG 4.03Å; L41-W54 HydrophobicContact CB-CZ3 4.37Å; L41-W54 HydrophobicContact CD1-CD2 4.13Å; L41-W54 HydrophobicContact CD1-CE3 4.04Å; L41-W54 HydrophobicContact CD1-CH2 3.7Å; L41-W54 HydrophobicContact CD1-CZ2 3.78Å; L41-W54 HydrophobicContact CD1-CZ3 3.83Å
42	I	93	Very high	78.9	Confident	9 Å²	9	92.1 Å²	92.1	5%	0.046	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.8	179.2	-62.9	179.9	0	0	0	109.4	L44 Q52 T53 R55 L58 Y82	I42-L44 HydrophobicContact CG2-CD2 3.91Å; I42-L44 HydrophobicContact CG2-CG 4.26Å; I42-Q52 WeakPolarHBondContact O-CA 3.42Å; I42-T53 PolarHBondContact N-O 2.96Å; I42-T53 PolarHBondContact O-N 2.96Å; I42-T53 VanDerWaalsContact O-N 3.07Å; I42-R55 HydrophobicContact CD1-CB 3.74Å; I42-R55 HydrophobicContact CD1-CG 3.97Å; I42-R55 HydrophobicContact CG1-CB 4.23Å; I42-L58 HydrophobicContact CD1-CD1 4.26Å; I42-Y82 HydrophobicContact CG2-CD2 3.45Å; I42-Y82 VanDerWaalsContact CG2-CD2 3.45Å; I42-Y82 HydrophobicContact CG2-CE2 3.42Å; I42-Y82 VanDerWaalsContact CG2-CE2 3.42Å
43	V	95.7	Very high	81	Confident	35 Å²	35	88.7 Å²	88.7	21%	0.212	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.9	174.4	-173.1	0	0	0	0	109.7	R50 F51 Q52 E81 Y82	V43-R50 HydrophobicContact CG1-CB 4.43Å; V43-R50 HydrophobicContact CG1-CG 4.47Å; V43-F51 WeakPolarHBondContact CA-O 3.45Å; V43-Q52 HydrophobicContact CG2-CG 4.32Å; V43-E81 HydrophobicContact CB-CB 3.91Å; V43-E81 HydrophobicContact CG1-CB 3.87Å; V43-Y82 PolarHBondContact O-N 3.11Å
44	L	96.9	Very high	83.3	Confident	0 Å²	0	88 Å²	88	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	107	178.5	-54.8	167.7	0	0	0	107.6	I42 F51 T53 L58 L66 Y82 F84 F91 L95	I42-L44 HydrophobicContact CG2-CD2 3.91Å; I42-L44 HydrophobicContact CG2-CG 4.26Å; L44-F51 HydrophobicContact CB-CB 4.29Å; L44-F51 PolarHBondContact N-O 2.98Å; L44-F51 PolarHBondContact O-N 3.46Å; L44-T53 HydrophobicContact CD1-CG2 3.94Å; L44-L58 HydrophobicContact CD1-CD1 4.37Å; L44-L66 HydrophobicContact CD2-CD2 4.39Å; L44-Y82 HydrophobicContact CD2-CD2 4.02Å; L44-Y82 HydrophobicContact CD2-CG 4.17Å; L44-F84 HydrophobicContact CD2-CE2 4.16Å; L44-F91 HydrophobicContact CB-CE1 4.19Å; L44-F91 HydrophobicContact CB-CZ 4.03Å; L44-F91 HydrophobicContact CD1-CE1 4.27Å; L44-F91 HydrophobicContact CD1-CZ 3.77Å; L44-F91 HydrophobicContact CG-CZ 4.46Å; L44-L95 HydrophobicContact CD1-CD1 4.28Å
45	N	97.1	Very high	85.6	Confident	10 Å²	10	81.4 Å²	81.4	5%	0.053	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	112.5	177.4	-176.6	-3.6	0	0	0	109.9	G48 R49 R50 E81 Y82 F83 F84	N45-G48 WeakPolarHBondContact OD1-CA 3.33Å; N45-G48 PolarHBondContact OD1-N 2.92Å; N45-R49 PolarHBondContact OD1-N 3.42Å; N45-R50 HydrophobicContact CB-CG 4.37Å; N45-E81 HydrophobicContact CB-CG 4.31Å; N45-E81 PolarHBondContact ND2-OE1 3.38Å; N45-Y82 PolarHBondContact N-O 3.07Å; N45-F83 HydrophobicContact CB-CD2 4.24Å; N45-F83 CarbonylContact O-C 3.53Å; N45-F83 WeakPolarHBondContact O-CA 3.36Å; N45-F84 PolarHBondContact O-N 2.87Å
46	V	97.4	Very high	87.7	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	105.5	179.1	-174.1	0	0	0	0	109.1	G48 R49 F51 F84 R86 P88 F91	V46-G48 PolarHBondContact O-N 3.42Å; V46-G48 VanDerWaalsContact O-N 3.14Å; V46-R49 PolarHBondContact N-O 3.37Å; V46-R49 WeakPolarHBondContact O-CB 3.47Å; V46-R49 PolarHBondContact O-N 3.36Å; V46-F51 HydrophobicContact CB-CD2 4.43Å; V46-F51 HydrophobicContact CB-CE2 4.2Å; V46-F51 HydrophobicContact CG2-CD2 4.16Å; V46-F51 HydrophobicContact CG2-CE2 4.31Å; V46-F84 CarbonylContact C-O 3.47Å; V46-F84 VanDerWaalsContact CA-O 3.31Å; V46-F84 WeakPolarHBondContact CA-O 3.29Å; V46-F84 HydrophobicContact CG1-CB 4.47Å; V46-F84 HydrophobicContact CG2-CB 4.25Å; V46-F84 HydrophobicContact CG2-CD2 4.3Å; V46-R86 HydrophobicContact CG1-CB 3.96Å; V46-R86 WeakPolarHBondContact CG1-O 3.37Å; V46-P88 HydrophobicContact CB-CB 4.33Å; V46-P88 HydrophobicContact CG1-CB 4.13Å; V46-F91 HydrophobicContact CB-CD1 4.42Å; V46-F91 HydrophobicContact CB-CG 4.41Å; V46-F91 HydrophobicContact CG1-CB 4.2Å; V46-F91 HydrophobicContact CG1-CG 4.44Å; V46-F91 HydrophobicContact CG2-CB 4.23Å; V46-F91 HydrophobicContact CG2-CD1 3.52Å; V46-F91 HydrophobicContact CG2-CD2 3.92Å; V46-F91 HydrophobicContact CG2-CE1 3.69Å; V46-F91 HydrophobicContact CG2-CE2 4.05Å; V46-F91 HydrophobicContact CG2-CG 3.61Å; V46-F91 HydrophobicContact CG2-CZ 3.93Å
47	S	95.1	Very high	89.8	Confident	56 Å²	56	69.8 Å²	69.8	39%	0.392	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	39.3	-178.2	-59.1	0	0	0	0	113.9	F84 R86	S47-F84 PolarHBondContact N-O 2.9Å; S47-R86 WeakPolarHBondContact CB-O 3.37Å; S47-R86 PolarHBondContact OG-N 3.31Å; S47-R86 PolarHBondContact OG-O 3.4Å
48	G	92.3	Very high	91.6	Very high	53 Å²	53	60.2 Å²	60.2	55%	0.546	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	-12.9	-178.6	0	0	0	0	0	114.9	N45 V46	N45-G48 WeakPolarHBondContact OD1-CA 3.33Å; N45-G48 PolarHBondContact OD1-N 2.92Å; V46-G48 PolarHBondContact O-N 3.42Å; V46-G48 VanDerWaalsContact O-N 3.14Å
49	R	96.7	Very high	93	Very high	114 Å²	114	56.5 Å²	56.5	43%	0.43	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.1	174.3	-168.1	178.9	-69.5	-179.2	-5	109.9	N45 V46 F51 P88 E89	N45-R49 PolarHBondContact OD1-N 3.42Å; V46-R49 PolarHBondContact N-O 3.37Å; V46-R49 WeakPolarHBondContact O-CB 3.47Å; V46-R49 PolarHBondContact O-N 3.36Å; R49-F51 HydrophobicContact CB-CE2 4.01Å; R49-F51 HydrophobicContact CG-CD2 4.47Å; R49-F51 HydrophobicContact CG-CE2 3.74Å; R49-F51 HydrophobicContact CG-CZ 3.99Å; R49-F51 WeakPolarHBondContact O-CD2 3.41Å; R49-P88 HydrophobicContact CB-CB 3.8Å; R49-P88 HydrophobicContact CG-CB 4.45Å; R49-E89 IonicContact CZ-OE2 2.83Å; R49-E89 IonicContact NH1-OE2 3.07Å; R49-E89 PolarHBondContact NH1-OE2 3.28Å
50	R	96	Very high	93.8	Very high	163 Å²	163	60.1 Å²	60.1	62%	0.615	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	127.2	179.9	-64.7	-173.4	178.5	102.5	2.8	112	V43 N45 E81	V43-R50 HydrophobicContact CG1-CB 4.43Å; V43-R50 HydrophobicContact CG1-CG 4.47Å; N45-R50 HydrophobicContact CB-CG 4.37Å; R50-E81 IonicContact CZ-OE2 3.5Å; R50-E81 IonicContact NE-OE2 3.76Å; R50-E81 PolarHBondContact NE-OE2 3.4Å; R50-E81 IonicContact NH2-OE2 2.71Å
51	F	96.8	Very high	94.2	Very high	26 Å²	26	58.4 Å²	58.4	11%	0.114	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.9	171.1	-63.8	-93.9	0	0	0	109.4	V43 L44 V46 R49 P88 F91 R92 L95	V43-F51 WeakPolarHBondContact CA-O 3.45Å; L44-F51 HydrophobicContact CB-CB 4.29Å; L44-F51 PolarHBondContact N-O 2.98Å; L44-F51 PolarHBondContact O-N 3.46Å; V46-F51 HydrophobicContact CB-CD2 4.43Å; V46-F51 HydrophobicContact CB-CE2 4.2Å; V46-F51 HydrophobicContact CG2-CD2 4.16Å; V46-F51 HydrophobicContact CG2-CE2 4.31Å; R49-F51 HydrophobicContact CB-CE2 4.01Å; R49-F51 HydrophobicContact CG-CD2 4.47Å; R49-F51 HydrophobicContact CG-CE2 3.74Å; R49-F51 HydrophobicContact CG-CZ 3.99Å; R49-F51 WeakPolarHBondContact O-CD2 3.41Å; F51-P88 HydrophobicContact CE2-CB 4.41Å; F51-P88 WeakPolarHBondContact CZ-O 3.38Å; F51-F91 HydrophobicContact CB-CD1 4.47Å; F51-F91 HydrophobicContact CB-CE1 3.9Å; F51-F91 HydrophobicContact CD1-CD1 4.16Å; F51-F91 HydrophobicContact CD1-CE1 4.34Å; F51-F91 AromaticContact CD2-CD1 3.48Å; F51-F91 HydrophobicContact CD2-CD1 3.48Å; F51-F91 VanDerWaalsContact CD2-CD1 3.48Å; F51-F91 AromaticContact CD2-CE1 3.66Å; F51-F91 HydrophobicContact CD2-CE1 3.66Å; F51-F91 HydrophobicContact CE1-CD1 4.24Å; F51-F91 AromaticContact CE2-CD1 3.58Å; F51-F91 HydrophobicContact CE2-CD1 3.58Å; F51-F91 HydrophobicContact CE2-CE1 4.25Å; F51-F91 AromaticContact CG-CD1 3.78Å; F51-F91 HydrophobicContact CG-CD1 3.78Å; F51-F91 AromaticContact CG-CE1 3.71Å; F51-F91 HydrophobicContact CG-CE1 3.71Å; F51-F91 AromaticContact CZ-CD1 3.96Å; F51-F91 HydrophobicContact CZ-CD1 3.96Å; F51-R92 HydrophobicContact CE1-CB 4.39Å; F51-L95 HydrophobicContact CB-CD2 3.84Å; F51-L95 HydrophobicContact CD1-CD2 3.86Å; F51-L95 HydrophobicContact CG-CD2 4.19Å
52	Q	95.2	Very high	94.3	Very high	110 Å²	110	58 Å²	58	51%	0.514	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.1	-179.5	-67.9	179.4	1.4	0	0	110.3	L41 I42 V43 R99	L41-Q52 HydrophobicContact CD2-CB 3.84Å; L41-Q52 HydrophobicContact CD2-CG 4.03Å; I42-Q52 WeakPolarHBondContact O-CA 3.42Å; V43-Q52 HydrophobicContact CG2-CG 4.32Å; Q52-R99 PolarHBondContact O-NH2 3.32Å
53	T	94.9	Very high	94.2	Very high	6 Å²	6	65.1 Å²	65.1	4%	0.037	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	160.7	177.6	-164.6	0	0	0	0	110.9	I42 L44 T57 L58 L95	I42-T53 PolarHBondContact N-O 2.96Å; I42-T53 PolarHBondContact O-N 2.96Å; I42-T53 VanDerWaalsContact O-N 3.07Å; L44-T53 HydrophobicContact CD1-CG2 3.94Å; T53-T57 WeakPolarHBondContact OG1-CB 3.36Å; T53-L58 HydrophobicContact CG2-CD1 3.99Å; T53-L58 HydrophobicContact CG2-CD2 3.93Å; T53-L58 HydrophobicContact CG2-CG 3.83Å; T53-L95 HydrophobicContact CG2-CD1 4.02Å
54	W	94	Very high	94.1	Very high	128 Å²	128	64 Å²	64	49%	0.485	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	144.6	173.7	-59	105.1	0	0	0	110.9	D39 L41 T56 T57	D39-W54 HydrophobicContact CB-CE3 4.39Å; D39-W54 WeakPolarHBondContact O-CZ3 3.36Å; L41-W54 HydrophobicContact CB-CZ3 4.37Å; L41-W54 HydrophobicContact CD1-CD2 4.13Å; L41-W54 HydrophobicContact CD1-CE3 4.04Å; L41-W54 HydrophobicContact CD1-CH2 3.7Å; L41-W54 HydrophobicContact CD1-CZ2 3.78Å; L41-W54 HydrophobicContact CD1-CZ3 3.83Å; W54-T56 PolarHBondContact O-N 2.96Å; W54-T57 VanDerWaalsContact O-CB 3.28Å; W54-T57 WeakPolarHBondContact O-CB 3.48Å; W54-T57 PolarHBondContact O-N 3.46Å
55	R	90.8	Very high	94	Very high	53 Å²	53	64.6 Å²	64.6	20%	0.2	31%	0.313	C	S	.	.	H	α-helix	trans	-53.3	-45.2	173.9	-179.5	-178.6	-66.3	-81.3	3.2	111.1	D39 E40 I42 T57 L58 E59	D39-R55 PolarHBondContact OD1-N 2.85Å; E40-R55 WeakPolarHBondContact O-CB 3.36Å; E40-R55 PolarHBondContact O-N 3.26Å; E40-R55 IonicContact OE2-CZ 3.59Å; E40-R55 IonicContact OE2-NE 3.2Å; E40-R55 IonicContact OE2-NH2 2.81Å; E40-R55 PolarHBondContact OE2-NH2 3.16Å; I42-R55 HydrophobicContact CD1-CB 3.74Å; I42-R55 HydrophobicContact CD1-CG 3.97Å; I42-R55 HydrophobicContact CG1-CB 4.23Å; R55-T57 PolarHBondContact O-N 2.99Å; R55-T57 VanDerWaalsContact O-N 3.16Å; R55-L58 PolarHBondContact O-N 3.41Å; R55-L58 VanDerWaalsContact O-N 3.09Å; R55-E59 WeakPolarHBondContact CD-OE1 3.08Å; R55-E59 HydrophobicContact CG-CG 4.32Å; R55-E59 VanDerWaalsContact CG-OE1 3.27Å; R55-E59 WeakPolarHBondContact CG-OE1 3.41Å; R55-E59 WeakPolarHBondContact O-CG 3.4Å; R55-E59 PolarHBondContact O-N 3.14Å; R55-E59 VanDerWaalsContact O-N 3.12Å
56	T	91.6	Very high	93.9	Very high	67 Å²	67	64.1 Å²	64.1	41%	0.411	31%	0.311	S	S	.	.	H	α-helix	trans	-59.4	-27.3	177.8	55.7	0	0	0	0	114.1	D39 W54 R60	D39-T56 HydrophobicContact CB-CG2 4.24Å; D39-T56 VanDerWaalsContact CG-OG1 3.28Å; D39-T56 VanDerWaalsContact OD1-CG2 3.28Å; D39-T56 WeakPolarHBondContact OD1-CG2 3.44Å; D39-T56 PolarHBondContact OD1-N 3.13Å; D39-T56 VanDerWaalsContact OD1-N 3.17Å; D39-T56 PolarHBondContact OD1-OG1 3.29Å; D39-T56 VanDerWaalsContact OD2-CG2 3.28Å; D39-T56 WeakPolarHBondContact OD2-CG2 3.38Å; D39-T56 PolarHBondContact OD2-OG1 3.31Å; W54-T56 PolarHBondContact O-N 2.96Å; T56-R60 PolarHBondContact O-N 3.26Å
57	T	93.5	Very high	93.7	Very high	18 Å²	18	64.6 Å²	64.6	11%	0.11	32%	0.315	C	S	.	.	H	α-helix	trans	-69.4	-37.7	178.6	-59.7	0	0	0	0	111.2	T53 W54 R55 R99	T53-T57 WeakPolarHBondContact OG1-CB 3.36Å; W54-T57 VanDerWaalsContact O-CB 3.28Å; W54-T57 WeakPolarHBondContact O-CB 3.48Å; W54-T57 PolarHBondContact O-N 3.46Å; R55-T57 PolarHBondContact O-N 2.99Å; R55-T57 VanDerWaalsContact O-N 3.16Å; T57-R99 HydrophobicContact CG2-CG 3.92Å
58	L	93.8	Very high	93.5	Very high	1 Å²	1	63 Å²	63	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-76.5	-40	177.9	-59.2	-178.5	0	0	0	111.3	I42 L44 T53 R55 R60 Y61 L66 G67 L95 Y98	I42-L58 HydrophobicContact CD1-CD1 4.26Å; L44-L58 HydrophobicContact CD1-CD1 4.37Å; T53-L58 HydrophobicContact CG2-CD1 3.99Å; T53-L58 HydrophobicContact CG2-CD2 3.93Å; T53-L58 HydrophobicContact CG2-CG 3.83Å; R55-L58 PolarHBondContact O-N 3.41Å; R55-L58 VanDerWaalsContact O-N 3.09Å; L58-R60 PolarHBondContact O-N 3.09Å; L58-R60 VanDerWaalsContact O-N 3.08Å; L58-Y61 PolarHBondContact O-N 3.34Å; L58-Y61 VanDerWaalsContact O-N 3.17Å; L58-L66 HydrophobicContact CD1-CB 4.31Å; L58-L66 HydrophobicContact CD2-CB 4Å; L58-L66 HydrophobicContact CD2-CD1 4.3Å; L58-G67 VanDerWaalsContact O-CA 3.25Å; L58-G67 WeakPolarHBondContact O-CA 3.42Å; L58-L95 HydrophobicContact CD2-CD1 4.48Å; L58-Y98 HydrophobicContact CD2-CD1 3.94Å; L58-Y98 HydrophobicContact CD2-CD2 4.27Å; L58-Y98 HydrophobicContact CD2-CE1 4.33Å; L58-Y98 HydrophobicContact CD2-CG 3.91Å
59	E	91	Very high	93.4	Very high	86 Å²	86	66.2 Å²	66.2	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-62.5	-14.9	179.3	-70.8	175.6	170.8	0	0	113.7	R55 Y61	R55-E59 WeakPolarHBondContact CD-OE1 3.08Å; R55-E59 HydrophobicContact CG-CG 4.32Å; R55-E59 VanDerWaalsContact CG-OE1 3.27Å; R55-E59 WeakPolarHBondContact CG-OE1 3.41Å; R55-E59 WeakPolarHBondContact O-CG 3.4Å; R55-E59 PolarHBondContact O-N 3.14Å; R55-E59 VanDerWaalsContact O-N 3.12Å; E59-Y61 PolarHBondContact O-N 2.89Å
60	R	91.8	Very high	93.1	Very high	142 Å²	142	66.5 Å²	66.5	54%	0.536	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.3	173.1	-174.4	177.5	-69.6	175.3	0.9	113	T56 L58 R99	T56-R60 PolarHBondContact O-N 3.26Å; L58-R60 PolarHBondContact O-N 3.09Å; L58-R60 VanDerWaalsContact O-N 3.08Å; R60-R99 PolarHBondContact NH1-O 3.05Å
61	Y	93.6	Very high	92.9	Very high	66 Å²	66	59.2 Å²	59.2	26%	0.259	29%	0.292	S	S	.	.			trans	-125.7	73.5	-177.9	-61.9	-77	0	0	0	110.3	L58 E59 D63 T64 G67 F97 Y98 G101	L58-Y61 PolarHBondContact O-N 3.34Å; L58-Y61 VanDerWaalsContact O-N 3.17Å; E59-Y61 PolarHBondContact O-N 2.89Å; Y61-D63 PolarHBondContact O-N 3.01Å; Y61-T64 PolarHBondContact O-N 3.42Å; Y61-T64 PolarHBondContact O-OG1 2.83Å; Y61-G67 WeakPolarHBondContact O-CA 3.41Å; Y61-F97 HydrophobicContact CD1-CE1 4.23Å; Y61-F97 AromaticContact CD1-CZ 3.87Å; Y61-F97 HydrophobicContact CD1-CZ 3.87Å; Y61-F97 AromaticContact CD2-CE1 3.94Å; Y61-F97 HydrophobicContact CD2-CE1 3.94Å; Y61-F97 HydrophobicContact CD2-CZ 4.19Å; Y61-F97 HydrophobicContact CE1-CE1 4.43Å; Y61-F97 HydrophobicContact CE1-CE2 4.32Å; Y61-F97 AromaticContact CE1-CZ 3.75Å; Y61-F97 HydrophobicContact CE1-CZ 3.75Å; Y61-F97 HydrophobicContact CE2-CE1 4.15Å; Y61-F97 HydrophobicContact CE2-CZ 4.08Å; Y61-F97 AromaticContact CG-CE1 3.99Å; Y61-F97 HydrophobicContact CG-CE1 3.99Å; Y61-F97 HydrophobicContact CG-CZ 4.1Å; Y61-F97 AromaticContact CZ-CZ 3.86Å; Y61-Y98 AromaticContact CD2-CD1 3.72Å; Y61-Y98 HydrophobicContact CD2-CD1 3.72Å; Y61-Y98 HydrophobicContact CD2-CE1 4.2Å; Y61-Y98 HydrophobicContact CD2-CG 4.4Å; Y61-Y98 HydrophobicContact CG-CD1 4.44Å; Y61-G101 WeakPolarHBondContact OH-CA 3.37Å
62	P	93.1	Very high	92.6	Very high	74 Å²	74	62.1 Å²	62.1	48%	0.481	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.9	-171.5	28	-35.9	0	0	0	113.8	T64 S68	P62-T64 PolarHBondContact O-N 2.91Å; P62-S68 WeakPolarHBondContact O-CA 3.28Å; P62-S68 VanDerWaalsContact O-CB 3.25Å; P62-S68 WeakPolarHBondContact O-CB 3.18Å; P62-S68 PolarHBondContact O-N 3.41Å
63	D	90.8	Very high	92.5	Very high	160 Å²	160	65.4 Å²	65.4	86%	0.856	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-2.6	-179.9	-55.9	-38.7	0	0	0	113.6	Y61	Y61-D63 PolarHBondContact O-N 3.01Å
64	T	94.6	Very high	92.4	Very high	12 Å²	12	67.7 Å²	67.7	7%	0.074	33%	0.329	C	S	.	.	S	Bend	trans	-103.6	159.5	-179.2	65.6	0	0	0	0	111.1	Y61 P62 L66 G67 S68 Y98 I123	Y61-T64 PolarHBondContact O-N 3.42Å; Y61-T64 PolarHBondContact O-OG1 2.83Å; P62-T64 PolarHBondContact O-N 2.91Å; T64-L66 VanDerWaalsContact C-N 3.34Å; T64-L66 PolarHBondContact O-N 3.38Å; T64-G67 PolarHBondContact O-N 3.44Å; T64-G67 PolarHBondContact OG1-N 3.37Å; T64-S68 WeakPolarHBondContact O-CB 3.39Å; T64-S68 PolarHBondContact O-N 3.31Å; T64-S68 PolarHBondContact O-OG 3.01Å; T64-Y98 WeakPolarHBondContact CB-OH 3.44Å; T64-Y98 VanDerWaalsContact OG1-CE1 3.27Å; T64-Y98 WeakPolarHBondContact OG1-CE1 3.25Å; T64-Y98 VanDerWaalsContact OG1-CZ 3.32Å; T64-Y98 PolarHBondContact OG1-OH 3.38Å; T64-I123 HydrophobicContact CG2-CG1 4.11Å
65	L	94.9	Very high	92.4	Very high	12 Å²	12	64.9 Å²	64.9	6%	0.063	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-44.8	-175.8	-176.1	154.1	0	0	0	112.9	S68 E70 K71 F74 F84 F120 Y121	L65-S68 PolarHBondContact O-OG 2.88Å; L65-E70 HydrophobicContact CG-CB 4.3Å; L65-K71 PolarHBondContact O-N 2.94Å; L65-F74 HydrophobicContact CD1-CE2 4.13Å; L65-F74 HydrophobicContact CD2-CD2 4.44Å; L65-F74 HydrophobicContact CD2-CE2 4.33Å; L65-F84 HydrophobicContact CD2-CE1 3.82Å; L65-F84 HydrophobicContact CD2-CZ 4.15Å; L65-F120 HydrophobicContact CD1-CD1 4.12Å; L65-F120 HydrophobicContact CD1-CE1 3.97Å; L65-F120 HydrophobicContact CD1-CG 4.49Å; L65-F120 HydrophobicContact CD1-CZ 4.18Å; L65-F120 WeakPolarHBondContact CD1-O 3.23Å; L65-Y121 PolarHBondContact N-O 2.91Å
66	L	95.2	Very high	92.4	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-28.1	-179	-60	176.7	0	0	0	112.6	L44 L58 T64 K71 F84 F91 V94 Y98 Y121	L44-L66 HydrophobicContact CD2-CD2 4.39Å; L58-L66 HydrophobicContact CD1-CB 4.31Å; L58-L66 HydrophobicContact CD2-CB 4Å; L58-L66 HydrophobicContact CD2-CD1 4.3Å; T64-L66 VanDerWaalsContact C-N 3.34Å; T64-L66 PolarHBondContact O-N 3.38Å; L66-K71 WeakPolarHBondContact O-CD 3.45Å; L66-K71 PolarHBondContact O-NZ 3.43Å; L66-F84 HydrophobicContact CD2-CE1 4.35Å; L66-F84 HydrophobicContact CD2-CE2 3.98Å; L66-F84 HydrophobicContact CD2-CZ 3.55Å; L66-F91 HydrophobicContact CD1-CE2 3.89Å; L66-F91 HydrophobicContact CD1-CZ 4.14Å; L66-V94 HydrophobicContact CD1-CG1 4.34Å; L66-Y98 HydrophobicContact CB-CE1 4.33Å; L66-Y98 HydrophobicContact CB-CE2 4.37Å; L66-Y98 HydrophobicContact CD1-CD2 4.46Å; L66-Y98 HydrophobicContact CD1-CE2 3.81Å; L66-Y121 HydrophobicContact CD1-CD1 4.18Å; L66-Y121 HydrophobicContact CD1-CE1 4.42Å; L66-Y121 HydrophobicContact CD2-CD1 4.36Å; L66-Y121 HydrophobicContact CD2-CE1 4.32Å; L66-Y121 HydrophobicContact CG-CD1 4.04Å; L66-Y121 HydrophobicContact CG-CE1 4.42Å
67	G	91.8	Very high	92.4	Very high	9 Å²	9	69 Å²	69	9%	0.093	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-30.8	177.6	0	0	0	0	0	113.1	L58 Y61 T64	L58-G67 VanDerWaalsContact O-CA 3.25Å; L58-G67 WeakPolarHBondContact O-CA 3.42Å; Y61-G67 WeakPolarHBondContact O-CA 3.41Å; T64-G67 PolarHBondContact O-N 3.44Å; T64-G67 PolarHBondContact OG1-N 3.37Å
68	S	92.1	Very high	92.3	Very high	22 Å²	22	75.5 Å²	75.5	15%	0.154	37%	0.373	C	S	.	.	S	Bend	trans	-82.3	-179.1	-177.7	79.8	0	0	0	0	112.5	P62 T64 L65 E70 K71	P62-S68 WeakPolarHBondContact O-CA 3.28Å; P62-S68 VanDerWaalsContact O-CB 3.25Å; P62-S68 WeakPolarHBondContact O-CB 3.18Å; P62-S68 PolarHBondContact O-N 3.41Å; T64-S68 WeakPolarHBondContact O-CB 3.39Å; T64-S68 PolarHBondContact O-N 3.31Å; T64-S68 PolarHBondContact O-OG 3.01Å; L65-S68 PolarHBondContact O-OG 2.88Å; S68-E70 PolarHBondContact O-N 2.9Å; S68-E70 VanDerWaalsContact OG-CB 3.29Å; S68-E70 WeakPolarHBondContact OG-CB 3.39Å; S68-E70 WeakPolarHBondContact OG-CG 3.47Å; S68-E70 PolarHBondContact OG-N 3.25Å; S68-E70 VanDerWaalsContact OG-N 3.09Å; S68-K71 PolarHBondContact O-NZ 3Å
69	T	89.7	Confident	92.1	Very high	121 Å²	121	79 Å²	79	74%	0.742	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-73	-8.9	171.9	50.7	0	0	0	0	112.9	K71 E72	T69-K71 VanDerWaalsContact C-N 3.27Å; T69-K71 PolarHBondContact O-N 2.82Å; T69-E72 WeakPolarHBondContact O-CB 3.47Å; T69-E72 WeakPolarHBondContact O-CG 3.45Å; T69-E72 PolarHBondContact O-N 3.39Å; T69-E72 VanDerWaalsContact O-N 3.14Å
70	E	90.2	Very high	92.1	Very high	121 Å²	121	81.6 Å²	81.6	57%	0.565	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-65.1	-29.8	-177.8	-66.7	176.6	-154.6	0	0	112.7	L65 S68 E72 F73	L65-E70 HydrophobicContact CG-CB 4.3Å; S68-E70 PolarHBondContact O-N 2.9Å; S68-E70 VanDerWaalsContact OG-CB 3.29Å; S68-E70 WeakPolarHBondContact OG-CB 3.39Å; S68-E70 WeakPolarHBondContact OG-CG 3.47Å; S68-E70 PolarHBondContact OG-N 3.25Å; S68-E70 VanDerWaalsContact OG-N 3.09Å; E70-E72 PolarHBondContact O-N 3.05Å; E70-E72 VanDerWaalsContact O-N 3.11Å; E70-F73 WeakPolarHBondContact O-CB 3.48Å; E70-F73 PolarHBondContact O-N 3.5Å; E70-F73 VanDerWaalsContact O-N 3.13Å
71	K	91.6	Very high	92.2	Very high	9 Å²	9	75.6 Å²	75.6	4%	0.039	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-54.8	-29.5	173.6	66.9	171.9	163.9	-72.1	0	113.2	L65 L66 S68 T69 F73 F74 Y82	L65-K71 PolarHBondContact O-N 2.94Å; L66-K71 WeakPolarHBondContact O-CD 3.45Å; L66-K71 PolarHBondContact O-NZ 3.43Å; S68-K71 PolarHBondContact O-NZ 3Å; T69-K71 VanDerWaalsContact C-N 3.27Å; T69-K71 PolarHBondContact O-N 2.82Å; K71-F73 PolarHBondContact O-N 2.82Å; K71-F73 VanDerWaalsContact O-N 3.16Å; K71-F74 PolarHBondContact O-N 2.92Å; K71-Y82 HydrophobicContact CB-CD1 4.21Å; K71-Y82 HydrophobicContact CB-CE1 4.06Å; K71-Y82 HydrophobicContact CD-CE1 4.03Å; K71-Y82 HydrophobicContact CG-CE1 3.87Å; K71-Y82 WeakPolarHBondContact O-CD1 3.44Å; K71-Y82 VanDerWaalsContact O-CE1 3.24Å; K71-Y82 WeakPolarHBondContact O-CE1 3.46Å
72	E	91.1	Very high	92.3	Very high	88 Å²	88	73 Å²	73	41%	0.411	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-63.9	-21.9	-177.1	-54.9	-60	175.9	0	0	112.2	T69 E70 F74 F75 Y82	T69-E72 WeakPolarHBondContact O-CB 3.47Å; T69-E72 WeakPolarHBondContact O-CG 3.45Å; T69-E72 PolarHBondContact O-N 3.39Å; T69-E72 VanDerWaalsContact O-N 3.14Å; E70-E72 PolarHBondContact O-N 3.05Å; E70-E72 VanDerWaalsContact O-N 3.11Å; E72-F74 PolarHBondContact O-N 3.35Å; E72-F75 WeakPolarHBondContact O-CB 3.47Å; E72-F75 PolarHBondContact O-N 3.04Å; E72-Y82 VanDerWaalsContact CD-OH 3.31Å; E72-Y82 PolarHBondContact OE1-OH 3.44Å; E72-Y82 WeakPolarHBondContact OE2-CE1 3.27Å; E72-Y82 PolarHBondContact OE2-OH 3.11Å
73	F	91.9	Very high	92.5	Very high	179 Å²	179	73.7 Å²	73.7	79%	0.785	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-63.7	-26.4	171.4	-175.1	-97.8	0	0	0	113.2	E70 K71	E70-F73 WeakPolarHBondContact O-CB 3.48Å; E70-F73 PolarHBondContact O-N 3.5Å; E70-F73 VanDerWaalsContact O-N 3.13Å; K71-F73 PolarHBondContact O-N 2.82Å; K71-F73 VanDerWaalsContact O-N 3.16Å
74	F	93.2	Very high	92.8	Very high	54 Å²	54	66.1 Å²	66.1	24%	0.237	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-98.5	3.7	-177.9	-60.3	-85.8	0	0	0	112.6	L65 K71 E72 Y82 F83 F84 F120	L65-F74 HydrophobicContact CD1-CE2 4.13Å; L65-F74 HydrophobicContact CD2-CD2 4.44Å; L65-F74 HydrophobicContact CD2-CE2 4.33Å; K71-F74 PolarHBondContact O-N 2.92Å; E72-F74 PolarHBondContact O-N 3.35Å; F74-Y82 CarbonylContact O-C 3.53Å; F74-Y82 VanDerWaalsContact O-CA 3.31Å; F74-Y82 WeakPolarHBondContact O-CA 3.35Å; F74-F83 PolarHBondContact O-N 3.41Å; F74-F84 HydrophobicContact CB-CD1 4.44Å; F74-F84 HydrophobicContact CB-CE1 3.9Å; F74-F84 HydrophobicContact CB-CZ 4.01Å; F74-F84 AromaticContact CD1-CD1 4Å; F74-F84 HydrophobicContact CD1-CD1 4Å; F74-F84 AromaticContact CD1-CE1 3.99Å; F74-F84 HydrophobicContact CD1-CE1 3.99Å; F74-F84 AromaticContact CD2-CE1 3.74Å; F74-F84 HydrophobicContact CD2-CE1 3.74Å; F74-F84 HydrophobicContact CD2-CZ 4.36Å; F74-F84 HydrophobicContact CE1-CD1 4.39Å; F74-F84 HydrophobicContact CE1-CE1 4.47Å; F74-F84 HydrophobicContact CE2-CE1 4.25Å; F74-F84 HydrophobicContact CG-CD1 4.07Å; F74-F84 AromaticContact CG-CE1 3.59Å; F74-F84 HydrophobicContact CG-CE1 3.59Å; F74-F84 HydrophobicContact CG-CZ 4.18Å; F74-F120 HydrophobicContact CE1-CE2 4.48Å; F74-F120 HydrophobicContact CE1-CZ 4.09Å; F74-F120 HydrophobicContact CZ-CE2 4.08Å; F74-F120 AromaticContact CZ-CZ 3.84Å; F74-F120 HydrophobicContact CZ-CZ 3.84Å
75	F	94.3	Very high	92.8	Very high	68 Å²	68	72 Å²	72	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.9	179.9	-170.1	-110.9	0	0	0	111	E72 E77 K80 Y82	E72-F75 WeakPolarHBondContact O-CB 3.47Å; E72-F75 PolarHBondContact O-N 3.04Å; F75-E77 HydrophobicContact CD1-CG 4.24Å; F75-E77 HydrophobicContact CE1-CG 4.25Å; F75-K80 HydrophobicContact CE1-CD 4.48Å; F75-K80 HydrophobicContact CZ-CB 4.46Å; F75-K80 HydrophobicContact CZ-CD 4.02Å; F75-Y82 HydrophobicContact CB-CD1 3.79Å; F75-Y82 HydrophobicContact CB-CE1 3.59Å; F75-Y82 AromaticContact CD2-CD1 3.92Å; F75-Y82 HydrophobicContact CD2-CD1 3.92Å; F75-Y82 AromaticContact CD2-CD2 3.96Å; F75-Y82 HydrophobicContact CD2-CD2 3.96Å; F75-Y82 AromaticContact CD2-CE1 3.68Å; F75-Y82 HydrophobicContact CD2-CE1 3.68Å; F75-Y82 AromaticContact CD2-CE2 3.69Å; F75-Y82 HydrophobicContact CD2-CE2 3.69Å; F75-Y82 HydrophobicContact CD2-CG 4.06Å; F75-Y82 AromaticContact CD2-CZ 3.55Å; F75-Y82 HydrophobicContact CE2-CE2 4.13Å; F75-Y82 HydrophobicContact CG-CD1 4.36Å; F75-Y82 HydrophobicContact CG-CE1 4.02Å
76	N	92	Very high	92.9	Very high	62 Å²	62	73.7 Å²	73.7	33%	0.332	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	117.2	171.7	-173.7	-24.6	0	0	0	109.6	D78 T79 K80 E81	N76-D78 VanDerWaalsContact C-N 3.33Å; N76-D78 PolarHBondContact O-N 3.46Å; N76-D78 PolarHBondContact OD1-N 3.15Å; N76-T79 WeakPolarHBondContact CB-OG1 3.18Å; N76-T79 VanDerWaalsContact CG-OG1 3.27Å; N76-K80 WeakPolarHBondContact O-CA 3.31Å; N76-K80 PolarHBondContact O-N 3.03Å; N76-E81 PolarHBondContact N-O 2.93Å
77	E	90.6	Very high	92.8	Very high	144 Å²	144	76.6 Å²	76.6	67%	0.673	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-31.2	-176.7	-69.6	-164.6	160.3	0	0	113.7	F75 K80	F75-E77 HydrophobicContact CD1-CG 4.24Å; F75-E77 HydrophobicContact CE1-CG 4.25Å; E77-K80 WeakPolarHBondContact O-CD 3.11Å; E77-K80 VanDerWaalsContact O-CE 3.27Å; E77-K80 WeakPolarHBondContact O-CE 3.34Å; E77-K80 PolarHBondContact O-NZ 3.39Å
78	D	90.7	Very high	93	Very high	155 Å²	155	77.6 Å²	77.6	83%	0.829	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-44.9	-176.7	-65.2	-38	0	0	0	111.1	N76	N76-D78 VanDerWaalsContact C-N 3.33Å; N76-D78 PolarHBondContact O-N 3.46Å; N76-D78 PolarHBondContact OD1-N 3.15Å
79	T	89.8	Confident	93	Very high	75 Å²	75	79.1 Å²	79.1	46%	0.46	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-8.4	-178.2	54.2	0	0	0	0	113.3	N76 E81	N76-T79 WeakPolarHBondContact CB-OG1 3.18Å; N76-T79 VanDerWaalsContact CG-OG1 3.27Å; T79-E81 PolarHBondContact O-N 2.99Å; T79-E81 WeakPolarHBondContact OG1-CG 3.24Å
80	K	91.6	Very high	93.2	Very high	141 Å²	141	73.4 Å²	73.4	61%	0.613	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	34.2	-176.9	-60.3	-66.6	-177.5	-164	0	113.3	F75 N76 E77	F75-K80 HydrophobicContact CE1-CD 4.48Å; F75-K80 HydrophobicContact CZ-CB 4.46Å; F75-K80 HydrophobicContact CZ-CD 4.02Å; N76-K80 WeakPolarHBondContact O-CA 3.31Å; N76-K80 PolarHBondContact O-N 3.03Å; E77-K80 WeakPolarHBondContact O-CD 3.11Å; E77-K80 VanDerWaalsContact O-CE 3.27Å; E77-K80 WeakPolarHBondContact O-CE 3.34Å; E77-K80 PolarHBondContact O-NZ 3.39Å
81	E	94.3	Very high	93.5	Very high	16 Å²	16	67.7 Å²	67.7	8%	0.075	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	155.2	177.9	61.5	-178.1	-160.9	0	0	111.2	V43 N45 R50 N76 T79	V43-E81 HydrophobicContact CB-CB 3.91Å; V43-E81 HydrophobicContact CG1-CB 3.87Å; N45-E81 HydrophobicContact CB-CG 4.31Å; N45-E81 PolarHBondContact ND2-OE1 3.38Å; R50-E81 IonicContact CZ-OE2 3.5Å; R50-E81 IonicContact NE-OE2 3.76Å; R50-E81 PolarHBondContact NE-OE2 3.4Å; R50-E81 IonicContact NH2-OE2 2.71Å; N76-E81 PolarHBondContact N-O 2.93Å; T79-E81 PolarHBondContact O-N 2.99Å; T79-E81 WeakPolarHBondContact OG1-CG 3.24Å
82	Y	95.8	Very high	93.6	Very high	10 Å²	10	71.9 Å²	71.9	4%	0.039	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.6	171.8	-63.7	-90.4	0	0	0	109.6	I42 V43 L44 N45 K71 E72 F74 F75	I42-Y82 HydrophobicContact CG2-CD2 3.45Å; I42-Y82 VanDerWaalsContact CG2-CD2 3.45Å; I42-Y82 HydrophobicContact CG2-CE2 3.42Å; I42-Y82 VanDerWaalsContact CG2-CE2 3.42Å; V43-Y82 PolarHBondContact O-N 3.11Å; L44-Y82 HydrophobicContact CD2-CD2 4.02Å; L44-Y82 HydrophobicContact CD2-CG 4.17Å; N45-Y82 PolarHBondContact N-O 3.07Å; K71-Y82 HydrophobicContact CB-CD1 4.21Å; K71-Y82 HydrophobicContact CB-CE1 4.06Å; K71-Y82 HydrophobicContact CD-CE1 4.03Å; K71-Y82 HydrophobicContact CG-CE1 3.87Å; K71-Y82 WeakPolarHBondContact O-CD1 3.44Å; K71-Y82 VanDerWaalsContact O-CE1 3.24Å; K71-Y82 WeakPolarHBondContact O-CE1 3.46Å; E72-Y82 VanDerWaalsContact CD-OH 3.31Å; E72-Y82 PolarHBondContact OE1-OH 3.44Å; E72-Y82 WeakPolarHBondContact OE2-CE1 3.27Å; E72-Y82 PolarHBondContact OE2-OH 3.11Å; F74-Y82 CarbonylContact O-C 3.53Å; F74-Y82 VanDerWaalsContact O-CA 3.31Å; F74-Y82 WeakPolarHBondContact O-CA 3.35Å; F75-Y82 HydrophobicContact CB-CD1 3.79Å; F75-Y82 HydrophobicContact CB-CE1 3.59Å; F75-Y82 AromaticContact CD2-CD1 3.92Å; F75-Y82 HydrophobicContact CD2-CD1 3.92Å; F75-Y82 AromaticContact CD2-CD2 3.96Å; F75-Y82 HydrophobicContact CD2-CD2 3.96Å; F75-Y82 AromaticContact CD2-CE1 3.68Å; F75-Y82 HydrophobicContact CD2-CE1 3.68Å; F75-Y82 AromaticContact CD2-CE2 3.69Å; F75-Y82 HydrophobicContact CD2-CE2 3.69Å; F75-Y82 HydrophobicContact CD2-CG 4.06Å; F75-Y82 AromaticContact CD2-CZ 3.55Å; F75-Y82 HydrophobicContact CE2-CE2 4.13Å; F75-Y82 HydrophobicContact CG-CD1 4.36Å; F75-Y82 HydrophobicContact CG-CE1 4.02Å
83	F	96.5	Very high	93.8	Very high	89 Å²	89	68.2 Å²	68.2	39%	0.39	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129	-177.3	-179.6	-100.6	0	0	0	112.6	N45 F74 D85	N45-F83 HydrophobicContact CB-CD2 4.24Å; N45-F83 CarbonylContact O-C 3.53Å; N45-F83 WeakPolarHBondContact O-CA 3.36Å; F74-F83 PolarHBondContact O-N 3.41Å; F83-D85 HydrophobicContact CE1-CB 4.04Å; F83-D85 HydrophobicContact CZ-CB 4.35Å
84	F	96.6	Very high	94	Very high	1 Å²	1	59.7 Å²	59.7	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.7	177.2	-60.4	-83.8	0	0	0	110.2	L44 N45 V46 S47 L65 L66 F74 R86 F120 Y121	L44-F84 HydrophobicContact CD2-CE2 4.16Å; N45-F84 PolarHBondContact O-N 2.87Å; V46-F84 CarbonylContact C-O 3.47Å; V46-F84 VanDerWaalsContact CA-O 3.31Å; V46-F84 WeakPolarHBondContact CA-O 3.29Å; V46-F84 HydrophobicContact CG1-CB 4.47Å; V46-F84 HydrophobicContact CG2-CB 4.25Å; V46-F84 HydrophobicContact CG2-CD2 4.3Å; S47-F84 PolarHBondContact N-O 2.9Å; L65-F84 HydrophobicContact CD2-CE1 3.82Å; L65-F84 HydrophobicContact CD2-CZ 4.15Å; L66-F84 HydrophobicContact CD2-CE1 4.35Å; L66-F84 HydrophobicContact CD2-CE2 3.98Å; L66-F84 HydrophobicContact CD2-CZ 3.55Å; F74-F84 HydrophobicContact CB-CD1 4.44Å; F74-F84 HydrophobicContact CB-CE1 3.9Å; F74-F84 HydrophobicContact CB-CZ 4.01Å; F74-F84 AromaticContact CD1-CD1 4Å; F74-F84 HydrophobicContact CD1-CD1 4Å; F74-F84 AromaticContact CD1-CE1 3.99Å; F74-F84 HydrophobicContact CD1-CE1 3.99Å; F74-F84 AromaticContact CD2-CE1 3.74Å; F74-F84 HydrophobicContact CD2-CE1 3.74Å; F74-F84 HydrophobicContact CD2-CZ 4.36Å; F74-F84 HydrophobicContact CE1-CD1 4.39Å; F74-F84 HydrophobicContact CE1-CE1 4.47Å; F74-F84 HydrophobicContact CE2-CE1 4.25Å; F74-F84 HydrophobicContact CG-CD1 4.07Å; F74-F84 AromaticContact CG-CE1 3.59Å; F74-F84 HydrophobicContact CG-CE1 3.59Å; F74-F84 HydrophobicContact CG-CZ 4.18Å; F84-R86 VanDerWaalsContact C-N 3.31Å; F84-R86 HydrophobicContact CB-CB 4.27Å; F84-R86 HydrophobicContact CB-CG 3.89Å; F84-R86 PolarHBondContact O-N 2.93Å; F84-R86 VanDerWaalsContact O-N 3.1Å; F84-F120 AromaticContact CD1-CE1 3.96Å; F84-F120 HydrophobicContact CD1-CE1 3.96Å; F84-F120 AromaticContact CD1-CZ 3.99Å; F84-F120 HydrophobicContact CD1-CZ 3.99Å; F84-F120 HydrophobicContact CE1-CE1 4.29Å; F84-F120 HydrophobicContact CE1-CZ 4.4Å; F84-Y121 HydrophobicContact CD1-CE1 4.34Å; F84-Y121 HydrophobicContact CE1-CE1 4.39Å
85	D	96	Very high	94.1	Very high	136 Å²	136	57.2 Å²	57.2	73%	0.727	28%	0.279	S	S	*	.			trans	-85.1	73.7	173.9	-169.1	22.3	0	0	0	110.4	F83	F83-D85 HydrophobicContact CE1-CB 4.04Å; F83-D85 HydrophobicContact CZ-CB 4.35Å
86	R	95.4	Very high	94.1	Very high	47 Å²	47	56.3 Å²	56.3	18%	0.177	28%	0.277	C	S	.	.	S	Bend	trans	-144.9	171.9	-163.7	-60.3	-75.8	-71.2	-142.6	-17.1	111.8	V46 S47 F84 P88 E117 F120	V46-R86 HydrophobicContact CG1-CB 3.96Å; V46-R86 WeakPolarHBondContact CG1-O 3.37Å; S47-R86 WeakPolarHBondContact CB-O 3.37Å; S47-R86 PolarHBondContact OG-N 3.31Å; S47-R86 PolarHBondContact OG-O 3.4Å; F84-R86 VanDerWaalsContact C-N 3.31Å; F84-R86 HydrophobicContact CB-CB 4.27Å; F84-R86 HydrophobicContact CB-CG 3.89Å; F84-R86 PolarHBondContact O-N 2.93Å; F84-R86 VanDerWaalsContact O-N 3.1Å; R86-P88 VanDerWaalsContact O-CD 3.25Å; R86-P88 WeakPolarHBondContact O-CD 3.33Å; R86-E117 IonicContact CZ-OE1 3.19Å; R86-E117 IonicContact CZ-OE2 2.59Å; R86-E117 IonicContact NE-OE1 2.89Å; R86-E117 PolarHBondContact NE-OE1 2.92Å; R86-E117 IonicContact NE-OE2 3.62Å; R86-E117 PolarHBondContact NE-OE2 3.4Å; R86-E117 PolarHBondContact NH2-O 3.33Å; R86-E117 IonicContact NH2-OE1 3.4Å; R86-E117 IonicContact NH2-OE2 3.44Å; R86-E117 PolarHBondContact NH2-OE2 2.94Å; R86-F120 HydrophobicContact CG-CE1 4.34Å; R86-F120 HydrophobicContact CG-CZ 4.41Å; R86-F120 VanDerWaalsContact CZ-CB 3.41Å
87	D	94.5	Very high	94.3	Very high	61 Å²	61	53.5 Å²	53.5	33%	0.326	26%	0.262	S	S	.	.			trans	-72	115.8	-179.9	-168.6	-57.7	0	0	0	112.3	E89 V90 F91	D87-E89 VanDerWaalsContact C-N 3.33Å; D87-E89 PolarHBondContact O-N 3.3Å; D87-E89 WeakPolarHBondContact OD1-CA 3.25Å; D87-E89 WeakPolarHBondContact OD1-CB 3.47Å; D87-E89 PolarHBondContact OD1-N 2.68Å; D87-V90 HydrophobicContact CB-CB 4.3Å; D87-V90 HydrophobicContact CB-CG2 4.14Å; D87-V90 PolarHBondContact OD1-N 2.98Å; D87-V90 VanDerWaalsContact OD1-N 3.09Å; D87-F91 WeakPolarHBondContact O-CB 3.32Å; D87-F91 PolarHBondContact O-N 3.34Å; D87-F91 VanDerWaalsContact O-N 3.16Å
88	P	95.1	Very high	94.5	Very high	30 Å²	30	46.6 Å²	46.6	20%	0.195	23%	0.23	C	C	.	.	H	α-helix	trans	-74.5	-19.2	-177.5	30.4	-34.9	0	0	0	114.1	V46 R49 F51 R86	V46-P88 HydrophobicContact CB-CB 4.33Å; V46-P88 HydrophobicContact CG1-CB 4.13Å; R49-P88 HydrophobicContact CB-CB 3.8Å; R49-P88 HydrophobicContact CG-CB 4.45Å; F51-P88 HydrophobicContact CE2-CB 4.41Å; F51-P88 WeakPolarHBondContact CZ-O 3.38Å; R86-P88 VanDerWaalsContact O-CD 3.25Å; R86-P88 WeakPolarHBondContact O-CD 3.33Å
89	E	92.7	Very high	94.6	Very high	54 Å²	54	44.7 Å²	44.7	25%	0.252	21%	0.211	S	C	.	.	H	α-helix	trans	-79.1	-42.2	178.5	-165	54.8	-138.3	0	0	110.8	R49 D87 F91 R92 Y108	R49-E89 IonicContact CZ-OE2 2.83Å; R49-E89 IonicContact NH1-OE2 3.07Å; R49-E89 PolarHBondContact NH1-OE2 3.28Å; D87-E89 VanDerWaalsContact C-N 3.33Å; D87-E89 PolarHBondContact O-N 3.3Å; D87-E89 WeakPolarHBondContact OD1-CA 3.25Å; D87-E89 WeakPolarHBondContact OD1-CB 3.47Å; D87-E89 PolarHBondContact OD1-N 2.68Å; E89-F91 VanDerWaalsContact C-N 3.34Å; E89-R92 WeakPolarHBondContact O-CB 3.27Å; E89-R92 PolarHBondContact O-N 3.34Å; E89-R92 IonicContact OE1-CZ 2.68Å; E89-R92 IonicContact OE1-NE 3.07Å; E89-R92 PolarHBondContact OE1-NE 3.43Å; E89-R92 IonicContact OE1-NH2 3.8Å; E89-Y108 HydrophobicContact CG-CE2 4.17Å; E89-Y108 PolarHBondContact OE1-OH 3.42Å
90	V	93.9	Very high	94.7	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-66.6	-38.6	173.7	-178.1	0	0	0	0	111.2	D87 R92 C93 V94 E109 Y114 E117	D87-V90 HydrophobicContact CB-CB 4.3Å; D87-V90 HydrophobicContact CB-CG2 4.14Å; D87-V90 PolarHBondContact OD1-N 2.98Å; D87-V90 VanDerWaalsContact OD1-N 3.09Å; V90-R92 PolarHBondContact O-N 3.21Å; V90-R92 VanDerWaalsContact O-N 3.12Å; V90-C93 WeakPolarHBondContact O-CB 3.42Å; V90-C93 PolarHBondContact O-N 3.07Å; V90-V94 PolarHBondContact O-N 2.84Å; V90-E109 HydrophobicContact CG2-CG 3.84Å; V90-Y114 HydrophobicContact CG1-CD2 3.65Å; V90-Y114 HydrophobicContact CG1-CE2 4.03Å; V90-E117 HydrophobicContact CB-CB 4.34Å; V90-E117 HydrophobicContact CB-CG 4Å; V90-E117 HydrophobicContact CG1-CB 3.54Å; V90-E117 HydrophobicContact CG1-CG 3.75Å; V90-E117 HydrophobicContact CG2-CG 4.37Å
91	F	96.1	Very high	94.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-56.9	-30.3	177.9	-173.5	-106	0	0	0	113.5	L44 V46 F51 L66 D87 E89 C93 V94 L95 Y121	L44-F91 HydrophobicContact CB-CE1 4.19Å; L44-F91 HydrophobicContact CB-CZ 4.03Å; L44-F91 HydrophobicContact CD1-CE1 4.27Å; L44-F91 HydrophobicContact CD1-CZ 3.77Å; L44-F91 HydrophobicContact CG-CZ 4.46Å; V46-F91 HydrophobicContact CB-CD1 4.42Å; V46-F91 HydrophobicContact CB-CG 4.41Å; V46-F91 HydrophobicContact CG1-CB 4.2Å; V46-F91 HydrophobicContact CG1-CG 4.44Å; V46-F91 HydrophobicContact CG2-CB 4.23Å; V46-F91 HydrophobicContact CG2-CD1 3.52Å; V46-F91 HydrophobicContact CG2-CD2 3.92Å; V46-F91 HydrophobicContact CG2-CE1 3.69Å; V46-F91 HydrophobicContact CG2-CE2 4.05Å; V46-F91 HydrophobicContact CG2-CG 3.61Å; V46-F91 HydrophobicContact CG2-CZ 3.93Å; F51-F91 HydrophobicContact CB-CD1 4.47Å; F51-F91 HydrophobicContact CB-CE1 3.9Å; F51-F91 HydrophobicContact CD1-CD1 4.16Å; F51-F91 HydrophobicContact CD1-CE1 4.34Å; F51-F91 AromaticContact CD2-CD1 3.48Å; F51-F91 HydrophobicContact CD2-CD1 3.48Å; F51-F91 VanDerWaalsContact CD2-CD1 3.48Å; F51-F91 AromaticContact CD2-CE1 3.66Å; F51-F91 HydrophobicContact CD2-CE1 3.66Å; F51-F91 HydrophobicContact CE1-CD1 4.24Å; F51-F91 AromaticContact CE2-CD1 3.58Å; F51-F91 HydrophobicContact CE2-CD1 3.58Å; F51-F91 HydrophobicContact CE2-CE1 4.25Å; F51-F91 AromaticContact CG-CD1 3.78Å; F51-F91 HydrophobicContact CG-CD1 3.78Å; F51-F91 AromaticContact CG-CE1 3.71Å; F51-F91 HydrophobicContact CG-CE1 3.71Å; F51-F91 AromaticContact CZ-CD1 3.96Å; F51-F91 HydrophobicContact CZ-CD1 3.96Å; L66-F91 HydrophobicContact CD1-CE2 3.89Å; L66-F91 HydrophobicContact CD1-CZ 4.14Å; D87-F91 WeakPolarHBondContact O-CB 3.32Å; D87-F91 PolarHBondContact O-N 3.34Å; D87-F91 VanDerWaalsContact O-N 3.16Å; E89-F91 VanDerWaalsContact C-N 3.34Å; F91-C93 PolarHBondContact O-N 2.76Å; F91-V94 HydrophobicContact CD2-CB 4.31Å; F91-V94 HydrophobicContact CD2-CG1 4.35Å; F91-V94 HydrophobicContact CE2-CG1 4.41Å; F91-V94 WeakPolarHBondContact O-CB 3.25Å; F91-V94 PolarHBondContact O-N 2.81Å; F91-L95 HydrophobicContact CE1-CB 4.3Å; F91-L95 HydrophobicContact CE1-CD2 4.36Å; F91-L95 WeakPolarHBondContact O-CB 3.34Å; F91-L95 PolarHBondContact O-N 3.19Å; F91-Y121 AromaticContact CD2-CE1 3.97Å; F91-Y121 HydrophobicContact CD2-CE1 3.97Å; F91-Y121 AromaticContact CD2-CE2 3.82Å; F91-Y121 HydrophobicContact CD2-CE2 3.82Å; F91-Y121 AromaticContact CD2-CZ 3.4Å; F91-Y121 VanDerWaalsContact CD2-CZ 3.4Å; F91-Y121 WeakPolarHBondContact CD2-OH 3.41Å; F91-Y121 AromaticContact CE2-CE1 3.71Å; F91-Y121 HydrophobicContact CE2-CE1 3.71Å; F91-Y121 HydrophobicContact CE2-CE2 4.38Å; F91-Y121 AromaticContact CE2-CZ 3.65Å
92	R	94.6	Very high	94.5	Very high	97 Å²	97	45.1 Å²	45.1	37%	0.366	22%	0.22	S	C	.	.	H	α-helix	trans	-58.1	-37.9	175.1	-169.8	179.7	63.5	74.2	3.5	111.8	F51 E89 V90 N96	F51-R92 HydrophobicContact CE1-CB 4.39Å; E89-R92 WeakPolarHBondContact O-CB 3.27Å; E89-R92 PolarHBondContact O-N 3.34Å; E89-R92 IonicContact OE1-CZ 2.68Å; E89-R92 IonicContact OE1-NE 3.07Å; E89-R92 PolarHBondContact OE1-NE 3.43Å; E89-R92 IonicContact OE1-NH2 3.8Å; V90-R92 PolarHBondContact O-N 3.21Å; V90-R92 VanDerWaalsContact O-N 3.12Å; R92-N96 WeakPolarHBondContact O-CB 3.37Å; R92-N96 VanDerWaalsContact O-CG 3.23Å; R92-N96 PolarHBondContact O-N 3.16Å; R92-N96 VanDerWaalsContact O-N 3.13Å; R92-N96 PolarHBondContact O-ND2 3.18Å
93	C	94.2	Very high	94.4	Very high	12 Å²	12	44.7 Å²	44.7	8%	0.081	22%	0.218	C	C	.	.	H	α-helix	trans	-72.3	-41.2	176.5	-69.8	0	0	0	0	112	V90 F91 N96 F97 P106 Y114	V90-C93 WeakPolarHBondContact O-CB 3.42Å; V90-C93 PolarHBondContact O-N 3.07Å; F91-C93 PolarHBondContact O-N 2.76Å; C93-N96 PolarHBondContact O-N 3.17Å; C93-F97 PolarHBondContact O-N 2.96Å; C93-P106 WeakPolarHBondContact SG-CG 3.22Å; C93-Y114 HydrophobicContact CB-CE2 4.32Å
94	V	95.9	Very high	94.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-57.3	-50.9	173.9	172.1	0	0	0	0	110.4	L66 V90 F91 N96 F97 Y98 L118 Y121 I123	L66-V94 HydrophobicContact CD1-CG1 4.34Å; V90-V94 PolarHBondContact O-N 2.84Å; F91-V94 HydrophobicContact CD2-CB 4.31Å; F91-V94 HydrophobicContact CD2-CG1 4.35Å; F91-V94 HydrophobicContact CE2-CG1 4.41Å; F91-V94 WeakPolarHBondContact O-CB 3.25Å; F91-V94 PolarHBondContact O-N 2.81Å; V94-N96 VanDerWaalsContact C-N 3.33Å; V94-N96 PolarHBondContact O-N 3.42Å; V94-F97 VanDerWaalsContact O-CB 3.31Å; V94-F97 WeakPolarHBondContact O-CB 3.37Å; V94-F97 PolarHBondContact O-N 3.4Å; V94-F97 VanDerWaalsContact O-N 3.12Å; V94-Y98 HydrophobicContact CG1-CE2 3.96Å; V94-Y98 VanDerWaalsContact O-CD2 3.22Å; V94-Y98 WeakPolarHBondContact O-CD2 3.33Å; V94-Y98 PolarHBondContact O-N 2.77Å; V94-L118 HydrophobicContact CG2-CD2 4.33Å; V94-Y121 HydrophobicContact CB-CD2 4.35Å; V94-Y121 HydrophobicContact CG1-CD1 4.34Å; V94-Y121 HydrophobicContact CG1-CD2 3.89Å; V94-Y121 HydrophobicContact CG1-CE2 4.44Å; V94-Y121 HydrophobicContact CG1-CG 3.85Å; V94-Y121 HydrophobicContact CG2-CD2 3.76Å; V94-Y121 HydrophobicContact CG2-CE2 4.23Å; V94-Y121 HydrophobicContact CG2-CG 4.48Å; V94-I123 HydrophobicContact CG1-CD1 3.79Å
95	L	95.9	Very high	94	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-36.6	-179.8	-174.9	59.7	0	0	0	112.7	L44 F51 T53 L58 F91 F97 Y98 R99	L44-L95 HydrophobicContact CD1-CD1 4.28Å; F51-L95 HydrophobicContact CB-CD2 3.84Å; F51-L95 HydrophobicContact CD1-CD2 3.86Å; F51-L95 HydrophobicContact CG-CD2 4.19Å; T53-L95 HydrophobicContact CG2-CD1 4.02Å; L58-L95 HydrophobicContact CD2-CD1 4.48Å; F91-L95 HydrophobicContact CE1-CB 4.3Å; F91-L95 HydrophobicContact CE1-CD2 4.36Å; F91-L95 WeakPolarHBondContact O-CB 3.34Å; F91-L95 PolarHBondContact O-N 3.19Å; L95-F97 VanDerWaalsContact C-N 3.27Å; L95-F97 PolarHBondContact O-N 3Å; L95-Y98 PolarHBondContact O-N 2.91Å; L95-R99 WeakPolarHBondContact O-CG 3.47Å; L95-R99 PolarHBondContact O-N 3.38Å
96	N	94.6	Very high	93.7	Very high	49 Å²	49	38.6 Å²	38.6	26%	0.262	19%	0.188	S	C	.	.	H	α-helix	trans	-66	-29.4	175.6	-78.7	-19.1	0	0	0	112.8	R92 C93 V94 R99 T100	R92-N96 WeakPolarHBondContact O-CB 3.37Å; R92-N96 VanDerWaalsContact O-CG 3.23Å; R92-N96 PolarHBondContact O-N 3.16Å; R92-N96 VanDerWaalsContact O-N 3.13Å; R92-N96 PolarHBondContact O-ND2 3.18Å; C93-N96 PolarHBondContact O-N 3.17Å; V94-N96 VanDerWaalsContact C-N 3.33Å; V94-N96 PolarHBondContact O-N 3.42Å; N96-R99 PolarHBondContact O-N 2.88Å; N96-T100 WeakPolarHBondContact O-CB 3.42Å; N96-T100 PolarHBondContact O-N 2.97Å; N96-T100 PolarHBondContact O-OG1 3.17Å
97	F	95.3	Very high	93.2	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.013	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-45.7	171.1	162.3	-102	0	0	0	111.4	Y61 C93 V94 L95 R99 G101 L103 I123 I127	Y61-F97 HydrophobicContact CD1-CE1 4.23Å; Y61-F97 AromaticContact CD1-CZ 3.87Å; Y61-F97 HydrophobicContact CD1-CZ 3.87Å; Y61-F97 AromaticContact CD2-CE1 3.94Å; Y61-F97 HydrophobicContact CD2-CE1 3.94Å; Y61-F97 HydrophobicContact CD2-CZ 4.19Å; Y61-F97 HydrophobicContact CE1-CE1 4.43Å; Y61-F97 HydrophobicContact CE1-CE2 4.32Å; Y61-F97 AromaticContact CE1-CZ 3.75Å; Y61-F97 HydrophobicContact CE1-CZ 3.75Å; Y61-F97 HydrophobicContact CE2-CE1 4.15Å; Y61-F97 HydrophobicContact CE2-CZ 4.08Å; Y61-F97 AromaticContact CG-CE1 3.99Å; Y61-F97 HydrophobicContact CG-CE1 3.99Å; Y61-F97 HydrophobicContact CG-CZ 4.1Å; Y61-F97 AromaticContact CZ-CZ 3.86Å; C93-F97 PolarHBondContact O-N 2.96Å; V94-F97 VanDerWaalsContact O-CB 3.31Å; V94-F97 WeakPolarHBondContact O-CB 3.37Å; V94-F97 PolarHBondContact O-N 3.4Å; V94-F97 VanDerWaalsContact O-N 3.12Å; L95-F97 VanDerWaalsContact C-N 3.27Å; L95-F97 PolarHBondContact O-N 3Å; F97-R99 VanDerWaalsContact C-N 3.3Å; F97-R99 PolarHBondContact O-N 3.14Å; F97-G101 WeakPolarHBondContact O-CA 3.33Å; F97-G101 PolarHBondContact O-N 2.79Å; F97-L103 HydrophobicContact CB-CB 4.41Å; F97-L103 HydrophobicContact CB-CD1 3.88Å; F97-L103 HydrophobicContact CD2-CB 3.97Å; F97-L103 HydrophobicContact CG-CB 4.46Å; F97-L103 HydrophobicContact CG-CD1 4.4Å; F97-I123 HydrophobicContact CD1-CD1 3.67Å; F97-I123 HydrophobicContact CD1-CG1 4.31Å; F97-I123 HydrophobicContact CD1-CG2 4.46Å; F97-I123 HydrophobicContact CE1-CD1 4.07Å; F97-I123 HydrophobicContact CE1-CG1 4.21Å; F97-I123 HydrophobicContact CE1-CG2 4.29Å; F97-I123 HydrophobicContact CG-CD1 4.49Å; F97-I127 HydrophobicContact CE2-CG2 3.77Å; F97-I127 HydrophobicContact CZ-CG2 4.48Å
98	Y	94.8	Very high	92.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-38.3	176	-69.1	-91	0	0	0	112.7	L58 Y61 T64 L66 V94 L95 I123	L58-Y98 HydrophobicContact CD2-CD1 3.94Å; L58-Y98 HydrophobicContact CD2-CD2 4.27Å; L58-Y98 HydrophobicContact CD2-CE1 4.33Å; L58-Y98 HydrophobicContact CD2-CG 3.91Å; Y61-Y98 AromaticContact CD2-CD1 3.72Å; Y61-Y98 HydrophobicContact CD2-CD1 3.72Å; Y61-Y98 HydrophobicContact CD2-CE1 4.2Å; Y61-Y98 HydrophobicContact CD2-CG 4.4Å; Y61-Y98 HydrophobicContact CG-CD1 4.44Å; T64-Y98 WeakPolarHBondContact CB-OH 3.44Å; T64-Y98 VanDerWaalsContact OG1-CE1 3.27Å; T64-Y98 WeakPolarHBondContact OG1-CE1 3.25Å; T64-Y98 VanDerWaalsContact OG1-CZ 3.32Å; T64-Y98 PolarHBondContact OG1-OH 3.38Å; L66-Y98 HydrophobicContact CB-CE1 4.33Å; L66-Y98 HydrophobicContact CB-CE2 4.37Å; L66-Y98 HydrophobicContact CD1-CD2 4.46Å; L66-Y98 HydrophobicContact CD1-CE2 3.81Å; V94-Y98 HydrophobicContact CG1-CE2 3.96Å; V94-Y98 VanDerWaalsContact O-CD2 3.22Å; V94-Y98 WeakPolarHBondContact O-CD2 3.33Å; V94-Y98 PolarHBondContact O-N 2.77Å; L95-Y98 PolarHBondContact O-N 2.91Å; Y98-I123 HydrophobicContact CE2-CD1 4.12Å
99	R	94	Very high	92.5	Very high	114 Å²	114	48.6 Å²	48.6	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-69.7	-46.8	-179.6	-69.3	170.3	173.6	171.4	-5.1	112.7	Q52 T57 R60 L95 N96 F97	Q52-R99 PolarHBondContact O-NH2 3.32Å; T57-R99 HydrophobicContact CG2-CG 3.92Å; R60-R99 PolarHBondContact NH1-O 3.05Å; L95-R99 WeakPolarHBondContact O-CG 3.47Å; L95-R99 PolarHBondContact O-N 3.38Å; N96-R99 PolarHBondContact O-N 2.88Å; F97-R99 VanDerWaalsContact C-N 3.3Å; F97-R99 PolarHBondContact O-N 3.14Å
100	T	91.9	Very high	92.3	Very high	84 Å²	84	49 Å²	49	52%	0.515	23%	0.228	S	C	.	.	H	α-helix	trans	-104.8	-18.3	-168.7	67	0	0	0	0	114	N96 K102	N96-T100 WeakPolarHBondContact O-CB 3.42Å; N96-T100 PolarHBondContact O-N 2.97Å; N96-T100 PolarHBondContact O-OG1 3.17Å; T100-K102 PolarHBondContact O-N 3.34Å; T100-K102 PolarHBondContact OG1-N 3.43Å; T100-K102 PolarHBondContact OG1-O 3.4Å
101	G	90.2	Very high	92.2	Very high	24 Å²	24	49.3 Å²	49.3	25%	0.247	23%	0.229	C	C	.	.	S	Bend	trans	72.5	6.8	-169.9	0	0	0	0	0	114.7	Y61 F97	Y61-G101 WeakPolarHBondContact OH-CA 3.37Å; F97-G101 WeakPolarHBondContact O-CA 3.33Å; F97-G101 PolarHBondContact O-N 2.79Å
102	K	90	Very high	91.9	Very high	134 Å²	134	51.6 Å²	51.6	58%	0.583	25%	0.245	S	C	*	.			trans	-117.7	126.3	179.9	-63.1	-175.9	-179.5	-177.9	0	110.5	T100	T100-K102 PolarHBondContact O-N 3.34Å; T100-K102 PolarHBondContact OG1-N 3.43Å; T100-K102 PolarHBondContact OG1-O 3.4Å
103	L	93.9	Very high	91.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-96.1	129.4	176.1	-173.1	66.6	0	0	0	110.2	F97 Y114 L118 I123 I128 G129	F97-L103 HydrophobicContact CB-CB 4.41Å; F97-L103 HydrophobicContact CB-CD1 3.88Å; F97-L103 HydrophobicContact CD2-CB 3.97Å; F97-L103 HydrophobicContact CG-CB 4.46Å; F97-L103 HydrophobicContact CG-CD1 4.4Å; L103-Y114 WeakPolarHBondContact CD1-OH 3.41Å; L103-L118 HydrophobicContact CD1-CD2 4.01Å; L103-L118 HydrophobicContact CD2-CD1 3.95Å; L103-L118 HydrophobicContact CD2-CD2 3.93Å; L103-I123 HydrophobicContact CD2-CG2 3.83Å; L103-I128 HydrophobicContact CD2-CG1 3.78Å; L103-I128 HydrophobicContact CG-CG1 4.14Å; L103-G129 PolarHBondContact O-N 2.93Å
104	H	92.4	Very high	91.8	Very high	77 Å²	77	48.2 Å²	48.2	36%	0.356	24%	0.239	S	C	.	.			trans	-123.3	134.7	-178.5	-67.5	-79.9	0	0	0	110.8	Y114 C131	H104-Y114 PolarHBondContact O-OH 3.46Å; H104-C131 PolarHBondContact CE1-SG 3.08Å; H104-C131 PolarHBondContact ND1-SG 3.42Å
105	Y	92.6	Very high	91.6	Very high	7 Å²	7	49.7 Å²	49.7	3%	0.027	25%	0.247	C	C	.	.			trans	-88.8	121.7	177	172.2	-120.2	0	0	0	111.2	E109 I111 Y114 Y136 R139	Y105-E109 PolarHBondContact OH-O 3.25Å; Y105-I111 HydrophobicContact CD2-CD1 4.47Å; Y105-I111 HydrophobicContact CE2-CD1 3.96Å; Y105-Y114 AromaticContact CD2-CD1 3.63Å; Y105-Y114 HydrophobicContact CD2-CD1 3.63Å; Y105-Y114 HydrophobicContact CD2-CD2 4.38Å; Y105-Y114 AromaticContact CD2-CE1 3.85Å; Y105-Y114 HydrophobicContact CD2-CE1 3.85Å; Y105-Y114 AromaticContact CD2-CG 3.9Å; Y105-Y114 HydrophobicContact CD2-CG 3.9Å; Y105-Y114 HydrophobicContact CE2-CD1 4.18Å; Y105-Y114 HydrophobicContact CE2-CG 4.16Å; Y105-Y136 HydrophobicContact CD1-CD2 4.46Å; Y105-Y136 HydrophobicContact CD2-CD2 4.16Å; Y105-Y136 HydrophobicContact CG-CD2 4.05Å; Y105-R139 HydrophobicContact CE1-CG 4.35Å; Y105-R139 PolarHBondContact OH-NH2 2.91Å; Y105-R139 VanDerWaalsContact OH-NH2 3.16Å
106	P	90.8	Very high	91.6	Very high	15 Å²	15	54.3 Å²	54.3	10%	0.097	27%	0.271	C	S	.	.			trans	-75.2	129.5	175	-15.6	31.3	0	0	0	112.5	C93 Y108 E109 Y114	C93-P106 WeakPolarHBondContact SG-CG 3.22Å; P106-Y108 VanDerWaalsContact C-N 3.31Å; P106-Y108 HydrophobicContact CB-CD1 4.36Å; P106-Y108 HydrophobicContact CB-CE1 3.94Å; P106-Y108 HydrophobicContact CB-CE2 4.26Å; P106-Y108 PolarHBondContact O-N 3.11Å; P106-E109 HydrophobicContact CB-CB 4.14Å; P106-E109 PolarHBondContact O-N 3.22Å; P106-Y114 HydrophobicContact CG-CE2 4.43Å
107	R	84.1	Confident	91.6	Very high	171 Å²	171	53 Å²	53	65%	0.645	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-32	-175.9	-62.1	-170.5	162.4	170.2	-7.1	115.1	E109 E135	R107-E109 VanDerWaalsContact C-N 3.29Å; R107-E135 VanDerWaalsContact CD-OE1 3.31Å; R107-E135 WeakPolarHBondContact CD-OE1 3.25Å; R107-E135 VanDerWaalsContact CG-OE1 3.29Å; R107-E135 WeakPolarHBondContact CG-OE1 3.33Å; R107-E135 IonicContact CZ-OE1 3.96Å; R107-E135 IonicContact CZ-OE2 3.23Å; R107-E135 VanDerWaalsContact CZ-OE2 3.23Å; R107-E135 VanDerWaalsContact NE-CD 3.32Å; R107-E135 IonicContact NE-OE1 3.15Å; R107-E135 PolarHBondContact NE-OE1 3.45Å; R107-E135 VanDerWaalsContact NE-OE1 3.15Å; R107-E135 IonicContact NE-OE2 2.71Å; R107-E135 PolarHBondContact NE-OE2 2.9Å; R107-E135 IonicContact NH2-OE2 2.93Å; R107-E135 PolarHBondContact NH2-OE2 3.25Å
108	Y	85.8	Confident	91.6	Very high	144 Å²	144	52.9 Å²	52.9	57%	0.565	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-12.3	-177.4	54.3	-96.1	0	0	0	112.7	E89 P106	E89-Y108 HydrophobicContact CG-CE2 4.17Å; E89-Y108 PolarHBondContact OE1-OH 3.42Å; P106-Y108 VanDerWaalsContact C-N 3.31Å; P106-Y108 HydrophobicContact CB-CD1 4.36Å; P106-Y108 HydrophobicContact CB-CE1 3.94Å; P106-Y108 HydrophobicContact CB-CE2 4.26Å; P106-Y108 PolarHBondContact O-N 3.11Å
109	E	88.9	Confident	91.6	Very high	32 Å²	32	56.2 Å²	56.2	15%	0.15	29%	0.291	C	S	.	.	S	Bend	trans	-88.3	147.6	-172.3	-160.3	51.9	-108.5	0	0	112.5	V90 Y105 P106 R107 I111 R139	V90-E109 HydrophobicContact CG2-CG 3.84Å; Y105-E109 PolarHBondContact OH-O 3.25Å; P106-E109 HydrophobicContact CB-CB 4.14Å; P106-E109 PolarHBondContact O-N 3.22Å; R107-E109 VanDerWaalsContact C-N 3.29Å; E109-I111 PolarHBondContact O-N 3.32Å; E109-R139 PolarHBondContact O-NH2 3.27Å
110	C	89.2	Confident	91.6	Very high	64 Å²	64	53.9 Å²	53.9	43%	0.432	28%	0.284	S	S	.	.			trans	-66.1	129.9	172.8	-177.3	0	0	0	0	109.9	S112 A113 Y114	C110-S112 VanDerWaalsContact C-N 3.28Å; C110-S112 PolarHBondContact O-N 3.36Å; C110-A113 HydrophobicContact CB-CB 3.95Å; C110-A113 PolarHBondContact O-N 3.49Å; C110-Y114 WeakPolarHBondContact O-CB 3.37Å; C110-Y114 PolarHBondContact O-N 2.91Å
111	I	91.4	Very high	91.8	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-36.1	-179.3	-173.1	65.4	0	0	0	112.3	Y105 E109 D115 Y136 R139 K140 N143	Y105-I111 HydrophobicContact CD2-CD1 4.47Å; Y105-I111 HydrophobicContact CE2-CD1 3.96Å; E109-I111 PolarHBondContact O-N 3.32Å; I111-D115 WeakPolarHBondContact O-CB 3.24Å; I111-D115 PolarHBondContact O-N 3.44Å; I111-Y136 HydrophobicContact CD1-CD2 3.24Å; I111-Y136 HydrophobicContact CD1-CE2 3.25Å; I111-Y136 HydrophobicContact CD1-CG 4.16Å; I111-Y136 HydrophobicContact CG1-CE2 4.44Å; I111-R139 HydrophobicContact CB-CB 4.36Å; I111-R139 HydrophobicContact CD1-CB 4.41Å; I111-R139 HydrophobicContact CG1-CB 4.34Å; I111-K140 HydrophobicContact CD1-CB 4.49Å; I111-K140 HydrophobicContact CG1-CB 4.2Å; I111-N143 HydrophobicContact CG2-CB 3.56Å
112	S	90.4	Very high	91.9	Very high	47 Å²	47	50.3 Å²	50.3	33%	0.329	26%	0.264	S	S	.	.	H	α-helix	trans	-67.6	-49.1	177.1	-163.5	0	0	0	0	111.1	C110 Y114 D115 D116	C110-S112 VanDerWaalsContact C-N 3.28Å; C110-S112 PolarHBondContact O-N 3.36Å; S112-Y114 VanDerWaalsContact C-N 3.28Å; S112-Y114 PolarHBondContact O-N 3.34Å; S112-D115 PolarHBondContact O-N 3.37Å; S112-D116 WeakPolarHBondContact O-CB 3.33Å; S112-D116 PolarHBondContact O-N 3.44Å; S112-D116 VanDerWaalsContact O-OD2 3.14Å
113	A	91.4	Very high	92.1	Very high	38 Å²	38	44.1 Å²	44.1	31%	0.314	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-39.1	179.2	0	0	0	0	0	111.4	C110 D116 E117	C110-A113 HydrophobicContact CB-CB 3.95Å; C110-A113 PolarHBondContact O-N 3.49Å; A113-D116 PolarHBondContact O-N 3.49Å; A113-E117 WeakPolarHBondContact O-CG 3.43Å; A113-E117 PolarHBondContact O-N 3.12Å
114	Y	94.1	Very high	91.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-46.1	175.1	-172.7	-103.4	0	0	0	112.4	V90 C93 L103 H104 Y105 P106 C110 S112 D116 E117 L118 I128 Y136	V90-Y114 HydrophobicContact CG1-CD2 3.65Å; V90-Y114 HydrophobicContact CG1-CE2 4.03Å; C93-Y114 HydrophobicContact CB-CE2 4.32Å; L103-Y114 WeakPolarHBondContact CD1-OH 3.41Å; H104-Y114 PolarHBondContact O-OH 3.46Å; Y105-Y114 AromaticContact CD2-CD1 3.63Å; Y105-Y114 HydrophobicContact CD2-CD1 3.63Å; Y105-Y114 HydrophobicContact CD2-CD2 4.38Å; Y105-Y114 AromaticContact CD2-CE1 3.85Å; Y105-Y114 HydrophobicContact CD2-CE1 3.85Å; Y105-Y114 AromaticContact CD2-CG 3.9Å; Y105-Y114 HydrophobicContact CD2-CG 3.9Å; Y105-Y114 HydrophobicContact CE2-CD1 4.18Å; Y105-Y114 HydrophobicContact CE2-CG 4.16Å; P106-Y114 HydrophobicContact CG-CE2 4.43Å; C110-Y114 WeakPolarHBondContact O-CB 3.37Å; C110-Y114 PolarHBondContact O-N 2.91Å; S112-Y114 VanDerWaalsContact C-N 3.28Å; S112-Y114 PolarHBondContact O-N 3.34Å; Y114-D116 VanDerWaalsContact C-N 3.34Å; Y114-D116 PolarHBondContact O-N 3.38Å; Y114-E117 PolarHBondContact O-N 2.85Å; Y114-L118 HydrophobicContact CD1-CD1 3.88Å; Y114-L118 HydrophobicContact CD1-CG 4.24Å; Y114-L118 HydrophobicContact CE1-CD1 3.44Å; Y114-L118 VanDerWaalsContact CE1-CD1 3.44Å; Y114-L118 HydrophobicContact CE1-CD2 4.39Å; Y114-L118 HydrophobicContact CE1-CG 3.96Å; Y114-L118 WeakPolarHBondContact O-CG 3.24Å; Y114-L118 PolarHBondContact O-N 2.92Å; Y114-I128 HydrophobicContact CE1-CD1 4.38Å; Y114-Y136 HydrophobicContact CD1-CE2 4.29Å
115	D	93	Very high	91.7	Very high	31 Å²	31	46.7 Å²	46.7	17%	0.166	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-39.5	175.9	-88	5.1	0	0	0	111.8	I111 S112 E117 L118 A119 Y136 K140	I111-D115 WeakPolarHBondContact O-CB 3.24Å; I111-D115 PolarHBondContact O-N 3.44Å; S112-D115 PolarHBondContact O-N 3.37Å; D115-E117 VanDerWaalsContact C-N 3.32Å; D115-E117 PolarHBondContact O-N 3.48Å; D115-L118 PolarHBondContact O-N 3.5Å; D115-A119 VanDerWaalsContact O-CB 3.25Å; D115-A119 WeakPolarHBondContact O-CB 3.4Å; D115-A119 PolarHBondContact O-N 2.91Å; D115-Y136 VanDerWaalsContact OD1-CE2 3.24Å; D115-Y136 WeakPolarHBondContact OD1-CE2 3.38Å; D115-Y136 VanDerWaalsContact OD1-CZ 3.32Å; D115-Y136 PolarHBondContact OD1-OH 3.21Å; D115-Y136 PolarHBondContact OD2-OH 2.59Å; D115-Y136 VanDerWaalsContact OD2-OH 3.08Å; D115-K140 WeakPolarHBondContact OD2-CE 3.27Å; D115-K140 IonicContact OD2-NZ 3.85Å; D115-K140 PolarHBondContact OD2-NZ 2.87Å
116	D	93.9	Very high	91.3	Very high	98 Å²	98	52.7 Å²	52.7	52%	0.524	28%	0.283	S	S	.	.	H	α-helix	trans	-62.9	-39.8	176.4	-65.9	-28.5	0	0	0	111.5	S112 A113 Y114 F120	S112-D116 WeakPolarHBondContact O-CB 3.33Å; S112-D116 PolarHBondContact O-N 3.44Å; S112-D116 VanDerWaalsContact O-OD2 3.14Å; A113-D116 PolarHBondContact O-N 3.49Å; Y114-D116 VanDerWaalsContact C-N 3.34Å; Y114-D116 PolarHBondContact O-N 3.38Å; D116-F120 PolarHBondContact O-N 3.32Å
117	E	95.4	Very high	91.1	Very high	22 Å²	22	55.7 Å²	55.7	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	-66.2	-49.2	175.3	-73.1	-62.4	146.9	0	0	111.6	R86 V90 A113 Y114 D115 A119 F120 Y121	R86-E117 IonicContact CZ-OE1 3.19Å; R86-E117 IonicContact CZ-OE2 2.59Å; R86-E117 IonicContact NE-OE1 2.89Å; R86-E117 PolarHBondContact NE-OE1 2.92Å; R86-E117 IonicContact NE-OE2 3.62Å; R86-E117 PolarHBondContact NE-OE2 3.4Å; R86-E117 PolarHBondContact NH2-O 3.33Å; R86-E117 IonicContact NH2-OE1 3.4Å; R86-E117 IonicContact NH2-OE2 3.44Å; R86-E117 PolarHBondContact NH2-OE2 2.94Å; V90-E117 HydrophobicContact CB-CB 4.34Å; V90-E117 HydrophobicContact CB-CG 4Å; V90-E117 HydrophobicContact CG1-CB 3.54Å; V90-E117 HydrophobicContact CG1-CG 3.75Å; V90-E117 HydrophobicContact CG2-CG 4.37Å; A113-E117 WeakPolarHBondContact O-CG 3.43Å; A113-E117 PolarHBondContact O-N 3.12Å; Y114-E117 PolarHBondContact O-N 2.85Å; D115-E117 VanDerWaalsContact C-N 3.32Å; D115-E117 PolarHBondContact O-N 3.48Å; E117-A119 VanDerWaalsContact C-N 3.31Å; E117-A119 PolarHBondContact O-N 2.98Å; E117-F120 PolarHBondContact O-N 3.31Å; E117-Y121 WeakPolarHBondContact O-CD2 3.42Å; E117-Y121 PolarHBondContact O-N 2.87Å; E117-Y121 VanDerWaalsContact O-N 3.1Å; E117-Y121 WeakPolarHBondContact OE2-CE2 3.46Å
118	L	94.6	Very high	91.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-43.1	176.6	-69.5	-174.8	0	0	0	112.3	V94 L103 Y114 D115 F120 Y121 G122 I123 P125	V94-L118 HydrophobicContact CG2-CD2 4.33Å; L103-L118 HydrophobicContact CD1-CD2 4.01Å; L103-L118 HydrophobicContact CD2-CD1 3.95Å; L103-L118 HydrophobicContact CD2-CD2 3.93Å; Y114-L118 HydrophobicContact CD1-CD1 3.88Å; Y114-L118 HydrophobicContact CD1-CG 4.24Å; Y114-L118 HydrophobicContact CE1-CD1 3.44Å; Y114-L118 VanDerWaalsContact CE1-CD1 3.44Å; Y114-L118 HydrophobicContact CE1-CD2 4.39Å; Y114-L118 HydrophobicContact CE1-CG 3.96Å; Y114-L118 WeakPolarHBondContact O-CG 3.24Å; Y114-L118 PolarHBondContact O-N 2.92Å; D115-L118 PolarHBondContact O-N 3.5Å; L118-F120 PolarHBondContact O-N 2.91Å; L118-Y121 PolarHBondContact O-N 3.34Å; L118-G122 PolarHBondContact O-N 2.91Å; L118-I123 HydrophobicContact CD2-CB 4.2Å; L118-I123 HydrophobicContact CD2-CG2 4.25Å; L118-I123 PolarHBondContact O-N 2.8Å; L118-P125 HydrophobicContact CD1-CB 4.21Å; L118-P125 HydrophobicContact CD1-CG 4.23Å
119	A	94.6	Very high	91.6	Very high	71 Å²	71	42 Å²	42	59%	0.587	25%	0.251	S	S	*	.	H	α-helix	trans	-60.1	-43.8	-179.4	0	0	0	0	0	111.9	D115 E117 G122	D115-A119 VanDerWaalsContact O-CB 3.25Å; D115-A119 WeakPolarHBondContact O-CB 3.4Å; D115-A119 PolarHBondContact O-N 2.91Å; E117-A119 VanDerWaalsContact C-N 3.31Å; E117-A119 PolarHBondContact O-N 2.98Å; A119-G122 PolarHBondContact O-N 3.28Å
120	F	95.8	Very high	91.5	Very high	64 Å²	64	47.6 Å²	47.6	28%	0.281	28%	0.282	S	S	.	.	H	α-helix	trans	-74.1	-33.5	178.3	157.6	-71.4	0	0	0	113.4	L65 F74 F84 R86 D116 E117 L118 G122	L65-F120 HydrophobicContact CD1-CD1 4.12Å; L65-F120 HydrophobicContact CD1-CE1 3.97Å; L65-F120 HydrophobicContact CD1-CG 4.49Å; L65-F120 HydrophobicContact CD1-CZ 4.18Å; L65-F120 WeakPolarHBondContact CD1-O 3.23Å; F74-F120 HydrophobicContact CE1-CE2 4.48Å; F74-F120 HydrophobicContact CE1-CZ 4.09Å; F74-F120 HydrophobicContact CZ-CE2 4.08Å; F74-F120 AromaticContact CZ-CZ 3.84Å; F74-F120 HydrophobicContact CZ-CZ 3.84Å; F84-F120 AromaticContact CD1-CE1 3.96Å; F84-F120 HydrophobicContact CD1-CE1 3.96Å; F84-F120 AromaticContact CD1-CZ 3.99Å; F84-F120 HydrophobicContact CD1-CZ 3.99Å; F84-F120 HydrophobicContact CE1-CE1 4.29Å; F84-F120 HydrophobicContact CE1-CZ 4.4Å; R86-F120 HydrophobicContact CG-CE1 4.34Å; R86-F120 HydrophobicContact CG-CZ 4.41Å; R86-F120 VanDerWaalsContact CZ-CB 3.41Å; D116-F120 PolarHBondContact O-N 3.32Å; E117-F120 PolarHBondContact O-N 3.31Å; L118-F120 PolarHBondContact O-N 2.91Å; F120-G122 PolarHBondContact O-N 3.42Å
121	Y	95.9	Very high	91.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-73.6	-3.3	171.8	-69	-65.6	0	0	0	112.7	L65 L66 F84 F91 V94 E117 L118 I123	L65-Y121 PolarHBondContact N-O 2.91Å; L66-Y121 HydrophobicContact CD1-CD1 4.18Å; L66-Y121 HydrophobicContact CD1-CE1 4.42Å; L66-Y121 HydrophobicContact CD2-CD1 4.36Å; L66-Y121 HydrophobicContact CD2-CE1 4.32Å; L66-Y121 HydrophobicContact CG-CD1 4.04Å; L66-Y121 HydrophobicContact CG-CE1 4.42Å; F84-Y121 HydrophobicContact CD1-CE1 4.34Å; F84-Y121 HydrophobicContact CE1-CE1 4.39Å; F91-Y121 AromaticContact CD2-CE1 3.97Å; F91-Y121 HydrophobicContact CD2-CE1 3.97Å; F91-Y121 AromaticContact CD2-CE2 3.82Å; F91-Y121 HydrophobicContact CD2-CE2 3.82Å; F91-Y121 AromaticContact CD2-CZ 3.4Å; F91-Y121 VanDerWaalsContact CD2-CZ 3.4Å; F91-Y121 WeakPolarHBondContact CD2-OH 3.41Å; F91-Y121 AromaticContact CE2-CE1 3.71Å; F91-Y121 HydrophobicContact CE2-CE1 3.71Å; F91-Y121 HydrophobicContact CE2-CE2 4.38Å; F91-Y121 AromaticContact CE2-CZ 3.65Å; V94-Y121 HydrophobicContact CB-CD2 4.35Å; V94-Y121 HydrophobicContact CG1-CD1 4.34Å; V94-Y121 HydrophobicContact CG1-CD2 3.89Å; V94-Y121 HydrophobicContact CG1-CE2 4.44Å; V94-Y121 HydrophobicContact CG1-CG 3.85Å; V94-Y121 HydrophobicContact CG2-CD2 3.76Å; V94-Y121 HydrophobicContact CG2-CE2 4.23Å; V94-Y121 HydrophobicContact CG2-CG 4.48Å; E117-Y121 WeakPolarHBondContact O-CD2 3.42Å; E117-Y121 PolarHBondContact O-N 2.87Å; E117-Y121 VanDerWaalsContact O-N 3.1Å; E117-Y121 WeakPolarHBondContact OE2-CE2 3.46Å; L118-Y121 PolarHBondContact O-N 3.34Å; Y121-I123 VanDerWaalsContact C-N 3.34Å
122	G	92.4	Very high	91.4	Very high	33 Å²	33	49.4 Å²	49.4	34%	0.34	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	26.7	178.5	0	0	0	0	0	113.1	L118 A119 F120	L118-G122 PolarHBondContact O-N 2.91Å; A119-G122 PolarHBondContact O-N 3.28Å; F120-G122 PolarHBondContact O-N 3.42Å
123	I	94.4	Very high	91.3	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	30%	0.296	C	S	.	.			trans	-98.7	123.8	-179.7	-59.8	173.4	0	0	0	108.9	T64 V94 F97 Y98 L103 L118 Y121 P125	T64-I123 HydrophobicContact CG2-CG1 4.11Å; V94-I123 HydrophobicContact CG1-CD1 3.79Å; F97-I123 HydrophobicContact CD1-CD1 3.67Å; F97-I123 HydrophobicContact CD1-CG1 4.31Å; F97-I123 HydrophobicContact CD1-CG2 4.46Å; F97-I123 HydrophobicContact CE1-CD1 4.07Å; F97-I123 HydrophobicContact CE1-CG1 4.21Å; F97-I123 HydrophobicContact CE1-CG2 4.29Å; F97-I123 HydrophobicContact CG-CD1 4.49Å; Y98-I123 HydrophobicContact CE2-CD1 4.12Å; L103-I123 HydrophobicContact CD2-CG2 3.83Å; L118-I123 HydrophobicContact CD2-CB 4.2Å; L118-I123 HydrophobicContact CD2-CG2 4.25Å; L118-I123 PolarHBondContact O-N 2.8Å; Y121-I123 VanDerWaalsContact C-N 3.34Å; I123-P125 WeakPolarHBondContact O-CD 3.47Å
124	L	89.8	Confident	91	Very high	105 Å²	105	54.8 Å²	54.8	55%	0.55	31%	0.305	S	S	.	.			trans	-69.2	124.9	177.3	-83.1	84.5	0	0	0	110.5	E126 I127	L124-E126 WeakPolarHBondContact CB-OE2 3.27Å; L124-E126 PolarHBondContact O-N 2.94Å; L124-E126 VanDerWaalsContact O-N 3.12Å; L124-I127 HydrophobicContact CB-CD1 3.87Å; L124-I127 HydrophobicContact CB-CG1 4.11Å; L124-I127 WeakPolarHBondContact O-CB 3.29Å; L124-I127 WeakPolarHBondContact O-CG1 3.36Å; L124-I127 PolarHBondContact O-N 3.47Å; L124-I127 VanDerWaalsContact O-N 3.13Å
125	P	87.3	Confident	90.6	Very high	26 Å²	26	57.6 Å²	57.6	17%	0.169	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-62.6	-17.5	177.6	-20.3	31.4	0	0	0	113.9	L118 I123 I127 I128 Y136	L118-P125 HydrophobicContact CD1-CB 4.21Å; L118-P125 HydrophobicContact CD1-CG 4.23Å; I123-P125 WeakPolarHBondContact O-CD 3.47Å; P125-I127 PolarHBondContact O-N 3.26Å; P125-I127 VanDerWaalsContact O-N 3.17Å; P125-I128 VanDerWaalsContact O-CD1 3.32Å; P125-I128 WeakPolarHBondContact O-CD1 3.3Å; P125-I128 WeakPolarHBondContact O-CG1 3.36Å; P125-I128 PolarHBondContact O-N 3.38Å; P125-Y136 HydrophobicContact CB-CE1 4.35Å; P125-Y136 WeakPolarHBondContact CB-OH 3.34Å
126	E	84.2	Confident	90.4	Very high	134 Å²	134	56.5 Å²	56.5	63%	0.626	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-64.7	-13.5	174.9	-64.1	75.6	-163.6	0	0	113.3	L124 I128	L124-E126 WeakPolarHBondContact CB-OE2 3.27Å; L124-E126 PolarHBondContact O-N 2.94Å; L124-E126 VanDerWaalsContact O-N 3.12Å; E126-I128 VanDerWaalsContact C-N 3.29Å
127	I	86.9	Confident	90.1	Very high	78 Å²	78	56.5 Å²	56.5	40%	0.4	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-87	1.3	-179	-50	166.9	0	0	0	111.8	F97 L124 P125 G129	F97-I127 HydrophobicContact CE2-CG2 3.77Å; F97-I127 HydrophobicContact CZ-CG2 4.48Å; L124-I127 HydrophobicContact CB-CD1 3.87Å; L124-I127 HydrophobicContact CB-CG1 4.11Å; L124-I127 WeakPolarHBondContact O-CB 3.29Å; L124-I127 WeakPolarHBondContact O-CG1 3.36Å; L124-I127 PolarHBondContact O-N 3.47Å; L124-I127 VanDerWaalsContact O-N 3.13Å; P125-I127 PolarHBondContact O-N 3.26Å; P125-I127 VanDerWaalsContact O-N 3.17Å; I127-G129 PolarHBondContact O-N 3.47Å
128	I	91.4	Very high	89.5	Confident	7 Å²	7	60.2 Å²	60.2	4%	0.036	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-59.7	129.7	176	-68.5	169.4	0	0	0	110.1	L103 Y114 P125 E126 C132 Y136	L103-I128 HydrophobicContact CD2-CG1 3.78Å; L103-I128 HydrophobicContact CG-CG1 4.14Å; Y114-I128 HydrophobicContact CE1-CD1 4.38Å; P125-I128 VanDerWaalsContact O-CD1 3.32Å; P125-I128 WeakPolarHBondContact O-CD1 3.3Å; P125-I128 WeakPolarHBondContact O-CG1 3.36Å; P125-I128 PolarHBondContact O-N 3.38Å; E126-I128 VanDerWaalsContact C-N 3.29Å; I128-C132 HydrophobicContact CG2-CB 4.07Å; I128-Y136 HydrophobicContact CD1-CD1 3.58Å; I128-Y136 HydrophobicContact CD1-CD2 3.3Å; I128-Y136 HydrophobicContact CD1-CE1 3.73Å; I128-Y136 HydrophobicContact CD1-CE2 3.46Å; I128-Y136 VanDerWaalsContact CD1-CE2 3.46Å; I128-Y136 HydrophobicContact CD1-CG 3.38Å
129	G	88.1	Confident	89	Confident	19 Å²	19	64 Å²	64	20%	0.196	34%	0.342	C	S	.	.			trans	-68.9	151	-177.7	0	0	0	0	0	113.6	L103 I127 C131 C132 Y133	L103-G129 PolarHBondContact O-N 2.93Å; I127-G129 PolarHBondContact O-N 3.47Å; G129-C131 PolarHBondContact O-N 2.97Å; G129-C132 PolarHBondContact O-N 3.3Å; G129-Y133 PolarHBondContact O-N 2.96Å; G129-Y133 VanDerWaalsContact O-N 3.11Å
130	D	87.3	Confident	88.6	Confident	151 Å²	151	64.3 Å²	64.3	81%	0.807	33%	0.33	S	S	*	.	H	α-helix	trans	-48.6	-34.8	-175.5	-60.5	-22.4	0	0	0	114.5	C132 Y133	D130-C132 PolarHBondContact O-N 3.32Å; D130-Y133 PolarHBondContact O-N 2.87Å
131	C	88.3	Confident	88	Confident	89 Å²	89	69.1 Å²	69.1	60%	0.601	35%	0.346	S	S	*	.	H	α-helix	trans	-63.6	-24.3	179.9	64.6	0	0	0	0	114.8	H104 G129	H104-C131 PolarHBondContact CE1-SG 3.08Å; H104-C131 PolarHBondContact ND1-SG 3.42Å; G129-C131 PolarHBondContact O-N 2.97Å
132	C	90.4	Very high	87	Confident	21 Å²	21	71.5 Å²	71.5	14%	0.142	36%	0.357	C	S	.	.	H	α-helix	trans	-118.3	-7.9	-179.1	-61.1	0	0	0	0	112.4	I128 G129 D130 E135 Y136	I128-C132 HydrophobicContact CG2-CB 4.07Å; G129-C132 PolarHBondContact O-N 3.3Å; D130-C132 PolarHBondContact O-N 3.32Å; C132-E135 PolarHBondContact O-N 3.3Å; C132-Y136 WeakPolarHBondContact O-CB 3.45Å; C132-Y136 PolarHBondContact O-N 3.24Å
133	Y	88.9	Confident	86.5	Confident	92 Å²	92	71.8 Å²	71.8	36%	0.361	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-47.5	-170.1	-177.6	-107.7	0	0	0	112.9	G129 D130 E135 Y136 K137	G129-Y133 PolarHBondContact O-N 2.96Å; G129-Y133 VanDerWaalsContact O-N 3.11Å; D130-Y133 PolarHBondContact O-N 2.87Å; Y133-E135 PolarHBondContact O-N 2.86Å; Y133-Y136 PolarHBondContact O-N 2.83Å; Y133-K137 HydrophobicContact CE1-CD 4.12Å; Y133-K137 WeakPolarHBondContact O-CB 3.07Å; Y133-K137 PolarHBondContact O-N 3Å
134	E	84.8	Confident	85.8	Confident	106 Å²	106	73.7 Å²	73.7	50%	0.495	37%	0.368	S	S	.	.	H	α-helix	trans	-62.7	-42.3	179.5	-69.6	-57.5	138	0	0	111.9	K137 D138	E134-K137 PolarHBondContact O-N 3.41Å; E134-K137 IonicContact OE2-NZ 3.88Å; E134-D138 WeakPolarHBondContact O-CB 3.27Å; E134-D138 PolarHBondContact O-N 3.38Å
135	E	85.1	Confident	84.9	Confident	58 Å²	58	73.1 Å²	73.1	27%	0.271	36%	0.362	S	S	.	.	H	α-helix	trans	-67.4	-41.4	179.1	-172.3	166.1	-174.8	0	0	112.3	R107 C132 Y133 R139	R107-E135 VanDerWaalsContact CD-OE1 3.31Å; R107-E135 WeakPolarHBondContact CD-OE1 3.25Å; R107-E135 VanDerWaalsContact CG-OE1 3.29Å; R107-E135 WeakPolarHBondContact CG-OE1 3.33Å; R107-E135 IonicContact CZ-OE1 3.96Å; R107-E135 IonicContact CZ-OE2 3.23Å; R107-E135 VanDerWaalsContact CZ-OE2 3.23Å; R107-E135 VanDerWaalsContact NE-CD 3.32Å; R107-E135 IonicContact NE-OE1 3.15Å; R107-E135 PolarHBondContact NE-OE1 3.45Å; R107-E135 VanDerWaalsContact NE-OE1 3.15Å; R107-E135 IonicContact NE-OE2 2.71Å; R107-E135 PolarHBondContact NE-OE2 2.9Å; R107-E135 IonicContact NH2-OE2 2.93Å; R107-E135 PolarHBondContact NH2-OE2 3.25Å; C132-E135 PolarHBondContact O-N 3.3Å; Y133-E135 PolarHBondContact O-N 2.86Å; E135-R139 WeakPolarHBondContact O-CB 3.46Å; E135-R139 WeakPolarHBondContact O-CG 3.25Å; E135-R139 PolarHBondContact O-N 2.79Å
136	Y	89.6	Confident	84.1	Confident	8 Å²	8	76.1 Å²	76.1	3%	0.031	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-48.1	172.5	170.6	-93.3	0	0	0	111.2	Y105 I111 Y114 D115 P125 I128 C132 Y133 R139 K140	Y105-Y136 HydrophobicContact CD1-CD2 4.46Å; Y105-Y136 HydrophobicContact CD2-CD2 4.16Å; Y105-Y136 HydrophobicContact CG-CD2 4.05Å; I111-Y136 HydrophobicContact CD1-CD2 3.24Å; I111-Y136 HydrophobicContact CD1-CE2 3.25Å; I111-Y136 HydrophobicContact CD1-CG 4.16Å; I111-Y136 HydrophobicContact CG1-CE2 4.44Å; Y114-Y136 HydrophobicContact CD1-CE2 4.29Å; D115-Y136 VanDerWaalsContact OD1-CE2 3.24Å; D115-Y136 WeakPolarHBondContact OD1-CE2 3.38Å; D115-Y136 VanDerWaalsContact OD1-CZ 3.32Å; D115-Y136 PolarHBondContact OD1-OH 3.21Å; D115-Y136 PolarHBondContact OD2-OH 2.59Å; D115-Y136 VanDerWaalsContact OD2-OH 3.08Å; P125-Y136 HydrophobicContact CB-CE1 4.35Å; P125-Y136 WeakPolarHBondContact CB-OH 3.34Å; I128-Y136 HydrophobicContact CD1-CD1 3.58Å; I128-Y136 HydrophobicContact CD1-CD2 3.3Å; I128-Y136 HydrophobicContact CD1-CE1 3.73Å; I128-Y136 HydrophobicContact CD1-CE2 3.46Å; I128-Y136 VanDerWaalsContact CD1-CE2 3.46Å; I128-Y136 HydrophobicContact CD1-CG 3.38Å; C132-Y136 WeakPolarHBondContact O-CB 3.45Å; C132-Y136 PolarHBondContact O-N 3.24Å; Y133-Y136 PolarHBondContact O-N 2.83Å; Y136-R139 PolarHBondContact O-N 2.95Å; Y136-K140 HydrophobicContact CE1-CD 3.78Å; Y136-K140 VanDerWaalsContact O-CB 3.29Å; Y136-K140 WeakPolarHBondContact O-CB 3.45Å; Y136-K140 PolarHBondContact O-N 2.85Å; Y136-K140 WeakPolarHBondContact OH-CD 3.25Å; Y136-K140 PolarHBondContact OH-NZ 3.32Å
137	K	86.7	Confident	83.5	Confident	98 Å²	98	74.6 Å²	74.6	43%	0.426	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-43.9	-178.9	179.5	-177.3	167	-160.2	0	112	Y133 E134 K140 R141	Y133-K137 HydrophobicContact CE1-CD 4.12Å; Y133-K137 WeakPolarHBondContact O-CB 3.07Å; Y133-K137 PolarHBondContact O-N 3Å; E134-K137 PolarHBondContact O-N 3.41Å; E134-K137 IonicContact OE2-NZ 3.88Å; K137-K140 PolarHBondContact O-N 3.33Å; K137-R141 WeakPolarHBondContact O-CB 3.42Å; K137-R141 PolarHBondContact O-N 2.89Å
138	D	82.2	Confident	82.6	Confident	100 Å²	100	77 Å²	77	54%	0.535	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-45.6	176	-80.9	-13.9	0	0	0	111.5	E134 R141 E142	E134-D138 WeakPolarHBondContact O-CB 3.27Å; E134-D138 PolarHBondContact O-N 3.38Å; D138-R141 PolarHBondContact O-N 3.26Å; D138-E142 WeakPolarHBondContact O-CB 3.36Å; D138-E142 PolarHBondContact O-N 3.49Å
139	R	84.8	Confident	81.2	Confident	79 Å²	79	80.5 Å²	80.5	30%	0.298	40%	0.395	S	S	.	.	H	α-helix	trans	-65.1	-40.2	177.5	-72.1	-81.1	-73.2	-113.7	-7.5	112.2	Y105 E109 I111 E135 Y136 E142 N143	Y105-R139 HydrophobicContact CE1-CG 4.35Å; Y105-R139 PolarHBondContact OH-NH2 2.91Å; Y105-R139 VanDerWaalsContact OH-NH2 3.16Å; E109-R139 PolarHBondContact O-NH2 3.27Å; I111-R139 HydrophobicContact CB-CB 4.36Å; I111-R139 HydrophobicContact CD1-CB 4.41Å; I111-R139 HydrophobicContact CG1-CB 4.34Å; E135-R139 WeakPolarHBondContact O-CB 3.46Å; E135-R139 WeakPolarHBondContact O-CG 3.25Å; E135-R139 PolarHBondContact O-N 2.79Å; Y136-R139 PolarHBondContact O-N 2.95Å; R139-E142 PolarHBondContact O-N 3.12Å; R139-N143 WeakPolarHBondContact O-CB 3.36Å; R139-N143 PolarHBondContact O-N 3.41Å
140	K	86.9	Confident	80	Confident	78 Å²	78	82.9 Å²	82.9	34%	0.339	40%	0.404	S	S	.	.	H	α-helix	trans	-65.3	-44.5	177.1	-172.3	171.4	-166.3	156	0	111.3	I111 D115 Y136 K137 N143 A144	I111-K140 HydrophobicContact CD1-CB 4.49Å; I111-K140 HydrophobicContact CG1-CB 4.2Å; D115-K140 WeakPolarHBondContact OD2-CE 3.27Å; D115-K140 IonicContact OD2-NZ 3.85Å; D115-K140 PolarHBondContact OD2-NZ 2.87Å; Y136-K140 HydrophobicContact CE1-CD 3.78Å; Y136-K140 VanDerWaalsContact O-CB 3.29Å; Y136-K140 WeakPolarHBondContact O-CB 3.45Å; Y136-K140 PolarHBondContact O-N 2.85Å; Y136-K140 WeakPolarHBondContact OH-CD 3.25Å; Y136-K140 PolarHBondContact OH-NZ 3.32Å; K137-K140 PolarHBondContact O-N 3.33Å; K140-N143 PolarHBondContact O-N 3.32Å; K140-A144 WeakPolarHBondContact O-CB 3.46Å; K140-A144 PolarHBondContact O-N 2.89Å
141	R	82.2	Confident	78.7	Confident	165 Å²	165	79.6 Å²	79.6	62%	0.623	39%	0.386	S	S	*	.	H	α-helix	trans	-60	-48.7	174.3	-179.9	-179.3	169.6	-169.2	-2.3	111.3	K137 D138 N143 A144 E145	K137-R141 WeakPolarHBondContact O-CB 3.42Å; K137-R141 PolarHBondContact O-N 2.89Å; D138-R141 PolarHBondContact O-N 3.26Å; R141-N143 VanDerWaalsContact C-N 3.3Å; R141-N143 PolarHBondContact O-N 3.15Å; R141-A144 PolarHBondContact O-N 3.2Å; R141-E145 IonicContact CZ-OE1 2.85Å; R141-E145 IonicContact NE-OE1 3.95Å; R141-E145 PolarHBondContact NE-OE1 3.1Å; R141-E145 IonicContact NH2-OE1 3.29Å; R141-E145 PolarHBondContact NH2-OE1 3.31Å; R141-E145 WeakPolarHBondContact O-CG 3.29Å; R141-E145 PolarHBondContact O-N 2.82Å
142	E	75.4	Confident	77.3	Confident	50 Å²	50	80.2 Å²	80.2	23%	0.234	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-39	178.8	-165.4	-163.9	-162.1	0	0	111.8	D138 R139 R146 Q412	D138-E142 WeakPolarHBondContact O-CB 3.36Å; D138-E142 PolarHBondContact O-N 3.49Å; R139-E142 PolarHBondContact O-N 3.12Å; E142-R146 VanDerWaalsContact O-CG 3.3Å; E142-R146 WeakPolarHBondContact O-CG 3.45Å; E142-R146 PolarHBondContact O-N 3.24Å; E142-R146 IonicContact OE1-CZ 3.18Å; E142-R146 IonicContact OE1-NH1 3.08Å; E142-R146 IonicContact OE1-NH2 3.73Å; E142-R146 PolarHBondContact OE1-NH2 3.39Å; E142-R146 IonicContact OE2-CZ 2.91Å; E142-R146 IonicContact OE2-NH1 2.64Å; E142-R146 PolarHBondContact OE2-NH1 3.19Å; E142-R146 IonicContact OE2-NH2 2.69Å; E142-R146 PolarHBondContact OE2-NH2 2.86Å; E142-Q412 PolarHBondContact OE1-NE2 3.1Å
143	N	81.8	Confident	75.6	Confident	39 Å²	39	81 Å²	81	21%	0.209	39%	0.389	C	S	.	.	H	α-helix	trans	-69.5	-40.4	175.9	-166.2	48.8	0	0	0	112.5	I111 R139 K140 R141 R146 L147	I111-N143 HydrophobicContact CG2-CB 3.56Å; R139-N143 WeakPolarHBondContact O-CB 3.36Å; R139-N143 PolarHBondContact O-N 3.41Å; K140-N143 PolarHBondContact O-N 3.32Å; R141-N143 VanDerWaalsContact C-N 3.3Å; R141-N143 PolarHBondContact O-N 3.15Å; N143-R146 WeakPolarHBondContact O-CB 3.5Å; N143-R146 PolarHBondContact O-N 3.32Å; N143-L147 WeakPolarHBondContact O-CG 3.38Å; N143-L147 PolarHBondContact O-N 3.23Å
144	A	79.2	Confident	74	Confident	45 Å²	45	80.9 Å²	80.9	37%	0.372	39%	0.392	S	S	.	.	H	α-helix	trans	-63.6	-43.3	175.8	0	0	0	0	0	111.9	K140 R141 R146 L147 M148	K140-A144 WeakPolarHBondContact O-CB 3.46Å; K140-A144 PolarHBondContact O-N 2.89Å; R141-A144 PolarHBondContact O-N 3.2Å; A144-R146 VanDerWaalsContact C-N 3.31Å; A144-R146 PolarHBondContact O-N 3.44Å; A144-L147 PolarHBondContact O-N 3.25Å; A144-M148 WeakPolarHBondContact O-CG 3.15Å; A144-M148 PolarHBondContact O-N 2.74Å
145	E	72.1	Confident	72.3	Confident	92 Å²	92	79.8 Å²	79.8	43%	0.43	39%	0.389	S	S	.	.	H	α-helix	trans	-59.4	-41.3	174.8	-72.8	174.3	-177.5	0	0	111.2	R141 M148 D149	R141-E145 IonicContact CZ-OE1 2.85Å; R141-E145 IonicContact NE-OE1 3.95Å; R141-E145 PolarHBondContact NE-OE1 3.1Å; R141-E145 IonicContact NH2-OE1 3.29Å; R141-E145 PolarHBondContact NH2-OE1 3.31Å; R141-E145 WeakPolarHBondContact O-CG 3.29Å; R141-E145 PolarHBondContact O-N 2.82Å; E145-M148 PolarHBondContact O-N 2.97Å; E145-D149 PolarHBondContact O-N 2.93Å; E145-D149 VanDerWaalsContact O-N 3.12Å
146	R	69.7	Low	70.5	Confident	90 Å²	90	82.5 Å²	82.5	34%	0.34	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-44.6	174.4	-72.3	171	178.5	129.6	1.8	113.3	E142 N143 A144 M148 D149 D150	E142-R146 VanDerWaalsContact O-CG 3.3Å; E142-R146 WeakPolarHBondContact O-CG 3.45Å; E142-R146 PolarHBondContact O-N 3.24Å; E142-R146 IonicContact OE1-CZ 3.18Å; E142-R146 IonicContact OE1-NH1 3.08Å; E142-R146 IonicContact OE1-NH2 3.73Å; E142-R146 PolarHBondContact OE1-NH2 3.39Å; E142-R146 IonicContact OE2-CZ 2.91Å; E142-R146 IonicContact OE2-NH1 2.64Å; E142-R146 PolarHBondContact OE2-NH1 3.19Å; E142-R146 IonicContact OE2-NH2 2.69Å; E142-R146 PolarHBondContact OE2-NH2 2.86Å; N143-R146 WeakPolarHBondContact O-CB 3.5Å; N143-R146 PolarHBondContact O-N 3.32Å; A144-R146 VanDerWaalsContact C-N 3.31Å; A144-R146 PolarHBondContact O-N 3.44Å; R146-M148 VanDerWaalsContact C-N 3.31Å; R146-M148 PolarHBondContact O-N 3.25Å; R146-D149 PolarHBondContact O-N 3.05Å; R146-D150 PolarHBondContact O-N 2.6Å
147	L	71.1	Confident	68.6	Low	101 Å²	101	87 Å²	87	53%	0.529	43%	0.427	S	S	.	.	H	α-helix	trans	-65.1	-37	179.6	-75	165.1	0	0	0	111.5	N143 A144 D150 N151	N143-L147 WeakPolarHBondContact O-CG 3.38Å; N143-L147 PolarHBondContact O-N 3.23Å; A144-L147 PolarHBondContact O-N 3.25Å; L147-D150 PolarHBondContact O-N 2.66Å; L147-N151 VanDerWaalsContact O-CB 3.29Å; L147-N151 WeakPolarHBondContact O-CB 3.22Å; L147-N151 PolarHBondContact O-N 3.08Å
148	M	67.9	Low	66.6	Low	130 Å²	130	90.3 Å²	90.3	64%	0.64	44%	0.444	S	S	*	.	H	α-helix	trans	-62.8	-46	173.3	-74.1	178.2	131.1	0	0	111.7	A144 E145 R146 D150 N151 D152	A144-M148 WeakPolarHBondContact O-CG 3.15Å; A144-M148 PolarHBondContact O-N 2.74Å; E145-M148 PolarHBondContact O-N 2.97Å; R146-M148 VanDerWaalsContact C-N 3.31Å; R146-M148 PolarHBondContact O-N 3.25Å; M148-D150 VanDerWaalsContact C-N 3.29Å; M148-D150 PolarHBondContact O-N 3.42Å; M148-N151 PolarHBondContact O-N 3.17Å; M148-D152 WeakPolarHBondContact O-CB 3.49Å; M148-D152 PolarHBondContact O-N 3.42Å
149	D	62.7	Low	64.6	Low	79 Å²	79	88.7 Å²	88.7	42%	0.422	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-35.2	177.1	-88.7	-7.1	0	0	0	113.2	E145 R146 S153 R420	E145-D149 PolarHBondContact O-N 2.93Å; E145-D149 VanDerWaalsContact O-N 3.12Å; R146-D149 PolarHBondContact O-N 3.05Å; D149-S153 PolarHBondContact O-N 3.12Å; D149-S153 PolarHBondContact O-OG 3.16Å; D149-R420 PolarHBondContact O-NH2 3.25Å
150	D	63.6	Low	62.8	Low	69 Å²	69	90.2 Å²	90.2	37%	0.369	45%	0.453	S	S	.	.	H	α-helix	trans	-73.8	-42.1	175.9	-79.6	-17.6	0	0	0	111.5	R146 L147 M148 S153 E154	R146-D150 PolarHBondContact O-N 2.6Å; L147-D150 PolarHBondContact O-N 2.66Å; M148-D150 VanDerWaalsContact C-N 3.29Å; M148-D150 PolarHBondContact O-N 3.42Å; D150-S153 WeakPolarHBondContact O-CA 3.49Å; D150-S153 VanDerWaalsContact O-CB 3.28Å; D150-S153 WeakPolarHBondContact O-CB 3.48Å; D150-S153 PolarHBondContact O-N 3.17Å; D150-S153 VanDerWaalsContact O-N 3.08Å; D150-E154 PolarHBondContact O-N 3.19Å
151	N	60	Low	61.3	Low	82 Å²	82	91 Å²	91	44%	0.439	47%	0.465	S	S	.	.	H	α-helix	trans	-66.2	-39.6	177.5	-166.8	14.2	0	0	0	112.1	L147 M148 S153 E154 N155	L147-N151 VanDerWaalsContact O-CB 3.29Å; L147-N151 WeakPolarHBondContact O-CB 3.22Å; L147-N151 PolarHBondContact O-N 3.08Å; M148-N151 PolarHBondContact O-N 3.17Å; N151-S153 PolarHBondContact O-N 3.25Å; N151-E154 PolarHBondContact O-N 3.05Å; N151-N155 WeakPolarHBondContact O-CB 3.4Å; N151-N155 PolarHBondContact O-N 3.22Å; N151-N155 PolarHBondContact O-ND2 3.37Å; N151-N155 PolarHBondContact OD1-ND2 3.06Å
152	D	58.7	Low	60	Low	102 Å²	102	88.8 Å²	88.8	55%	0.545	48%	0.476	S	S	.	.	H	α-helix	trans	-62.9	-30.6	171.8	-82.3	-8.8	0	0	0	111.7	M148 N156	M148-D152 WeakPolarHBondContact O-CB 3.49Å; M148-D152 PolarHBondContact O-N 3.42Å; D152-N156 WeakPolarHBondContact O-CB 3.45Å; D152-N156 PolarHBondContact O-ND2 3.02Å
153	S	55.1	Low	59.4	Low	38 Å²	38	89 Å²	89	27%	0.266	48%	0.478	S	S	.	.	H	α-helix	trans	-74.2	-36.7	175.3	-56.9	0	0	0	0	112.2	D149 D150 N151 R420	D149-S153 PolarHBondContact O-N 3.12Å; D149-S153 PolarHBondContact O-OG 3.16Å; D150-S153 WeakPolarHBondContact O-CA 3.49Å; D150-S153 VanDerWaalsContact O-CB 3.28Å; D150-S153 WeakPolarHBondContact O-CB 3.48Å; D150-S153 PolarHBondContact O-N 3.17Å; D150-S153 VanDerWaalsContact O-N 3.08Å; N151-S153 PolarHBondContact O-N 3.25Å; S153-R420 PolarHBondContact OG-NH2 2.95Å
154	E	54.9	Low	59.4	Low	89 Å²	89	90.3 Å²	90.3	42%	0.416	49%	0.49	S	S	.	.	H	α-helix	trans	-77.4	-45	179.4	-72.8	-174.8	159	0	0	113.1	D150 N151 N156 Q157 E158 K423	D150-E154 PolarHBondContact O-N 3.19Å; N151-E154 PolarHBondContact O-N 3.05Å; E154-N156 PolarHBondContact O-N 3.21Å; E154-Q157 WeakPolarHBondContact O-CA 3.36Å; E154-Q157 WeakPolarHBondContact O-CB 3.39Å; E154-Q157 PolarHBondContact O-N 3.22Å; E154-E158 PolarHBondContact O-N 2.74Å; E154-E158 VanDerWaalsContact O-N 3.11Å; E154-K423 VanDerWaalsContact CD-NZ 3.33Å; E154-K423 IonicContact OE1-NZ 3.87Å; E154-K423 PolarHBondContact OE1-NZ 2.96Å
155	N	48.2	Very low	59.6	Low	83 Å²	83	95.5 Å²	95.5	44%	0.444	51%	0.505	S	S	.	.	H	α-helix	trans	-61	-31.5	177.4	-78.8	-38	0	0	0	112.9	N151 Q157 S159	N151-N155 WeakPolarHBondContact O-CB 3.4Å; N151-N155 PolarHBondContact O-N 3.22Å; N151-N155 PolarHBondContact O-ND2 3.37Å; N151-N155 PolarHBondContact OD1-ND2 3.06Å; N155-Q157 PolarHBondContact O-N 3.37Å; N155-S159 PolarHBondContact O-OG 2.91Å
156	N	48.9	Very low	60.2	Low	115 Å²	115	95.9 Å²	95.9	62%	0.615	50%	0.502	S	S	*	.	H	α-helix	trans	-70.3	-16.9	173	-84.9	-45.1	0	0	0	113.4	D152 E154	D152-N156 WeakPolarHBondContact O-CB 3.45Å; D152-N156 PolarHBondContact O-ND2 3.02Å; E154-N156 PolarHBondContact O-N 3.21Å
157	Q	47.9	Very low	60.9	Low	102 Å²	102	95.7 Å²	95.7	48%	0.477	51%	0.505	S	S	.	.	H	α-helix	trans	-101.3	-30.5	-174.8	-158.9	156	51.3	0	0	113	E154 N155	E154-Q157 WeakPolarHBondContact O-CA 3.36Å; E154-Q157 WeakPolarHBondContact O-CB 3.39Å; E154-Q157 PolarHBondContact O-N 3.22Å; N155-Q157 PolarHBondContact O-N 3.37Å
158	E	45	Very low	61.5	Low	168 Å²	168	94.2 Å²	94.2	79%	0.785	50%	0.501	S	S	*	.	H	α-helix	trans	-83.1	-21.9	179.5	-68.6	-168.3	152.8	0	0	114.2	E154 M160	E154-E158 PolarHBondContact O-N 2.74Å; E154-E158 VanDerWaalsContact O-N 3.11Å; E158-M160 PolarHBondContact O-N 3Å; E158-M160 VanDerWaalsContact O-N 3.15Å
159	S	41.6	Very low	62.3	Low	66 Å²	66	89.5 Å²	89.5	46%	0.462	48%	0.477	S	S	.	.			trans	-88.1	76.4	176.1	56	0	0	0	0	112.3	N155 P161	N155-S159 PolarHBondContact O-OG 2.91Å; S159-P161 WeakPolarHBondContact O-CD 3.42Å
160	M	46.7	Very low	63.5	Low	112 Å²	112	88.7 Å²	88.7	55%	0.552	47%	0.468	S	S	*	.			trans	-116.7	66.4	171.1	-79.9	-69.1	-62.8	0	0	113.2	E158 L163 R171	E158-M160 PolarHBondContact O-N 3Å; E158-M160 VanDerWaalsContact O-N 3.15Å; M160-L163 HydrophobicContact CE-CD1 3.71Å; M160-L163 HydrophobicContact CE-CG 4.13Å; M160-L163 HydrophobicContact SD-CD1 3.93Å; M160-L163 HydrophobicContact SD-CD2 4.3Å; M160-L163 HydrophobicContact SD-CG 4.11Å; M160-R171 PolarHBondContact SD-NH1 3.07Å
161	P	53.6	Low	64.4	Low	93 Å²	93	89 Å²	89	60%	0.604	46%	0.464	S	S	*	.	S	Bend	trans	-68.5	159.9	150.6	30.6	-28	0	0	0	109.3	S159 L163	S159-P161 WeakPolarHBondContact O-CD 3.42Å; P161-L163 PolarHBondContact O-N 3.35Å
162	S	55	Low	65.6	Low	120 Å²	120	86 Å²	86	84%	0.839	45%	0.451	S	S	*	.			trans	-46.3	112.3	178.2	55.5	0	0	0	0	111.2	S164	S162-S164 PolarHBondContact O-N 3.43Å
163	L	64.6	Low	66.9	Low	53 Å²	53	82.6 Å²	82.6	28%	0.277	43%	0.432	S	S	.	.			trans	-63.7	125.3	-176.4	-68.4	157.9	0	0	0	109.5	M160 P161 Q167 T168 R171	M160-L163 HydrophobicContact CE-CD1 3.71Å; M160-L163 HydrophobicContact CE-CG 4.13Å; M160-L163 HydrophobicContact SD-CD1 3.93Å; M160-L163 HydrophobicContact SD-CD2 4.3Å; M160-L163 HydrophobicContact SD-CG 4.11Å; P161-L163 PolarHBondContact O-N 3.35Å; L163-Q167 HydrophobicContact CB-CB 4.36Å; L163-Q167 HydrophobicContact CD2-CB 3.84Å; L163-T168 WeakPolarHBondContact CB-OG1 3.3Å; L163-R171 VanDerWaalsContact CD2-CZ 3.44Å; L163-R171 VanDerWaalsContact CD2-NH1 3.29Å
164	S	80.3	Confident	68.1	Low	68 Å²	68	84 Å²	84	48%	0.476	43%	0.434	S	S	.	.			trans	-59	147.1	166.4	177.1	0	0	0	0	109.2	S162 R166 Q167 T168	S162-S164 PolarHBondContact O-N 3.43Å; S164-R166 PolarHBondContact O-N 2.8Å; S164-Q167 WeakPolarHBondContact O-CA 3.4Å; S164-Q167 WeakPolarHBondContact O-CB 3.44Å; S164-Q167 PolarHBondContact O-N 3.04Å; S164-T168 PolarHBondContact O-N 3.38Å; S164-T168 PolarHBondContact O-OG1 2.93Å
165	F	83	Confident	69.2	Low	154 Å²	154	84 Å²	84	68%	0.675	44%	0.436	S	S	*	.	H	α-helix	trans	-45.2	-39.4	175.5	175.3	-99.6	0	0	0	112.5	Q167 T168 M169	F165-Q167 PolarHBondContact O-N 2.71Å; F165-T168 PolarHBondContact O-N 3.09Å; F165-M169 HydrophobicContact CE1-SD 4.37Å; F165-M169 WeakPolarHBondContact O-CB 3.29Å; F165-M169 PolarHBondContact O-N 2.86Å
166	R	86.3	Confident	70.9	Confident	100 Å²	100	81.3 Å²	81.3	38%	0.377	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-43.7	176.2	-170.4	-178.8	67.8	173.4	0.6	113.1	S164 M169 W170 F246	S164-R166 PolarHBondContact O-N 2.8Å; R166-M169 PolarHBondContact O-N 2.86Å; R166-W170 WeakPolarHBondContact O-CB 3.34Å; R166-W170 PolarHBondContact O-N 3.43Å; R166-F246 WeakPolarHBondContact CD-O 3.37Å
167	Q	83.4	Confident	72.2	Confident	85 Å²	85	84 Å²	84	40%	0.397	43%	0.432	S	S	.	.	H	α-helix	trans	-69.9	-37.1	179	-69.2	169.2	-29.6	0	0	111.2	L163 S164 F165 W170 R171	L163-Q167 HydrophobicContact CB-CB 4.36Å; L163-Q167 HydrophobicContact CD2-CB 3.84Å; S164-Q167 WeakPolarHBondContact O-CA 3.4Å; S164-Q167 WeakPolarHBondContact O-CB 3.44Å; S164-Q167 PolarHBondContact O-N 3.04Å; F165-Q167 PolarHBondContact O-N 2.71Å; Q167-W170 PolarHBondContact O-N 2.88Å; Q167-R171 WeakPolarHBondContact O-CG 3.26Å; Q167-R171 PolarHBondContact O-N 2.86Å
168	T	83.4	Confident	73.7	Confident	71 Å²	71	83 Å²	83	44%	0.436	43%	0.433	S	S	.	.	H	α-helix	trans	-61.3	-46.2	172.7	-56	0	0	0	0	110.9	L163 S164 F165 R171 A172	L163-T168 WeakPolarHBondContact CB-OG1 3.3Å; S164-T168 PolarHBondContact O-N 3.38Å; S164-T168 PolarHBondContact O-OG1 2.93Å; F165-T168 PolarHBondContact O-N 3.09Å; T168-R171 PolarHBondContact O-N 3.31Å; T168-A172 WeakPolarHBondContact O-CB 3.28Å; T168-A172 PolarHBondContact O-N 3.37Å
169	M	86.1	Confident	75.6	Confident	30 Å²	30	77.1 Å²	77.1	15%	0.148	41%	0.411	C	S	.	.	H	α-helix	trans	-64.3	-41.8	177.2	-169.8	164.8	77.3	0	0	112.4	F165 R166 R171 A172 F173 F246 A247	F165-M169 HydrophobicContact CE1-SD 4.37Å; F165-M169 WeakPolarHBondContact O-CB 3.29Å; F165-M169 PolarHBondContact O-N 2.86Å; R166-M169 PolarHBondContact O-N 2.86Å; M169-R171 PolarHBondContact O-N 2.84Å; M169-A172 WeakPolarHBondContact O-CB 3.45Å; M169-A172 PolarHBondContact O-N 3.48Å; M169-F173 HydrophobicContact CE-CE2 4.48Å; M169-F173 HydrophobicContact CG-CD2 3.94Å; M169-F173 HydrophobicContact CG-CE2 3.49Å; M169-F173 VanDerWaalsContact CG-CE2 3.49Å; M169-F173 HydrophobicContact CG-CZ 4.33Å; M169-F173 VanDerWaalsContact O-CD2 3.24Å; M169-F173 WeakPolarHBondContact O-CD2 3.35Å; M169-F173 PolarHBondContact O-N 3.43Å; M169-F173 VanDerWaalsContact O-N 3.08Å; M169-F173 HydrophobicContact SD-CE2 4.1Å; M169-F246 HydrophobicContact CE-CD1 3.51Å; M169-F246 HydrophobicContact CE-CE1 4.1Å; M169-A247 HydrophobicContact CB-CB 4.35Å; M169-A247 HydrophobicContact CE-CB 3.73Å; M169-A247 HydrophobicContact CG-CB 4.2Å
170	W	88.1	Confident	77.7	Confident	63 Å²	63	79.8 Å²	79.8	24%	0.239	43%	0.425	C	S	.	.	H	α-helix	trans	-59	-45.8	174.4	179.3	-109.6	0	0	0	112.1	R166 Q167 A172 F173 E174 A247 A248 F254	R166-W170 WeakPolarHBondContact O-CB 3.34Å; R166-W170 PolarHBondContact O-N 3.43Å; Q167-W170 PolarHBondContact O-N 2.88Å; W170-A172 VanDerWaalsContact C-N 3.34Å; W170-A172 PolarHBondContact O-N 3.42Å; W170-F173 PolarHBondContact O-N 3.31Å; W170-E174 PolarHBondContact O-N 3.43Å; W170-E174 VanDerWaalsContact O-N 3.08Å; W170-A247 HydrophobicContact CB-CB 4.07Å; W170-A247 HydrophobicContact CE3-CB 4.06Å; W170-A248 HydrophobicContact CE3-CB 4.13Å; W170-A248 HydrophobicContact CH2-CB 4.33Å; W170-A248 HydrophobicContact CZ3-CB 3.77Å; W170-F254 AromaticContact CH2-CD2 3.73Å; W170-F254 HydrophobicContact CH2-CD2 3.73Å; W170-F254 HydrophobicContact CH2-CE2 4.02Å; W170-F254 AromaticContact CZ3-CD2 3.92Å; W170-F254 HydrophobicContact CZ3-CD2 3.92Å; W170-F254 AromaticContact CZ3-CE2 3.99Å; W170-F254 HydrophobicContact CZ3-CE2 3.99Å
171	R	82.1	Confident	79.6	Confident	74 Å²	74	79.7 Å²	79.7	28%	0.279	43%	0.425	S	S	.	.	H	α-helix	trans	-65.1	-37.2	177.8	-75.7	-176.4	177.4	175	1.8	112.7	M160 L163 Q167 T168 M169 F173 E174 N175	M160-R171 PolarHBondContact SD-NH1 3.07Å; L163-R171 VanDerWaalsContact CD2-CZ 3.44Å; L163-R171 VanDerWaalsContact CD2-NH1 3.29Å; Q167-R171 WeakPolarHBondContact O-CG 3.26Å; Q167-R171 PolarHBondContact O-N 2.86Å; T168-R171 PolarHBondContact O-N 3.31Å; M169-R171 PolarHBondContact O-N 2.84Å; R171-F173 VanDerWaalsContact C-N 3.33Å; R171-E174 PolarHBondContact O-N 2.88Å; R171-N175 PolarHBondContact O-N 2.89Å
172	A	85.5	Confident	81.2	Confident	20 Å²	20	75.4 Å²	75.4	17%	0.165	40%	0.398	C	S	.	.	H	α-helix	trans	-61.7	-40	174.5	0	0	0	0	0	111.8	T168 M169 W170 A182	T168-A172 WeakPolarHBondContact O-CB 3.28Å; T168-A172 PolarHBondContact O-N 3.37Å; M169-A172 WeakPolarHBondContact O-CB 3.45Å; M169-A172 PolarHBondContact O-N 3.48Å; W170-A172 VanDerWaalsContact C-N 3.34Å; W170-A172 PolarHBondContact O-N 3.42Å; A172-A182 HydrophobicContact CB-CB 3.87Å; A172-A182 VanDerWaalsContact O-CB 3.22Å; A172-A182 WeakPolarHBondContact O-CB 2.95Å
173	F	85.6	Confident	82.9	Confident	31 Å²	31	72.5 Å²	72.5	14%	0.136	37%	0.373	C	S	.	.	H	α-helix	trans	-74.6	-31.7	178.3	-74	-51.6	0	0	0	114.6	M169 W170 R171 L243 R244 A247	M169-F173 HydrophobicContact CE-CE2 4.48Å; M169-F173 HydrophobicContact CG-CD2 3.94Å; M169-F173 HydrophobicContact CG-CE2 3.49Å; M169-F173 VanDerWaalsContact CG-CE2 3.49Å; M169-F173 HydrophobicContact CG-CZ 4.33Å; M169-F173 VanDerWaalsContact O-CD2 3.24Å; M169-F173 WeakPolarHBondContact O-CD2 3.35Å; M169-F173 PolarHBondContact O-N 3.43Å; M169-F173 VanDerWaalsContact O-N 3.08Å; M169-F173 HydrophobicContact SD-CE2 4.1Å; W170-F173 PolarHBondContact O-N 3.31Å; R171-F173 VanDerWaalsContact C-N 3.33Å; F173-L243 HydrophobicContact CE2-CB 3.94Å; F173-L243 HydrophobicContact CZ-CB 3.79Å; F173-L243 HydrophobicContact CZ-CD1 4.34Å; F173-R244 HydrophobicContact CB-CG 4.16Å; F173-R244 HydrophobicContact CD1-CG 4.18Å; F173-R244 HydrophobicContact CD2-CG 3.83Å; F173-R244 HydrophobicContact CE2-CG 4.22Å; F173-R244 HydrophobicContact CG-CG 3.81Å; F173-A247 HydrophobicContact CD2-CB 4.22Å; F173-A247 HydrophobicContact CE2-CB 4.48Å
174	E	80.1	Confident	84.2	Confident	67 Å²	67	74 Å²	74	31%	0.313	38%	0.384	S	S	.	.	H	α-helix	trans	-82.8	-35	-178.1	-165.6	62.4	-156.5	0	0	112.3	W170 R171	W170-E174 PolarHBondContact O-N 3.43Å; W170-E174 VanDerWaalsContact O-N 3.08Å; R171-E174 PolarHBondContact O-N 2.88Å
175	N	78.9	Confident	84.6	Confident	88 Å²	88	75.2 Å²	75.2	47%	0.471	38%	0.381	S	S	.	.			trans	-126.7	99.7	-176.2	-68.6	-73.9	0	0	0	111	R171 H177 T178	R171-N175 PolarHBondContact O-N 2.89Å; N175-H177 PolarHBondContact O-N 3.37Å; N175-H177 VanDerWaalsContact O-N 3.14Å; N175-T178 HydrophobicContact CB-CG2 3.44Å; N175-T178 VanDerWaalsContact CB-CG2 3.44Å; N175-T178 WeakPolarHBondContact O-CB 3.35Å; N175-T178 PolarHBondContact O-N 2.94Å; N175-T178 VanDerWaalsContact O-N 3.09Å; N175-T178 PolarHBondContact O-OG1 3.45Å
176	P	82.1	Confident	85	Confident	27 Å²	27	71.3 Å²	71.3	18%	0.175	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-62.9	-24.9	-176.9	24.8	-33.9	0	0	0	113.1	T178 L183 Y186	P176-T178 VanDerWaalsContact C-N 3.28Å; P176-T178 PolarHBondContact O-N 3.1Å; P176-L183 PolarHBondContact O-N 3.26Å; P176-Y186 HydrophobicContact CB-CD2 3.78Å; P176-Y186 HydrophobicContact CB-CG 3.78Å; P176-Y186 HydrophobicContact CG-CD2 3.92Å; P176-Y186 HydrophobicContact CG-CE2 4.22Å; P176-Y186 HydrophobicContact CG-CG 4.35Å
177	H	77.1	Confident	85.2	Confident	172 Å²	172	73.8 Å²	73.8	80%	0.796	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-80.6	-0.2	179.1	-57.9	-65.9	0	0	0	114.6	N175	N175-H177 PolarHBondContact O-N 3.37Å; N175-H177 VanDerWaalsContact O-N 3.14Å
178	T	78.9	Confident	85.7	Confident	80 Å²	80	72.9 Å²	72.9	49%	0.491	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-77	-32.2	-178.3	52.5	0	0	0	0	113.6	N175 P176	N175-T178 HydrophobicContact CB-CG2 3.44Å; N175-T178 VanDerWaalsContact CB-CG2 3.44Å; N175-T178 WeakPolarHBondContact O-CB 3.35Å; N175-T178 PolarHBondContact O-N 2.94Å; N175-T178 VanDerWaalsContact O-N 3.09Å; N175-T178 PolarHBondContact O-OG1 3.45Å; P176-T178 VanDerWaalsContact C-N 3.28Å; P176-T178 PolarHBondContact O-N 3.1Å
179	S	84.6	Confident	86.1	Confident	46 Å²	46	69.9 Å²	69.9	32%	0.322	35%	0.354	S	S	.	.			trans	-148.3	154	-179.7	63.5	0	0	0	0	110.9	L181 A182 L183	S179-L181 PolarHBondContact O-N 3.01Å; S179-A182 WeakPolarHBondContact O-CB 3.45Å; S179-A182 PolarHBondContact O-N 3.08Å; S179-A182 WeakPolarHBondContact OG-CB 3.47Å; S179-A182 PolarHBondContact OG-N 3.21Å; S179-L183 PolarHBondContact O-N 3.24Å
180	T	86.9	Confident	86.3	Confident	122 Å²	122	69.2 Å²	69.2	75%	0.748	36%	0.355	S	S	*	.	H	α-helix	trans	-59.3	-38.1	173.3	50	0	0	0	0	111.4	L183 V184	T180-L183 WeakPolarHBondContact O-CB 3.27Å; T180-L183 PolarHBondContact O-N 3.47Å; T180-V184 WeakPolarHBondContact O-CG2 3.39Å; T180-V184 PolarHBondContact O-N 3.36Å
181	L	86.4	Confident	86.6	Confident	109 Å²	109	72 Å²	72	57%	0.571	37%	0.369	S	S	*	.	H	α-helix	trans	-60.8	-47	174.8	-174.2	68.8	0	0	0	111.7	S179 L183 V184 F185	S179-L181 PolarHBondContact O-N 3.01Å; L181-L183 VanDerWaalsContact C-N 3.27Å; L181-L183 PolarHBondContact O-N 3.37Å; L181-V184 PolarHBondContact O-N 2.98Å; L181-F185 HydrophobicContact CD1-CD2 4.06Å; L181-F185 HydrophobicContact CD1-CE2 3.67Å; L181-F185 HydrophobicContact CD2-CE2 4.14Å; L181-F185 HydrophobicContact CG-CD2 3.84Å; L181-F185 HydrophobicContact CG-CE2 3.69Å; L181-F185 VanDerWaalsContact O-CD2 3.27Å; L181-F185 WeakPolarHBondContact O-CD2 3.21Å; L181-F185 PolarHBondContact O-N 2.9Å
182	A	87.9	Confident	87.2	Confident	4 Å²	4	71.1 Å²	71.1	3%	0.033	37%	0.368	C	S	.	.	H	α-helix	trans	-58.1	-40.8	175.8	0	0	0	0	0	112	A172 S179 F185 Y186	A172-A182 HydrophobicContact CB-CB 3.87Å; A172-A182 VanDerWaalsContact O-CB 3.22Å; A172-A182 WeakPolarHBondContact O-CB 2.95Å; S179-A182 WeakPolarHBondContact O-CB 3.45Å; S179-A182 PolarHBondContact O-N 3.08Å; S179-A182 WeakPolarHBondContact OG-CB 3.47Å; S179-A182 PolarHBondContact OG-N 3.21Å; A182-F185 PolarHBondContact O-N 2.93Å; A182-Y186 VanDerWaalsContact O-CB 3.32Å; A182-Y186 WeakPolarHBondContact O-CB 3.36Å; A182-Y186 PolarHBondContact O-N 3.22Å
183	L	89.4	Confident	87.6	Confident	59 Å²	59	70.4 Å²	70.4	31%	0.309	36%	0.361	S	S	.	.	H	α-helix	trans	-65.1	-42.8	177.5	-169.8	67.7	0	0	0	112	P176 S179 T180 L181 Y186 Y187	P176-L183 PolarHBondContact O-N 3.26Å; S179-L183 PolarHBondContact O-N 3.24Å; T180-L183 WeakPolarHBondContact O-CB 3.27Å; T180-L183 PolarHBondContact O-N 3.47Å; L181-L183 VanDerWaalsContact C-N 3.27Å; L181-L183 PolarHBondContact O-N 3.37Å; L183-Y186 WeakPolarHBondContact O-CB 3.47Å; L183-Y186 PolarHBondContact O-N 3.08Å; L183-Y187 HydrophobicContact CD1-CD2 4.21Å; L183-Y187 HydrophobicContact CD1-CE2 3.59Å; L183-Y187 HydrophobicContact CD2-CE2 4.19Å; L183-Y187 HydrophobicContact CG-CD2 3.97Å; L183-Y187 HydrophobicContact CG-CE2 3.63Å; L183-Y187 WeakPolarHBondContact O-CD2 3.33Å; L183-Y187 PolarHBondContact O-N 2.94Å
184	V	91.2	Very high	88	Confident	85 Å²	85	71.2 Å²	71.2	52%	0.515	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-49.1	175.3	172.4	0	0	0	0	110.6	T180 L181 Y186 Y187 V188	T180-V184 WeakPolarHBondContact O-CG2 3.39Å; T180-V184 PolarHBondContact O-N 3.36Å; L181-V184 PolarHBondContact O-N 2.98Å; V184-Y186 VanDerWaalsContact C-N 3.26Å; V184-Y186 PolarHBondContact O-N 3.27Å; V184-Y187 PolarHBondContact O-N 2.66Å; V184-V188 HydrophobicContact CG1-CG2 4.13Å; V184-V188 WeakPolarHBondContact O-CB 3.43Å; V184-V188 VanDerWaalsContact O-CG2 3.29Å; V184-V188 WeakPolarHBondContact O-CG2 3.37Å; V184-V188 PolarHBondContact O-N 3.36Å
185	F	89.8	Confident	88.7	Confident	92 Å²	92	69.7 Å²	69.7	40%	0.404	37%	0.368	S	S	.	.	H	α-helix	trans	-57.4	-41	176	-86.9	-71.9	0	0	0	112.1	L181 A182 T189	L181-F185 HydrophobicContact CD1-CD2 4.06Å; L181-F185 HydrophobicContact CD1-CE2 3.67Å; L181-F185 HydrophobicContact CD2-CE2 4.14Å; L181-F185 HydrophobicContact CG-CD2 3.84Å; L181-F185 HydrophobicContact CG-CE2 3.69Å; L181-F185 VanDerWaalsContact O-CD2 3.27Å; L181-F185 WeakPolarHBondContact O-CD2 3.21Å; L181-F185 PolarHBondContact O-N 2.9Å; A182-F185 PolarHBondContact O-N 2.93Å; F185-T189 WeakPolarHBondContact O-CB 3.34Å; F185-T189 VanDerWaalsContact O-CG2 3.24Å; F185-T189 WeakPolarHBondContact O-CG2 3.25Å; F185-T189 PolarHBondContact O-N 3.26Å; F185-T189 PolarHBondContact O-OG1 2.7Å
186	Y	90.9	Very high	89.4	Confident	72 Å²	72	65.5 Å²	65.5	28%	0.282	35%	0.346	S	S	.	.	H	α-helix	trans	-59.3	-49	176.6	172.6	-89.1	0	0	0	112.2	P176 A182 L183 V184 T189 G190 H303	P176-Y186 HydrophobicContact CB-CD2 3.78Å; P176-Y186 HydrophobicContact CB-CG 3.78Å; P176-Y186 HydrophobicContact CG-CD2 3.92Å; P176-Y186 HydrophobicContact CG-CE2 4.22Å; P176-Y186 HydrophobicContact CG-CG 4.35Å; A182-Y186 VanDerWaalsContact O-CB 3.32Å; A182-Y186 WeakPolarHBondContact O-CB 3.36Å; A182-Y186 PolarHBondContact O-N 3.22Å; L183-Y186 WeakPolarHBondContact O-CB 3.47Å; L183-Y186 PolarHBondContact O-N 3.08Å; V184-Y186 VanDerWaalsContact C-N 3.26Å; V184-Y186 PolarHBondContact O-N 3.27Å; Y186-T189 PolarHBondContact O-OG1 3.3Å; Y186-G190 PolarHBondContact O-N 3.4Å; Y186-H303 AromaticContact CD2-CD2 3.54Å; Y186-H303 HydrophobicContact CE2-CB 3.84Å; Y186-H303 AromaticContact CE2-CD2 3.44Å; Y186-H303 VanDerWaalsContact CE2-CD2 3.44Å; Y186-H303 WeakPolarHBondContact CE2-CD2 3.39Å; Y186-H303 AromaticContact CE2-CG 3.91Å; Y186-H303 AromaticContact CZ-CD2 3.9Å; Y186-H303 PolarHBondContact O-CD2 3.28Å; Y186-H303 PolarHBondContact O-NE2 2.9Å; Y186-H303 PolarHBondContact OH-O 3.21Å
187	Y	91.8	Very high	90	Very high	153 Å²	153	66 Å²	66	60%	0.6	35%	0.349	S	S	*	.	H	α-helix	trans	-69.9	-40.1	179.4	-74.6	-60.9	0	0	0	113	L183 V184 G190 F191	L183-Y187 HydrophobicContact CD1-CD2 4.21Å; L183-Y187 HydrophobicContact CD1-CE2 3.59Å; L183-Y187 HydrophobicContact CD2-CE2 4.19Å; L183-Y187 HydrophobicContact CG-CD2 3.97Å; L183-Y187 HydrophobicContact CG-CE2 3.63Å; L183-Y187 WeakPolarHBondContact O-CD2 3.33Å; L183-Y187 PolarHBondContact O-N 2.94Å; V184-Y187 PolarHBondContact O-N 2.66Å; Y187-G190 PolarHBondContact O-N 3.26Å; Y187-F191 WeakPolarHBondContact O-CB 3.34Å; Y187-F191 PolarHBondContact O-N 3.37Å
188	V	92.4	Very high	90.8	Very high	66 Å²	66	62.8 Å²	62.8	40%	0.4	34%	0.336	S	S	.	.	H	α-helix	trans	-63.3	-47.7	178.1	171.8	0	0	0	0	110.8	V184 G190 F191 F192	V184-V188 HydrophobicContact CG1-CG2 4.13Å; V184-V188 WeakPolarHBondContact O-CB 3.43Å; V184-V188 VanDerWaalsContact O-CG2 3.29Å; V184-V188 WeakPolarHBondContact O-CG2 3.37Å; V184-V188 PolarHBondContact O-N 3.36Å; V188-G190 VanDerWaalsContact C-N 3.34Å; V188-G190 PolarHBondContact O-N 3.05Å; V188-F191 WeakPolarHBondContact O-CB 3.38Å; V188-F191 PolarHBondContact O-N 3.42Å; V188-F192 HydrophobicContact CG1-CD2 3.94Å; V188-F192 HydrophobicContact CG1-CE2 3.9Å; V188-F192 VanDerWaalsContact O-CD2 3.3Å; V188-F192 WeakPolarHBondContact O-CD2 3.31Å; V188-F192 PolarHBondContact O-N 2.93Å; V188-F192 VanDerWaalsContact O-N 3.1Å
189	T	91.6	Very high	91.4	Very high	7 Å²	7	59.4 Å²	59.4	4%	0.043	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-41.4	176.8	53.1	0	0	0	0	111.6	F185 Y186 F191 F192 I193 E240 H303	F185-T189 WeakPolarHBondContact O-CB 3.34Å; F185-T189 VanDerWaalsContact O-CG2 3.24Å; F185-T189 WeakPolarHBondContact O-CG2 3.25Å; F185-T189 PolarHBondContact O-N 3.26Å; F185-T189 PolarHBondContact O-OG1 2.7Å; Y186-T189 PolarHBondContact O-OG1 3.3Å; T189-F191 PolarHBondContact O-N 3.31Å; T189-F192 PolarHBondContact O-N 2.95Å; T189-I193 WeakPolarHBondContact O-CD1 3.48Å; T189-I193 VanDerWaalsContact O-CG1 3.25Å; T189-I193 WeakPolarHBondContact O-CG1 3.43Å; T189-I193 PolarHBondContact O-N 3.34Å; T189-E240 VanDerWaalsContact CG2-CD 3.44Å; T189-E240 HydrophobicContact CG2-CG 3.94Å; T189-H303 PolarHBondContact OG1-NE2 3.25Å
190	G	92.3	Very high	91.7	Very high	16 Å²	16	58.6 Å²	58.6	17%	0.165	31%	0.307	C	S	.	.	H	α-helix	trans	-59.1	-42.3	173.8	0	0	0	0	0	113.3	Y186 Y187 V188 I193 A194	Y186-G190 PolarHBondContact O-N 3.4Å; Y187-G190 PolarHBondContact O-N 3.26Å; V188-G190 VanDerWaalsContact C-N 3.34Å; V188-G190 PolarHBondContact O-N 3.05Å; G190-I193 PolarHBondContact O-N 3.47Å; G190-A194 PolarHBondContact O-N 3.12Å
191	F	93.8	Very high	92	Very high	123 Å²	123	56.9 Å²	56.9	54%	0.539	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-48.7	176.1	174.1	-100.5	0	0	0	112	Y187 V188 T189 I193 A194 V195	Y187-F191 WeakPolarHBondContact O-CB 3.34Å; Y187-F191 PolarHBondContact O-N 3.37Å; V188-F191 WeakPolarHBondContact O-CB 3.38Å; V188-F191 PolarHBondContact O-N 3.42Å; T189-F191 PolarHBondContact O-N 3.31Å; F191-I193 VanDerWaalsContact C-N 3.31Å; F191-I193 PolarHBondContact O-N 3.47Å; F191-A194 WeakPolarHBondContact O-CB 3.24Å; F191-A194 PolarHBondContact O-N 3.5Å; F191-A194 VanDerWaalsContact O-N 3.14Å; F191-V195 HydrophobicContact CD1-CG2 4.2Å; F191-V195 HydrophobicContact CD2-CG2 4.42Å; F191-V195 HydrophobicContact CE1-CG2 3.76Å; F191-V195 HydrophobicContact CE2-CG2 4Å; F191-V195 HydrophobicContact CZ-CG2 3.65Å; F191-V195 WeakPolarHBondContact O-CG2 3.16Å; F191-V195 PolarHBondContact O-N 2.63Å
192	F	94.6	Very high	92.3	Very high	55 Å²	55	54.5 Å²	54.5	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-29.8	178.5	-79.2	-74.8	0	0	0	113.1	V188 T189 S196 I236 F237	V188-F192 HydrophobicContact CG1-CD2 3.94Å; V188-F192 HydrophobicContact CG1-CE2 3.9Å; V188-F192 VanDerWaalsContact O-CD2 3.3Å; V188-F192 WeakPolarHBondContact O-CD2 3.31Å; V188-F192 PolarHBondContact O-N 2.93Å; V188-F192 VanDerWaalsContact O-N 3.1Å; T189-F192 PolarHBondContact O-N 2.95Å; F192-S196 WeakPolarHBondContact O-CB 3.38Å; F192-S196 PolarHBondContact O-N 2.87Å; F192-S196 PolarHBondContact O-OG 3.22Å; F192-I236 HydrophobicContact CD1-CD1 3.58Å; F192-I236 HydrophobicContact CD2-CD1 3.7Å; F192-I236 HydrophobicContact CD2-CG2 4.39Å; F192-I236 HydrophobicContact CE1-CD1 3.42Å; F192-I236 VanDerWaalsContact CE1-CD1 3.42Å; F192-I236 HydrophobicContact CE2-CD1 3.56Å; F192-I236 HydrophobicContact CG-CD1 3.72Å; F192-I236 HydrophobicContact CZ-CD1 3.42Å; F192-I236 VanDerWaalsContact CZ-CD1 3.42Å; F192-F237 HydrophobicContact CB-CE1 4.14Å
193	I	94.3	Very high	92.4	Very high	4 Å²	4	56 Å²	56	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-50.6	168.7	-67.2	163	0	0	0	110	T189 G190 F191 V195 S196 V197 F237 K299 F300 H303	T189-I193 WeakPolarHBondContact O-CD1 3.48Å; T189-I193 VanDerWaalsContact O-CG1 3.25Å; T189-I193 WeakPolarHBondContact O-CG1 3.43Å; T189-I193 PolarHBondContact O-N 3.34Å; G190-I193 PolarHBondContact O-N 3.47Å; F191-I193 VanDerWaalsContact C-N 3.31Å; F191-I193 PolarHBondContact O-N 3.47Å; I193-V195 PolarHBondContact O-N 2.93Å; I193-S196 PolarHBondContact O-N 3.5Å; I193-S196 PolarHBondContact O-OG 2.99Å; I193-V197 WeakPolarHBondContact O-CG2 3.05Å; I193-V197 PolarHBondContact O-N 3.26Å; I193-F237 HydrophobicContact CB-CZ 4.42Å; I193-F237 HydrophobicContact CG1-CE1 3.75Å; I193-F237 HydrophobicContact CG1-CZ 3.79Å; I193-K299 HydrophobicContact CD1-CB 4.12Å; I193-K299 HydrophobicContact CD1-CD 3.97Å; I193-K299 HydrophobicContact CD1-CG 3.72Å; I193-K299 HydrophobicContact CG1-CB 4.39Å; I193-K299 HydrophobicContact CG1-CD 4.05Å; I193-K299 HydrophobicContact CG1-CG 4.23Å; I193-F300 HydrophobicContact CG2-CB 4.38Å; I193-H303 WeakPolarHBondContact CD1-CE1 3.19Å
194	A	94	Very high	92.4	Very high	48 Å²	48	58.3 Å²	58.3	40%	0.397	31%	0.31	S	S	.	.	H	α-helix	trans	-60	-47.3	178.6	0	0	0	0	0	112.1	G190 F191 S196 V197 I198	G190-A194 PolarHBondContact O-N 3.12Å; F191-A194 WeakPolarHBondContact O-CB 3.24Å; F191-A194 PolarHBondContact O-N 3.5Å; F191-A194 VanDerWaalsContact O-N 3.14Å; A194-S196 VanDerWaalsContact C-N 3.31Å; A194-S196 PolarHBondContact O-N 3.42Å; A194-V197 PolarHBondContact O-N 3.1Å; A194-I198 WeakPolarHBondContact O-CB 3.18Å; A194-I198 VanDerWaalsContact O-CG1 3.31Å; A194-I198 WeakPolarHBondContact O-CG1 3.22Å; A194-I198 PolarHBondContact O-N 2.93Å
195	V	94.6	Very high	92.4	Very high	35 Å²	35	57.2 Å²	57.2	21%	0.212	30%	0.303	C	S	.	.	H	α-helix	trans	-57.7	-44.1	176.1	169.4	0	0	0	0	111.1	F191 I193 I198 T199 L229	F191-V195 HydrophobicContact CD1-CG2 4.2Å; F191-V195 HydrophobicContact CD2-CG2 4.42Å; F191-V195 HydrophobicContact CE1-CG2 3.76Å; F191-V195 HydrophobicContact CE2-CG2 4Å; F191-V195 HydrophobicContact CZ-CG2 3.65Å; F191-V195 WeakPolarHBondContact O-CG2 3.16Å; F191-V195 PolarHBondContact O-N 2.63Å; I193-V195 PolarHBondContact O-N 2.93Å; V195-I198 PolarHBondContact O-N 3.14Å; V195-T199 WeakPolarHBondContact O-CB 3.44Å; V195-T199 PolarHBondContact O-N 2.91Å; V195-T199 PolarHBondContact O-OG1 3.48Å; V195-L229 HydrophobicContact CG1-CD1 4.48Å; V195-L229 HydrophobicContact CG1-CD2 3.88Å; V195-L229 HydrophobicContact CG1-CG 4.47Å
196	S	93.9	Very high	92.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-49.9	176.1	80	0	0	0	0	110.7	F192 I193 A194 I198 T199 N200 R296	F192-S196 WeakPolarHBondContact O-CB 3.38Å; F192-S196 PolarHBondContact O-N 2.87Å; F192-S196 PolarHBondContact O-OG 3.22Å; I193-S196 PolarHBondContact O-N 3.5Å; I193-S196 PolarHBondContact O-OG 2.99Å; A194-S196 VanDerWaalsContact C-N 3.31Å; A194-S196 PolarHBondContact O-N 3.42Å; S196-I198 VanDerWaalsContact C-N 3.34Å; S196-I198 PolarHBondContact O-N 2.86Å; S196-T199 WeakPolarHBondContact O-CB 3.48Å; S196-T199 PolarHBondContact O-N 2.87Å; S196-T199 VanDerWaalsContact O-N 3.12Å; S196-N200 PolarHBondContact O-N 2.97Å; S196-R296 VanDerWaalsContact C-NE 3.34Å; S196-R296 VanDerWaalsContact C-NH2 3.34Å; S196-R296 PolarHBondContact O-NE 3.37Å; S196-R296 PolarHBondContact O-NH2 3.49Å; S196-R296 WeakPolarHBondContact OG-CD 3.19Å; S196-R296 PolarHBondContact OG-NE 2.71Å
197	V	93.7	Very high	91.8	Very high	38 Å²	38	55 Å²	55	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-44.5	-179.6	174.8	0	0	0	0	111.3	I193 A194 T199 N200 V201 R296 I297	I193-V197 WeakPolarHBondContact O-CG2 3.05Å; I193-V197 PolarHBondContact O-N 3.26Å; A194-V197 PolarHBondContact O-N 3.1Å; V197-T199 VanDerWaalsContact C-N 3.32Å; V197-T199 PolarHBondContact O-N 3.18Å; V197-N200 WeakPolarHBondContact O-CB 3.32Å; V197-N200 PolarHBondContact O-N 3.3Å; V197-V201 PolarHBondContact O-N 2.82Å; V197-R296 HydrophobicContact CG2-CG 4.23Å; V197-I297 HydrophobicContact CG1-CD1 4.46Å; V197-I297 HydrophobicContact CG2-CB 4.22Å; V197-I297 HydrophobicContact CG2-CG1 4.22Å
198	I	93.7	Very high	91	Very high	105 Å²	105	49.9 Å²	49.9	54%	0.538	30%	0.3	S	S	.	.	H	α-helix	trans	-59.9	-44.3	176.3	-68.7	163.3	0	0	0	110.6	A194 V195 S196 N200 V201 V202	A194-I198 WeakPolarHBondContact O-CB 3.18Å; A194-I198 VanDerWaalsContact O-CG1 3.31Å; A194-I198 WeakPolarHBondContact O-CG1 3.22Å; A194-I198 PolarHBondContact O-N 2.93Å; V195-I198 PolarHBondContact O-N 3.14Å; S196-I198 VanDerWaalsContact C-N 3.34Å; S196-I198 PolarHBondContact O-N 2.86Å; I198-N200 VanDerWaalsContact C-N 3.32Å; I198-N200 PolarHBondContact O-N 2.75Å; I198-V201 WeakPolarHBondContact O-CB 3.31Å; I198-V201 PolarHBondContact O-N 3.47Å; I198-V202 HydrophobicContact CG2-CG2 3.96Å; I198-V202 WeakPolarHBondContact O-CG2 3.38Å; I198-V202 PolarHBondContact O-N 2.77Å
199	T	92.3	Very high	89.9	Confident	9 Å²	9	52.4 Å²	52.4	6%	0.055	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-40.7	179.1	-58	0	0	0	0	112	V195 S196 V197 V201 V202 E203 F226 L229	V195-T199 WeakPolarHBondContact O-CB 3.44Å; V195-T199 PolarHBondContact O-N 2.91Å; V195-T199 PolarHBondContact O-OG1 3.48Å; S196-T199 WeakPolarHBondContact O-CB 3.48Å; S196-T199 PolarHBondContact O-N 2.87Å; S196-T199 VanDerWaalsContact O-N 3.12Å; V197-T199 VanDerWaalsContact C-N 3.32Å; V197-T199 PolarHBondContact O-N 3.18Å; T199-V201 VanDerWaalsContact C-N 3.27Å; T199-V201 PolarHBondContact O-N 3.08Å; T199-V202 PolarHBondContact O-N 2.56Å; T199-E203 VanDerWaalsContact O-CB 3.32Å; T199-E203 WeakPolarHBondContact O-CB 3.42Å; T199-E203 PolarHBondContact O-N 3.38Å; T199-F226 HydrophobicContact CG2-CD1 3.41Å; T199-F226 VanDerWaalsContact CG2-CD1 3.41Å; T199-F226 HydrophobicContact CG2-CE1 3.69Å; T199-L229 HydrophobicContact CG2-CD1 4.06Å; T199-L229 HydrophobicContact CG2-CD2 3.87Å; T199-L229 HydrophobicContact CG2-CG 4.41Å; T199-L229 WeakPolarHBondContact OG1-CD1 3.36Å; T199-L229 VanDerWaalsContact OG1-CD2 3.24Å; T199-L229 WeakPolarHBondContact OG1-CD2 3.42Å
200	N	90.6	Very high	88.7	Confident	28 Å²	28	55 Å²	55	15%	0.15	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-38.9	175.1	-91.7	-12.7	0	0	0	111.8	S196 V197 I198 R293 R296	S196-N200 PolarHBondContact O-N 2.97Å; V197-N200 WeakPolarHBondContact O-CB 3.32Å; V197-N200 PolarHBondContact O-N 3.3Å; I198-N200 VanDerWaalsContact C-N 3.32Å; I198-N200 PolarHBondContact O-N 2.75Å; N200-R293 PolarHBondContact ND2-O 3.41Å; N200-R293 VanDerWaalsContact ND2-O 3.15Å; N200-R296 VanDerWaalsContact ND2-CZ 3.25Å; N200-R296 PolarHBondContact ND2-NE 3.21Å; N200-R296 PolarHBondContact ND2-NH2 2.9Å; N200-R296 PolarHBondContact OD1-NH2 3.15Å
201	V	92.3	Very high	87.1	Confident	86 Å²	86	60.6 Å²	60.6	52%	0.521	37%	0.366	S	S	.	.	H	α-helix	trans	-70.2	-50.9	179.4	176.9	0	0	0	0	109.7	V197 I198 T199 E203 T204	V197-V201 PolarHBondContact O-N 2.82Å; I198-V201 WeakPolarHBondContact O-CB 3.31Å; I198-V201 PolarHBondContact O-N 3.47Å; T199-V201 VanDerWaalsContact C-N 3.27Å; T199-V201 PolarHBondContact O-N 3.08Å; V201-E203 VanDerWaalsContact C-N 3.28Å; V201-E203 PolarHBondContact O-N 3.47Å; V201-T204 PolarHBondContact O-N 3.29Å; V201-T204 VanDerWaalsContact O-N 3.08Å; V201-T204 PolarHBondContact O-OG1 3.17Å
202	V	92.6	Very high	85.9	Confident	59 Å²	59	59 Å²	59	36%	0.358	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-32.5	-178	-177.2	0	0	0	0	112	I198 T199 T204 V205 C218 F226	I198-V202 HydrophobicContact CG2-CG2 3.96Å; I198-V202 WeakPolarHBondContact O-CG2 3.38Å; I198-V202 PolarHBondContact O-N 2.77Å; T199-V202 PolarHBondContact O-N 2.56Å; V202-T204 PolarHBondContact O-N 3.37Å; V202-T204 VanDerWaalsContact O-N 3.1Å; V202-V205 PolarHBondContact O-N 3.12Å; V202-V205 VanDerWaalsContact O-N 3.12Å; V202-C218 WeakPolarHBondContact O-CB 3.48Å; V202-F226 HydrophobicContact CB-CE1 4.38Å; V202-F226 HydrophobicContact CB-CZ 4.36Å; V202-F226 HydrophobicContact CG1-CE1 4.39Å; V202-F226 HydrophobicContact CG1-CZ 3.89Å
203	E	90.4	Very high	84.6	Confident	35 Å²	35	59.9 Å²	59.9	16%	0.164	40%	0.396	C	S	.	.	H	α-helix	trans	-55.3	-29.9	175.2	-168	179.7	171.5	0	0	112.2	T199 V201 G219 F226 R293	T199-E203 VanDerWaalsContact O-CB 3.32Å; T199-E203 WeakPolarHBondContact O-CB 3.42Å; T199-E203 PolarHBondContact O-N 3.38Å; V201-E203 VanDerWaalsContact C-N 3.28Å; V201-E203 PolarHBondContact O-N 3.47Å; E203-G219 PolarHBondContact O-N 2.78Å; E203-G219 VanDerWaalsContact O-N 3.1Å; E203-F226 HydrophobicContact CB-CD1 4.21Å; E203-F226 HydrophobicContact CB-CE1 4.15Å; E203-F226 HydrophobicContact CG-CD1 4.45Å; E203-R293 IonicContact OE1-NH1 2.86Å; E203-R293 PolarHBondContact OE1-NH1 2.73Å; E203-R293 IonicContact OE2-NH1 3.51Å; E203-R293 PolarHBondContact OE2-NH1 2.93Å
204	T	89.5	Confident	83.4	Confident	109 Å²	109	68.9 Å²	68.9	67%	0.669	44%	0.435	S	S	*	.	H	α-helix	trans	-92.5	-11.8	-178.1	67.6	0	0	0	0	114.8	V201 V202	V201-T204 PolarHBondContact O-N 3.29Å; V201-T204 VanDerWaalsContact O-N 3.08Å; V201-T204 PolarHBondContact O-OG1 3.17Å; V202-T204 PolarHBondContact O-N 3.37Å; V202-T204 VanDerWaalsContact O-N 3.1Å
205	V	90.4	Very high	82.6	Confident	62 Å²	62	73 Å²	73	38%	0.376	45%	0.447	S	S	.	.	S	Bend	trans	-69.7	140.4	-179.5	174.1	0	0	0	0	109.3	V202 C207 P217 C218	V202-V205 PolarHBondContact O-N 3.12Å; V202-V205 VanDerWaalsContact O-N 3.12Å; V205-C207 PolarHBondContact O-N 2.81Å; V205-P217 CarbonylContact O-C 3.55Å; V205-P217 WeakPolarHBondContact O-CA 3.14Å; V205-C218 PolarHBondContact O-N 3.02Å; V205-C218 PolarHBondContact O-SG 3.34Å
206	P	88.6	Confident	82	Confident	72 Å²	72	73.6 Å²	73.6	47%	0.468	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-68.3	121.6	171.8	26.1	-32.7	0	0	0	110.4	E215	P206-E215 HydrophobicContact CB-CB 4.06Å
207	C	80	Confident	81.7	Confident	46 Å²	46	75.4 Å²	75.4	31%	0.311	46%	0.46	S	S	.	.			trans	-126.7	77.2	176.7	-79.2	0	0	0	0	110.1	V205 L216 C218	V205-C207 PolarHBondContact O-N 2.81Å; C207-L216 CarbonylContact C-O 3.51Å; C207-L216 PolarHBondContact N-O 3.38Å; C207-C218 HydrophobicContact CB-CB 3.62Å; C207-C218 WeakPolarHBondContact CB-SG 3.49Å; C207-C218 WeakPolarHBondContact SG-CB 3.28Å; C207-C218 CovalentContact SG-SG 2.01Å; C207-C218 PolarHBondContact SG-SG 3.07Å
208	G	74.8	Confident	81.4	Confident	44 Å²	44	73.7 Å²	73.7	45%	0.454	45%	0.449	S	S	.	.			trans	122.9	142	167.9	0	0	0	0	0	113.7	L216	G208-L216 PolarHBondContact O-N 3.24Å
209	T	69.8	Low	81	Confident	120 Å²	120	69.2 Å²	69.2	74%	0.736	43%	0.43	S	S	*	.			trans	-103.6	116.3	172.4	36.3	0	0	0	0	108.3
210	V	67.1	Low	80.7	Confident	61 Å²	61	74.3 Å²	74.3	37%	0.37	45%	0.453	S	S	.	.			trans	-81.7	133.5	166	179.8	0	0	0	0	106.8	G212 S213	V210-G212 PolarHBondContact O-N 3.13Å; V210-S213 WeakPolarHBondContact CB-OG 3.49Å; V210-S213 PolarHBondContact O-N 3.12Å
211	P	58.8	Low	80.5	Confident	134 Å²	134	80.1 Å²	80.1	87%	0.87	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	106.2	176.9	-10.5	20.7	0	0	0	109.6
212	G	67	Low	80.4	Confident	88 Å²	88	82.4 Å²	82.4	91%	0.907	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.4	1.7	175.2	0	0	0	0	0	117.7	V210	V210-G212 PolarHBondContact O-N 3.13Å
213	S	67.3	Low	80.1	Confident	74 Å²	74	82.9 Å²	82.9	52%	0.517	48%	0.478	S	S	.	.	S	Bend	trans	-136.8	164.6	176.6	64.5	0	0	0	0	113.9	V210	V210-S213 WeakPolarHBondContact CB-OG 3.49Å; V210-S213 PolarHBondContact O-N 3.12Å
214	K	69.3	Low	80.1	Confident	194 Å²	194	86.7 Å²	86.7	84%	0.843	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-48.7	148.3	179.2	-65.4	177.9	179.3	176.2	0	112	L216	K214-L216 PolarHBondContact O-N 3.09Å
215	E	76.9	Confident	80.2	Confident	135 Å²	135	84.4 Å²	84.4	63%	0.631	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-51.1	126.4	175.7	-64.1	-175.9	171.6	0	0	110.8	P206	P206-E215 HydrophobicContact CB-CB 4.06Å
216	L	82.9	Confident	80.3	Confident	46 Å²	46	82.9 Å²	82.9	24%	0.241	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-91.2	129.6	-176.3	-154	80.6	0	0	0	109.8	C207 G208 K214 E220 R221	C207-L216 CarbonylContact C-O 3.51Å; C207-L216 PolarHBondContact N-O 3.38Å; G208-L216 PolarHBondContact O-N 3.24Å; K214-L216 PolarHBondContact O-N 3.09Å; L216-E220 WeakPolarHBondContact CD1-OE2 3.49Å; L216-E220 HydrophobicContact CD2-CB 4.2Å; L216-E220 HydrophobicContact CG-CB 4.14Å; L216-R221 HydrophobicContact CD2-CB 4.42Å
217	P	87.6	Confident	80.4	Confident	38 Å²	38	85.4 Å²	85.4	25%	0.247	49%	0.489	C	S	.	.	B	Isolated β-bridge	trans	-68.7	149.2	176.8	26.6	-32.8	0	0	0	112	V205 G219 E220 R221	V205-P217 CarbonylContact O-C 3.55Å; V205-P217 WeakPolarHBondContact O-CA 3.14Å; P217-G219 PolarHBondContact O-N 2.89Å; P217-G219 VanDerWaalsContact O-N 3.15Å; P217-E220 HydrophobicContact CG-CB 4.26Å; P217-E220 HydrophobicContact CG-CG 3.97Å; P217-E220 PolarHBondContact O-N 2.66Å; P217-R221 PolarHBondContact O-N 3.43Å
218	C	87.4	Confident	81	Confident	2 Å²	2	87.1 Å²	87.1	1%	0.014	50%	0.5	C	S	.	.	H	α-helix	trans	-56.2	-32.5	178.6	-46.2	0	0	0	0	112.2	V202 V205 C207 E220 R221 Y222 F226	V202-C218 WeakPolarHBondContact O-CB 3.48Å; V205-C218 PolarHBondContact O-N 3.02Å; V205-C218 PolarHBondContact O-SG 3.34Å; C207-C218 HydrophobicContact CB-CB 3.62Å; C207-C218 WeakPolarHBondContact CB-SG 3.49Å; C207-C218 WeakPolarHBondContact SG-CB 3.28Å; C207-C218 CovalentContact SG-SG 2.01Å; C207-C218 PolarHBondContact SG-SG 3.07Å; C218-E220 VanDerWaalsContact C-N 3.31Å; C218-E220 PolarHBondContact O-N 3.21Å; C218-R221 PolarHBondContact O-N 3.22Å; C218-Y222 PolarHBondContact O-N 3.46Å; C218-F226 HydrophobicContact CB-CE2 4.05Å; C218-F226 HydrophobicContact CB-CZ 4.22Å; C218-F226 WeakPolarHBondContact O-CE2 3.43Å
219	G	86	Confident	81.9	Confident	12 Å²	12	87.9 Å²	87.9	12%	0.124	49%	0.493	C	S	.	.	H	α-helix	trans	-60	-35.9	176.4	0	0	0	0	0	114.1	E203 P217 S223	E203-G219 PolarHBondContact O-N 2.78Å; E203-G219 VanDerWaalsContact O-N 3.1Å; P217-G219 PolarHBondContact O-N 2.89Å; P217-G219 VanDerWaalsContact O-N 3.15Å; G219-S223 WeakPolarHBondContact O-CA 3.28Å; G219-S223 PolarHBondContact O-N 3.22Å
220	E	85.5	Confident	83	Confident	115 Å²	115	82.6 Å²	82.6	54%	0.537	46%	0.46	S	S	.	.	H	α-helix	trans	-81.9	-38.7	177.7	-72.4	-176.8	-168	0	0	111.6	L216 P217 C218 Y222	L216-E220 WeakPolarHBondContact CD1-OE2 3.49Å; L216-E220 HydrophobicContact CD2-CB 4.2Å; L216-E220 HydrophobicContact CG-CB 4.14Å; P217-E220 HydrophobicContact CG-CB 4.26Å; P217-E220 HydrophobicContact CG-CG 3.97Å; P217-E220 PolarHBondContact O-N 2.66Å; C218-E220 VanDerWaalsContact C-N 3.31Å; C218-E220 PolarHBondContact O-N 3.21Å; E220-Y222 PolarHBondContact O-N 3.13Å
221	R	86.1	Confident	84.2	Confident	151 Å²	151	81.2 Å²	81.2	57%	0.57	45%	0.453	S	S	*	.	H	α-helix	trans	-61.7	-43.3	177.7	-174.4	75.3	-176.7	176.7	2.8	112.4	L216 P217 C218	L216-R221 HydrophobicContact CD2-CB 4.42Å; P217-R221 PolarHBondContact O-N 3.43Å; C218-R221 PolarHBondContact O-N 3.22Å
222	Y	90	Very high	85.9	Confident	134 Å²	134	77 Å²	77	53%	0.525	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	42.3	-175.5	-60	-70.4	0	0	0	112.1	C218 E220 V224 A225 F226	C218-Y222 PolarHBondContact O-N 3.46Å; E220-Y222 PolarHBondContact O-N 3.13Å; Y222-V224 VanDerWaalsContact C-N 3.28Å; Y222-V224 PolarHBondContact O-N 2.97Å; Y222-A225 PolarHBondContact O-N 3.31Å; Y222-F226 WeakPolarHBondContact O-CD2 3.28Å; Y222-F226 PolarHBondContact O-N 2.91Å; Y222-F226 VanDerWaalsContact O-N 3.08Å
223	S	87.6	Confident	87.2	Confident	68 Å²	68	72.9 Å²	72.9	48%	0.476	39%	0.386	S	S	.	.	H	α-helix	trans	-52.2	-41.1	-174.4	59.9	0	0	0	0	114.1	G219 F227	G219-S223 WeakPolarHBondContact O-CA 3.28Å; G219-S223 PolarHBondContact O-N 3.22Å; S223-F227 WeakPolarHBondContact O-CB 3.36Å; S223-F227 PolarHBondContact O-N 3.32Å
224	V	89.9	Confident	88.6	Confident	116 Å²	116	69.6 Å²	69.6	70%	0.703	36%	0.363	S	S	*	.	H	α-helix	trans	-65	-41.5	178.4	-178.6	0	0	0	0	112	Y222 C228	Y222-V224 VanDerWaalsContact C-N 3.28Å; Y222-V224 PolarHBondContact O-N 2.97Å; V224-C228 WeakPolarHBondContact O-CB 3.4Å; V224-C228 PolarHBondContact O-N 3.25Å
225	A	92.1	Very high	89.8	Confident	61 Å²	61	65.2 Å²	65.2	50%	0.504	35%	0.347	S	S	.	.	H	α-helix	trans	-68.2	-45.8	-179.8	0	0	0	0	0	111.1	Y222 C228 L229	Y222-A225 PolarHBondContact O-N 3.31Å; A225-C228 PolarHBondContact O-N 2.73Å; A225-L229 WeakPolarHBondContact O-CB 3.29Å; A225-L229 PolarHBondContact O-N 3.46Å
226	F	92.1	Very high	90.6	Very high	29 Å²	29	61.3 Å²	61.3	13%	0.127	33%	0.329	C	S	.	.	H	α-helix	trans	-64	-40.4	176	-79.6	-76.9	0	0	0	112.2	T199 V202 E203 C218 Y222 L229 D230	T199-F226 HydrophobicContact CG2-CD1 3.41Å; T199-F226 VanDerWaalsContact CG2-CD1 3.41Å; T199-F226 HydrophobicContact CG2-CE1 3.69Å; V202-F226 HydrophobicContact CB-CE1 4.38Å; V202-F226 HydrophobicContact CB-CZ 4.36Å; V202-F226 HydrophobicContact CG1-CE1 4.39Å; V202-F226 HydrophobicContact CG1-CZ 3.89Å; E203-F226 HydrophobicContact CB-CD1 4.21Å; E203-F226 HydrophobicContact CB-CE1 4.15Å; E203-F226 HydrophobicContact CG-CD1 4.45Å; C218-F226 HydrophobicContact CB-CE2 4.05Å; C218-F226 HydrophobicContact CB-CZ 4.22Å; C218-F226 WeakPolarHBondContact O-CE2 3.43Å; Y222-F226 WeakPolarHBondContact O-CD2 3.28Å; Y222-F226 PolarHBondContact O-N 2.91Å; Y222-F226 VanDerWaalsContact O-N 3.08Å; F226-L229 PolarHBondContact O-N 3.05Å; F226-D230 WeakPolarHBondContact O-CB 3.47Å; F226-D230 PolarHBondContact O-N 2.92Å
227	F	90.1	Very high	91.2	Very high	126 Å²	126	59.2 Å²	59.2	55%	0.553	32%	0.318	S	S	*	.	H	α-helix	trans	-62.8	-44.2	174.9	178.9	-99.7	0	0	0	112.2	S223 T231 Y270	S223-F227 WeakPolarHBondContact O-CB 3.36Å; S223-F227 PolarHBondContact O-N 3.32Å; F227-T231 VanDerWaalsContact O-CB 3.24Å; F227-T231 WeakPolarHBondContact O-CB 3.47Å; F227-T231 PolarHBondContact O-N 3.28Å; F227-T231 PolarHBondContact O-OG1 2.94Å; F227-Y270 HydrophobicContact CE2-CE2 4.42Å
228	C	93.2	Very high	91.6	Very high	82 Å²	82	58.3 Å²	58.3	55%	0.554	31%	0.313	S	S	*	.	H	α-helix	trans	-62.8	-43.2	176.8	-173.7	0	0	0	0	111.5	V224 A225 A232	V224-C228 WeakPolarHBondContact O-CB 3.4Å; V224-C228 PolarHBondContact O-N 3.25Å; A225-C228 PolarHBondContact O-N 2.73Å; C228-A232 WeakPolarHBondContact O-CB 3.24Å; C228-A232 PolarHBondContact O-N 2.94Å
229	L	93	Very high	92	Very high	59 Å²	59	61.8 Å²	61.8	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-48.6	179	-164.6	169.2	0	0	0	111.2	V195 T199 A225 F226 T231 A232 C233	V195-L229 HydrophobicContact CG1-CD1 4.48Å; V195-L229 HydrophobicContact CG1-CD2 3.88Å; V195-L229 HydrophobicContact CG1-CG 4.47Å; T199-L229 HydrophobicContact CG2-CD1 4.06Å; T199-L229 HydrophobicContact CG2-CD2 3.87Å; T199-L229 HydrophobicContact CG2-CG 4.41Å; T199-L229 WeakPolarHBondContact OG1-CD1 3.36Å; T199-L229 VanDerWaalsContact OG1-CD2 3.24Å; T199-L229 WeakPolarHBondContact OG1-CD2 3.42Å; A225-L229 WeakPolarHBondContact O-CB 3.29Å; A225-L229 PolarHBondContact O-N 3.46Å; F226-L229 PolarHBondContact O-N 3.05Å; L229-T231 VanDerWaalsContact C-N 3.31Å; L229-T231 PolarHBondContact O-N 3.31Å; L229-A232 PolarHBondContact O-N 3.48Å; L229-C233 PolarHBondContact O-N 3.3Å
230	D	92.6	Very high	92.4	Very high	9 Å²	9	61.7 Å²	61.7	5%	0.048	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-42.8	178.2	-161.7	41.4	0	0	0	110.8	F226 A232 C233 V234 R293 R296	F226-D230 WeakPolarHBondContact O-CB 3.47Å; F226-D230 PolarHBondContact O-N 2.92Å; D230-A232 PolarHBondContact O-N 2.92Å; D230-C233 PolarHBondContact O-N 3.49Å; D230-V234 WeakPolarHBondContact O-CB 3.2Å; D230-V234 VanDerWaalsContact O-CG2 3.27Å; D230-V234 WeakPolarHBondContact O-CG2 3.32Å; D230-V234 PolarHBondContact O-N 3.27Å; D230-R293 IonicContact OD2-CZ 3.65Å; D230-R293 VanDerWaalsContact OD2-CZ 3.29Å; D230-R293 IonicContact OD2-NE 3.29Å; D230-R293 PolarHBondContact OD2-NE 2.86Å; D230-R293 IonicContact OD2-NH2 3.96Å; D230-R293 PolarHBondContact OD2-NH2 3.43Å; D230-R296 IonicContact OD1-CZ 3.44Å; D230-R296 IonicContact OD1-NH1 3.22Å; D230-R296 PolarHBondContact OD1-NH1 3.14Å
231	T	93.1	Very high	92.9	Very high	33 Å²	33	57.3 Å²	57.3	20%	0.202	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-46.8	174.9	-59.9	0	0	0	0	111.5	F227 L229 C233 V234 M235 Y270	F227-T231 VanDerWaalsContact O-CB 3.24Å; F227-T231 WeakPolarHBondContact O-CB 3.47Å; F227-T231 PolarHBondContact O-N 3.28Å; F227-T231 PolarHBondContact O-OG1 2.94Å; L229-T231 VanDerWaalsContact C-N 3.31Å; L229-T231 PolarHBondContact O-N 3.31Å; T231-C233 PolarHBondContact O-N 3.4Å; T231-V234 PolarHBondContact O-N 3.47Å; T231-M235 HydrophobicContact CG2-CG 4.33Å; T231-M235 WeakPolarHBondContact O-CB 3.35Å; T231-M235 WeakPolarHBondContact O-CG 3.2Å; T231-M235 PolarHBondContact O-N 2.68Å; T231-Y270 VanDerWaalsContact CG2-OH 3.27Å; T231-Y270 WeakPolarHBondContact CG2-OH 3.42Å; T231-Y270 WeakPolarHBondContact OG1-CE2 3.22Å; T231-Y270 PolarHBondContact OG1-OH 2.74Å
232	A	94.6	Very high	93.3	Very high	46 Å²	46	54.8 Å²	54.8	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-61.5	-45.6	178.2	0	0	0	0	0	112.2	C228 L229 D230 M235 I236	C228-A232 WeakPolarHBondContact O-CB 3.24Å; C228-A232 PolarHBondContact O-N 2.94Å; L229-A232 PolarHBondContact O-N 3.48Å; D230-A232 PolarHBondContact O-N 2.92Å; A232-M235 PolarHBondContact O-N 2.71Å; A232-I236 WeakPolarHBondContact O-CG1 3.43Å; A232-I236 PolarHBondContact O-N 2.82Å; A232-I236 VanDerWaalsContact O-N 3.12Å
233	C	94.8	Very high	93.4	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.007	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-46.6	177	-77.7	0	0	0	0	112.4	L229 D230 T231 I236 F237	L229-C233 PolarHBondContact O-N 3.3Å; D230-C233 PolarHBondContact O-N 3.49Å; T231-C233 PolarHBondContact O-N 3.4Å; C233-I236 PolarHBondContact O-N 2.89Å; C233-F237 VanDerWaalsContact O-CG 3.27Å; C233-F237 WeakPolarHBondContact O-CG 3.45Å; C233-F237 PolarHBondContact O-N 3.32Å
234	V	95	Very high	93.6	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-38.9	-179.9	171.8	0	0	0	0	111.3	D230 T231 I236 F237 T238 I267 Y270 Y271	D230-V234 WeakPolarHBondContact O-CB 3.2Å; D230-V234 VanDerWaalsContact O-CG2 3.27Å; D230-V234 WeakPolarHBondContact O-CG2 3.32Å; D230-V234 PolarHBondContact O-N 3.27Å; T231-V234 PolarHBondContact O-N 3.47Å; V234-I236 PolarHBondContact O-N 2.97Å; V234-F237 PolarHBondContact O-N 3.32Å; V234-T238 WeakPolarHBondContact O-CB 3.34Å; V234-T238 PolarHBondContact O-N 2.69Å; V234-T238 PolarHBondContact O-OG1 2.64Å; V234-I267 HydrophobicContact CG1-CB 4.2Å; V234-I267 HydrophobicContact CG1-CG2 4.23Å; V234-Y270 HydrophobicContact CB-CD1 4.34Å; V234-Y270 HydrophobicContact CB-CD2 4.5Å; V234-Y270 HydrophobicContact CB-CG 4.17Å; V234-Y270 HydrophobicContact CG1-CD1 3.72Å; V234-Y270 HydrophobicContact CG1-CE1 4.4Å; V234-Y270 HydrophobicContact CG1-CG 3.87Å; V234-Y270 HydrophobicContact CG2-CD2 4.16Å; V234-Y270 HydrophobicContact CG2-CG 3.96Å; V234-Y271 HydrophobicContact CG1-CE2 3.9Å
235	M	95	Very high	93.8	Very high	102 Å²	102	44.9 Å²	44.9	50%	0.502	25%	0.251	S	S	.	.	H	α-helix	trans	-59.3	-47.1	174.5	-77	-62.4	-66.5	0	0	111.4	T231 A232 F237 T238 V239	T231-M235 HydrophobicContact CG2-CG 4.33Å; T231-M235 WeakPolarHBondContact O-CB 3.35Å; T231-M235 WeakPolarHBondContact O-CG 3.2Å; T231-M235 PolarHBondContact O-N 2.68Å; A232-M235 PolarHBondContact O-N 2.71Å; M235-F237 PolarHBondContact O-N 3.46Å; M235-T238 PolarHBondContact O-N 2.84Å; M235-V239 WeakPolarHBondContact O-CG2 3.34Å; M235-V239 PolarHBondContact O-N 2.77Å
236	I	95.2	Very high	93.8	Very high	53 Å²	53	47.3 Å²	47.3	27%	0.272	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-46.6	176.4	-68.5	168.5	0	0	0	110.7	F192 A232 C233 V234 T238 V239 E240	F192-I236 HydrophobicContact CD1-CD1 3.58Å; F192-I236 HydrophobicContact CD2-CD1 3.7Å; F192-I236 HydrophobicContact CD2-CG2 4.39Å; F192-I236 HydrophobicContact CE1-CD1 3.42Å; F192-I236 VanDerWaalsContact CE1-CD1 3.42Å; F192-I236 HydrophobicContact CE2-CD1 3.56Å; F192-I236 HydrophobicContact CG-CD1 3.72Å; F192-I236 HydrophobicContact CZ-CD1 3.42Å; F192-I236 VanDerWaalsContact CZ-CD1 3.42Å; A232-I236 WeakPolarHBondContact O-CG1 3.43Å; A232-I236 PolarHBondContact O-N 2.82Å; A232-I236 VanDerWaalsContact O-N 3.12Å; C233-I236 PolarHBondContact O-N 2.89Å; V234-I236 PolarHBondContact O-N 2.97Å; I236-T238 VanDerWaalsContact C-N 3.3Å; I236-T238 PolarHBondContact O-N 2.95Å; I236-V239 PolarHBondContact O-N 3.07Å; I236-E240 WeakPolarHBondContact O-CB 3.26Å; I236-E240 PolarHBondContact O-N 3.31Å
237	F	95.5	Very high	93.8	Very high	2 Å²	2	46 Å²	46	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-34.4	178.9	-65.7	-15.6	0	0	0	113.3	F192 I193 C233 V234 M235 Y241 I267 K299	F192-F237 HydrophobicContact CB-CE1 4.14Å; I193-F237 HydrophobicContact CB-CZ 4.42Å; I193-F237 HydrophobicContact CG1-CE1 3.75Å; I193-F237 HydrophobicContact CG1-CZ 3.79Å; C233-F237 VanDerWaalsContact O-CG 3.27Å; C233-F237 WeakPolarHBondContact O-CG 3.45Å; C233-F237 PolarHBondContact O-N 3.32Å; V234-F237 PolarHBondContact O-N 3.32Å; M235-F237 PolarHBondContact O-N 3.46Å; F237-Y241 WeakPolarHBondContact O-CB 3.43Å; F237-Y241 PolarHBondContact O-N 3.24Å; F237-I267 HydrophobicContact CB-CG2 3.54Å; F237-I267 HydrophobicContact CD2-CG2 4.41Å; F237-K299 VanDerWaalsContact CB-NZ 3.35Å; F237-K299 HydrophobicContact CD1-CD 4.31Å; F237-K299 HydrophobicContact CE1-CD 4.43Å; F237-K299 HydrophobicContact CG-CD 4.4Å; F237-K299 VanDerWaalsContact CG-NZ 3.27Å
238	T	95.9	Very high	93.8	Very high	20 Å²	20	40.1 Å²	40.1	12%	0.123	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-49	176.4	-55.7	0	0	0	0	110.2	V234 M235 I236 E240 Y241 L242 Y271	V234-T238 WeakPolarHBondContact O-CB 3.34Å; V234-T238 PolarHBondContact O-N 2.69Å; V234-T238 PolarHBondContact O-OG1 2.64Å; M235-T238 PolarHBondContact O-N 2.84Å; I236-T238 VanDerWaalsContact C-N 3.3Å; I236-T238 PolarHBondContact O-N 2.95Å; T238-E240 VanDerWaalsContact C-N 3.31Å; T238-E240 PolarHBondContact O-N 3.03Å; T238-Y241 PolarHBondContact O-N 3.28Å; T238-L242 HydrophobicContact CG2-CD1 4.08Å; T238-L242 HydrophobicContact CG2-CG 4.4Å; T238-L242 VanDerWaalsContact O-CG 3.3Å; T238-L242 WeakPolarHBondContact O-CG 3.46Å; T238-L242 PolarHBondContact O-N 2.95Å; T238-Y271 WeakPolarHBondContact CB-OH 3.48Å; T238-Y271 VanDerWaalsContact CG2-OH 3.26Å; T238-Y271 WeakPolarHBondContact CG2-OH 3.36Å; T238-Y271 PolarHBondContact OG1-OH 2.75Å
239	V	95.3	Very high	93.4	Very high	75 Å²	75	40.4 Å²	40.4	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-59	-45.6	176.6	170.6	0	0	0	0	110.5	M235 I236 Y241 L242 L243	M235-V239 WeakPolarHBondContact O-CG2 3.34Å; M235-V239 PolarHBondContact O-N 2.77Å; I236-V239 PolarHBondContact O-N 3.07Å; V239-Y241 PolarHBondContact O-N 3.34Å; V239-L242 PolarHBondContact O-N 2.85Å; V239-L243 HydrophobicContact CG1-CD1 3.81Å; V239-L243 HydrophobicContact CG1-CG 4.23Å; V239-L243 WeakPolarHBondContact O-CB 3.23Å; V239-L243 VanDerWaalsContact O-CG 3.24Å; V239-L243 WeakPolarHBondContact O-CG 3.33Å; V239-L243 PolarHBondContact O-N 3.01Å
240	E	94.5	Very high	93.3	Very high	9 Å²	9	39.7 Å²	39.7	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-45.5	176.3	-170.8	-163.1	162.3	0	0	112	T189 I236 T238 R244 K299	T189-E240 VanDerWaalsContact CG2-CD 3.44Å; T189-E240 HydrophobicContact CG2-CG 3.94Å; I236-E240 WeakPolarHBondContact O-CB 3.26Å; I236-E240 PolarHBondContact O-N 3.31Å; T238-E240 VanDerWaalsContact C-N 3.31Å; T238-E240 PolarHBondContact O-N 3.03Å; E240-R244 VanDerWaalsContact CG-NH1 3.26Å; E240-R244 WeakPolarHBondContact O-CG 3.5Å; E240-R244 PolarHBondContact O-N 2.82Å; E240-R244 VanDerWaalsContact O-N 3.1Å; E240-R244 IonicContact OE1-CZ 3.62Å; E240-R244 IonicContact OE1-NH1 2.84Å; E240-R244 PolarHBondContact OE1-NH1 3.03Å; E240-R244 IonicContact OE1-NH2 3.95Å; E240-R244 PolarHBondContact OE1-NH2 3.27Å; E240-K299 IonicContact OE1-NZ 2.63Å; E240-K299 VanDerWaalsContact OE2-CE 3.26Å; E240-K299 WeakPolarHBondContact OE2-CE 3.29Å; E240-K299 IonicContact OE2-NZ 3.27Å; E240-K299 PolarHBondContact OE2-NZ 3.12Å
241	Y	94.9	Very high	93.3	Very high	24 Å²	24	46.2 Å²	46.2	9%	0.094	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-46.3	176.5	178.9	-104.1	0	0	0	112.3	F237 T238 V239 R244 L245 F254 S260 D263 V264	F237-Y241 WeakPolarHBondContact O-CB 3.43Å; F237-Y241 PolarHBondContact O-N 3.24Å; T238-Y241 PolarHBondContact O-N 3.28Å; V239-Y241 PolarHBondContact O-N 3.34Å; Y241-R244 PolarHBondContact O-N 3.42Å; Y241-L245 HydrophobicContact CE1-CD2 4.31Å; Y241-L245 WeakPolarHBondContact O-CB 3.3Å; Y241-L245 PolarHBondContact O-N 3.23Å; Y241-F254 HydrophobicContact CD2-CE1 4.37Å; Y241-F254 AromaticContact CE2-CE1 3.83Å; Y241-F254 HydrophobicContact CE2-CE1 3.83Å; Y241-F254 HydrophobicContact CE2-CZ 4.48Å; Y241-S260 WeakPolarHBondContact CE2-OG 3.36Å; Y241-S260 PolarHBondContact OH-OG 3.09Å; Y241-D263 HydrophobicContact CD2-CB 3.67Å; Y241-D263 HydrophobicContact CE2-CB 4.24Å; Y241-V264 HydrophobicContact CD2-CG2 4.38Å; Y241-V264 HydrophobicContact CE1-CG2 4Å; Y241-V264 HydrophobicContact CE2-CG2 3.65Å; Y241-V264 VanDerWaalsContact CZ-CG2 3.43Å; Y241-V264 WeakPolarHBondContact OH-CG2 3.36Å
242	L	94.9	Very high	93.2	Very high	97 Å²	97	51.8 Å²	51.8	51%	0.508	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-42	179.2	-69.1	175.9	0	0	0	112	T238 V239 R244 L245 F246	T238-L242 HydrophobicContact CG2-CD1 4.08Å; T238-L242 HydrophobicContact CG2-CG 4.4Å; T238-L242 VanDerWaalsContact O-CG 3.3Å; T238-L242 WeakPolarHBondContact O-CG 3.46Å; T238-L242 PolarHBondContact O-N 2.95Å; V239-L242 PolarHBondContact O-N 2.85Å; L242-R244 VanDerWaalsContact C-N 3.32Å; L242-R244 PolarHBondContact O-N 3.18Å; L242-L245 PolarHBondContact O-N 3.2Å; L242-F246 WeakPolarHBondContact O-CB 3.48Å; L242-F246 PolarHBondContact O-N 2.88Å
243	L	92.7	Very high	93	Very high	65 Å²	65	59 Å²	59	34%	0.34	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-40.9	175.4	-72.7	173.7	0	0	0	111.4	F173 V239 F246 A247	F173-L243 HydrophobicContact CE2-CB 3.94Å; F173-L243 HydrophobicContact CZ-CB 3.79Å; F173-L243 HydrophobicContact CZ-CD1 4.34Å; V239-L243 HydrophobicContact CG1-CD1 3.81Å; V239-L243 HydrophobicContact CG1-CG 4.23Å; V239-L243 WeakPolarHBondContact O-CB 3.23Å; V239-L243 VanDerWaalsContact O-CG 3.24Å; V239-L243 WeakPolarHBondContact O-CG 3.33Å; V239-L243 PolarHBondContact O-N 3.01Å; L243-F246 PolarHBondContact O-N 3.07Å; L243-A247 WeakPolarHBondContact O-CB 3.4Å; L243-A247 PolarHBondContact O-N 3.39Å
244	R	92.3	Very high	92.9	Very high	11 Å²	11	59.6 Å²	59.6	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-67.9	-42.3	174.8	-72.6	-167.5	-173	105.5	11.8	112.8	F173 E240 Y241 L242 F246 A247 A248 F254 D263	F173-R244 HydrophobicContact CB-CG 4.16Å; F173-R244 HydrophobicContact CD1-CG 4.18Å; F173-R244 HydrophobicContact CD2-CG 3.83Å; F173-R244 HydrophobicContact CE2-CG 4.22Å; F173-R244 HydrophobicContact CG-CG 3.81Å; E240-R244 VanDerWaalsContact CG-NH1 3.26Å; E240-R244 WeakPolarHBondContact O-CG 3.5Å; E240-R244 PolarHBondContact O-N 2.82Å; E240-R244 VanDerWaalsContact O-N 3.1Å; E240-R244 IonicContact OE1-CZ 3.62Å; E240-R244 IonicContact OE1-NH1 2.84Å; E240-R244 PolarHBondContact OE1-NH1 3.03Å; E240-R244 IonicContact OE1-NH2 3.95Å; E240-R244 PolarHBondContact OE1-NH2 3.27Å; Y241-R244 PolarHBondContact O-N 3.42Å; L242-R244 VanDerWaalsContact C-N 3.32Å; L242-R244 PolarHBondContact O-N 3.18Å; R244-F246 VanDerWaalsContact C-N 3.27Å; R244-F246 PolarHBondContact O-N 3.24Å; R244-A247 PolarHBondContact O-N 3.5Å; R244-A248 WeakPolarHBondContact O-CB 3.43Å; R244-A248 PolarHBondContact O-N 3.47Å; R244-F254 HydrophobicContact CB-CE1 4.33Å; R244-F254 HydrophobicContact CB-CE2 4.3Å; R244-F254 HydrophobicContact CB-CZ 3.69Å; R244-D263 IonicContact NH1-OD2 3.28Å
245	L	93.9	Very high	92.8	Very high	35 Å²	35	63.1 Å²	63.1	18%	0.183	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-37.4	176.8	-179	63.2	0	0	0	111.5	Y241 L242 R251 F254 I255	Y241-L245 HydrophobicContact CE1-CD2 4.31Å; Y241-L245 WeakPolarHBondContact O-CB 3.3Å; Y241-L245 PolarHBondContact O-N 3.23Å; L242-L245 PolarHBondContact O-N 3.2Å; L245-R251 HydrophobicContact CD1-CB 4Å; L245-R251 HydrophobicContact CD1-CG 4.34Å; L245-F254 HydrophobicContact CB-CD1 4.33Å; L245-F254 HydrophobicContact CB-CE1 4.19Å; L245-F254 HydrophobicContact CD1-CD1 3.72Å; L245-F254 HydrophobicContact CD1-CE1 4.34Å; L245-I255 HydrophobicContact CD1-CD1 3.92Å; L245-I255 HydrophobicContact CD1-CG1 3.71Å
246	F	92.4	Very high	92.7	Very high	112 Å²	112	66.7 Å²	66.7	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-70	-41.8	174.6	178	-90.9	0	0	0	112.4	R166 M169 L242 L243 R244 A248	R166-F246 WeakPolarHBondContact CD-O 3.37Å; M169-F246 HydrophobicContact CE-CD1 3.51Å; M169-F246 HydrophobicContact CE-CE1 4.1Å; L242-F246 WeakPolarHBondContact O-CB 3.48Å; L242-F246 PolarHBondContact O-N 2.88Å; L243-F246 PolarHBondContact O-N 3.07Å; R244-F246 VanDerWaalsContact C-N 3.27Å; R244-F246 PolarHBondContact O-N 3.24Å; F246-A248 VanDerWaalsContact C-N 3.29Å; F246-A248 PolarHBondContact O-N 2.97Å
247	A	90.6	Very high	92.5	Very high	2 Å²	2	66 Å²	66	2%	0.017	31%	0.309	C	S	.	.	H	α-helix	trans	-66.6	-29.1	176.9	0	0	0	0	0	113.2	M169 W170 F173 L243 R244	M169-A247 HydrophobicContact CB-CB 4.35Å; M169-A247 HydrophobicContact CE-CB 3.73Å; M169-A247 HydrophobicContact CG-CB 4.2Å; W170-A247 HydrophobicContact CB-CB 4.07Å; W170-A247 HydrophobicContact CE3-CB 4.06Å; F173-A247 HydrophobicContact CD2-CB 4.22Å; F173-A247 HydrophobicContact CE2-CB 4.48Å; L243-A247 WeakPolarHBondContact O-CB 3.4Å; L243-A247 PolarHBondContact O-N 3.39Å; R244-A247 PolarHBondContact O-N 3.5Å
248	A	89.5	Confident	92.2	Very high	2 Å²	2	70.8 Å²	70.8	2%	0.017	34%	0.338	C	S	.	.			trans	-58.6	133.8	-172.4	0	0	0	0	0	112.9	W170 R244 F246 S250 F254	W170-A248 HydrophobicContact CE3-CB 4.13Å; W170-A248 HydrophobicContact CH2-CB 4.33Å; W170-A248 HydrophobicContact CZ3-CB 3.77Å; R244-A248 WeakPolarHBondContact O-CB 3.43Å; R244-A248 PolarHBondContact O-N 3.47Å; F246-A248 VanDerWaalsContact C-N 3.29Å; F246-A248 PolarHBondContact O-N 2.97Å; A248-S250 VanDerWaalsContact C-N 3.31Å; A248-S250 PolarHBondContact O-N 3.05Å; A248-F254 HydrophobicContact CB-CB 3.76Å; A248-F254 HydrophobicContact CB-CD1 4.49Å; A248-F254 HydrophobicContact CB-CD2 4.24Å; A248-F254 HydrophobicContact CB-CG 3.91Å
249	P	86.6	Confident	91.9	Very high	88 Å²	88	71.9 Å²	71.9	57%	0.571	34%	0.342	S	S	*	.	S	Bend	trans	-65.4	-34.1	178.9	24	-32.2	0	0	0	112.4
250	S	90.4	Very high	91.8	Very high	44 Å²	44	68.3 Å²	68.3	31%	0.308	32%	0.32	S	S	.	.	S	Bend	trans	-133.3	106.9	173	51.3	0	0	0	0	110.6	A248 Y252 R253 F254	A248-S250 VanDerWaalsContact C-N 3.31Å; A248-S250 PolarHBondContact O-N 3.05Å; S250-Y252 PolarHBondContact O-N 3.23Å; S250-R253 PolarHBondContact O-N 3.3Å; S250-R253 VanDerWaalsContact OG-CB 3.27Å; S250-R253 WeakPolarHBondContact OG-CB 3.36Å; S250-F254 PolarHBondContact O-N 3.17Å
251	R	92	Very high	91.8	Very high	146 Å²	146	72 Å²	72	55%	0.551	34%	0.339	S	S	*	.	H	α-helix	trans	-60.1	-42.9	-174.3	-60.7	176.4	-174	166.4	0.6	112.6	L245 F254 I255	L245-R251 HydrophobicContact CD1-CB 4Å; L245-R251 HydrophobicContact CD1-CG 4.34Å; R251-F254 WeakPolarHBondContact O-CB 3.46Å; R251-F254 PolarHBondContact O-N 3.42Å; R251-I255 VanDerWaalsContact O-CG1 3.3Å; R251-I255 WeakPolarHBondContact O-CG1 3.32Å; R251-I255 PolarHBondContact O-N 2.86Å
252	Y	91.9	Very high	91.7	Very high	150 Å²	150	72.5 Å²	72.5	59%	0.588	34%	0.343	S	S	*	.	H	α-helix	trans	-65.4	-42.5	-179.2	-172.7	-103.5	0	0	0	112.6	S250 F254 I255 R256	S250-Y252 PolarHBondContact O-N 3.23Å; Y252-F254 VanDerWaalsContact C-N 3.31Å; Y252-F254 PolarHBondContact O-N 3.39Å; Y252-I255 PolarHBondContact O-N 3.29Å; Y252-R256 PolarHBondContact O-N 2.92Å; Y252-R256 VanDerWaalsContact O-N 3.12Å; Y252-R256 PolarHBondContact OH-NH1 3.25Å; Y252-R256 VanDerWaalsContact OH-NH1 3.15Å; Y252-R256 PolarHBondContact OH-NH2 2.87Å
253	R	90.4	Very high	91.7	Very high	196 Å²	196	67.9 Å²	67.9	74%	0.74	32%	0.319	S	S	*	.	H	α-helix	trans	-64.7	-39.2	175.3	-171.1	-179.7	-68.9	166.6	-0.7	111	S250 R256 S257	S250-R253 PolarHBondContact O-N 3.3Å; S250-R253 VanDerWaalsContact OG-CB 3.27Å; S250-R253 WeakPolarHBondContact OG-CB 3.36Å; R253-R256 PolarHBondContact O-N 3.45Å; R253-S257 PolarHBondContact O-N 2.94Å
254	F	91.4	Very high	91.8	Very high	14 Å²	14	67.6 Å²	67.6	6%	0.061	32%	0.32	C	S	.	.	H	α-helix	trans	-62.2	-50.4	175.3	179	-100.2	0	0	0	111.5	W170 Y241 R244 L245 A248 S250 R251 Y252 R256 S257 S260	W170-F254 AromaticContact CH2-CD2 3.73Å; W170-F254 HydrophobicContact CH2-CD2 3.73Å; W170-F254 HydrophobicContact CH2-CE2 4.02Å; W170-F254 AromaticContact CZ3-CD2 3.92Å; W170-F254 HydrophobicContact CZ3-CD2 3.92Å; W170-F254 AromaticContact CZ3-CE2 3.99Å; W170-F254 HydrophobicContact CZ3-CE2 3.99Å; Y241-F254 HydrophobicContact CD2-CE1 4.37Å; Y241-F254 AromaticContact CE2-CE1 3.83Å; Y241-F254 HydrophobicContact CE2-CE1 3.83Å; Y241-F254 HydrophobicContact CE2-CZ 4.48Å; R244-F254 HydrophobicContact CB-CE1 4.33Å; R244-F254 HydrophobicContact CB-CE2 4.3Å; R244-F254 HydrophobicContact CB-CZ 3.69Å; L245-F254 HydrophobicContact CB-CD1 4.33Å; L245-F254 HydrophobicContact CB-CE1 4.19Å; L245-F254 HydrophobicContact CD1-CD1 3.72Å; L245-F254 HydrophobicContact CD1-CE1 4.34Å; A248-F254 HydrophobicContact CB-CB 3.76Å; A248-F254 HydrophobicContact CB-CD1 4.49Å; A248-F254 HydrophobicContact CB-CD2 4.24Å; A248-F254 HydrophobicContact CB-CG 3.91Å; S250-F254 PolarHBondContact O-N 3.17Å; R251-F254 WeakPolarHBondContact O-CB 3.46Å; R251-F254 PolarHBondContact O-N 3.42Å; Y252-F254 VanDerWaalsContact C-N 3.31Å; Y252-F254 PolarHBondContact O-N 3.39Å; F254-R256 VanDerWaalsContact C-N 3.26Å; F254-R256 PolarHBondContact O-N 3.34Å; F254-S257 VanDerWaalsContact O-CB 3.27Å; F254-S257 WeakPolarHBondContact O-CB 3.39Å; F254-S257 PolarHBondContact O-N 2.92Å; F254-S257 PolarHBondContact O-OG 3.32Å; F254-S260 WeakPolarHBondContact O-CB 3.37Å; F254-S260 PolarHBondContact O-OG 3.16Å
255	I	93.8	Very high	91.8	Very high	79 Å²	79	69 Å²	69	41%	0.405	33%	0.33	S	S	.	.	H	α-helix	trans	-57.2	-39.2	179.3	-69	166.5	0	0	0	111.7	L245 R251 Y252 S257	L245-I255 HydrophobicContact CD1-CD1 3.92Å; L245-I255 HydrophobicContact CD1-CG1 3.71Å; R251-I255 VanDerWaalsContact O-CG1 3.3Å; R251-I255 WeakPolarHBondContact O-CG1 3.32Å; R251-I255 PolarHBondContact O-N 2.86Å; Y252-I255 PolarHBondContact O-N 3.29Å; I255-S257 VanDerWaalsContact C-N 3.27Å; I255-S257 PolarHBondContact O-N 2.93Å
256	R	92.9	Very high	91.8	Very high	176 Å²	176	67.7 Å²	67.7	66%	0.664	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-6.2	176.8	-97.2	-175.9	168.4	168.4	0.3	115	Y252 R253 F254	Y252-R256 PolarHBondContact O-N 2.92Å; Y252-R256 VanDerWaalsContact O-N 3.12Å; Y252-R256 PolarHBondContact OH-NH1 3.25Å; Y252-R256 VanDerWaalsContact OH-NH1 3.15Å; Y252-R256 PolarHBondContact OH-NH2 2.87Å; R253-R256 PolarHBondContact O-N 3.45Å; F254-R256 VanDerWaalsContact C-N 3.26Å; F254-R256 PolarHBondContact O-N 3.34Å
257	S	90.1	Very high	91.8	Very high	39 Å²	39	63 Å²	63	27%	0.273	30%	0.304	S	S	.	.	S	Bend	trans	-75.6	141.8	-180	74	0	0	0	0	111.6	R253 F254 I255 M259 S260 I261	R253-S257 PolarHBondContact O-N 2.94Å; F254-S257 VanDerWaalsContact O-CB 3.27Å; F254-S257 WeakPolarHBondContact O-CB 3.39Å; F254-S257 PolarHBondContact O-N 2.92Å; F254-S257 PolarHBondContact O-OG 3.32Å; I255-S257 VanDerWaalsContact C-N 3.27Å; I255-S257 PolarHBondContact O-N 2.93Å; S257-M259 PolarHBondContact O-N 3Å; S257-S260 WeakPolarHBondContact O-CB 3.46Å; S257-S260 PolarHBondContact O-N 3.41Å; S257-S260 WeakPolarHBondContact OG-CB 3.47Å; S257-S260 PolarHBondContact OG-N 3.35Å; S257-I261 WeakPolarHBondContact O-CG1 3.37Å; S257-I261 PolarHBondContact O-N 2.89Å
258	V	90.6	Very high	91.9	Very high	102 Å²	102	66.9 Å²	66.9	62%	0.618	32%	0.322	S	S	*	.	H	α-helix	trans	-55	-41.5	-179	178.1	0	0	0	0	111.8	S260 I261 I262	V258-S260 PolarHBondContact O-N 2.75Å; V258-I261 PolarHBondContact O-N 2.91Å; V258-I262 HydrophobicContact CG1-CD1 4.23Å; V258-I262 WeakPolarHBondContact O-CG1 3.36Å; V258-I262 PolarHBondContact O-N 3.41Å
259	M	88.9	Confident	91.9	Very high	44 Å²	44	67.2 Å²	67.2	22%	0.217	32%	0.324	C	S	.	.	H	α-helix	trans	-67.1	-36.2	-179.9	-57.4	-64.4	157.6	0	0	112.2	S257 I262 D263 R302 R308	S257-M259 PolarHBondContact O-N 3Å; M259-I262 HydrophobicContact SD-CD1 4.43Å; M259-D263 PolarHBondContact O-N 2.81Å; M259-R302 VanDerWaalsContact CB-NH2 3.33Å; M259-R308 HydrophobicContact CE-CG 4.17Å
260	S	93.6	Very high	92	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-69	-37.6	173.2	171.6	0	0	0	0	111.9	Y241 F254 S257 V258 I262 D263 V264	Y241-S260 WeakPolarHBondContact CE2-OG 3.36Å; Y241-S260 PolarHBondContact OH-OG 3.09Å; F254-S260 WeakPolarHBondContact O-CB 3.37Å; F254-S260 PolarHBondContact O-OG 3.16Å; S257-S260 WeakPolarHBondContact O-CB 3.46Å; S257-S260 PolarHBondContact O-N 3.41Å; S257-S260 WeakPolarHBondContact OG-CB 3.47Å; S257-S260 PolarHBondContact OG-N 3.35Å; V258-S260 PolarHBondContact O-N 2.75Å; S260-I262 VanDerWaalsContact C-N 3.32Å; S260-I262 PolarHBondContact O-N 3.42Å; S260-D263 WeakPolarHBondContact O-CB 3.36Å; S260-D263 PolarHBondContact O-N 3.31Å; S260-V264 WeakPolarHBondContact O-CG2 3.43Å; S260-V264 PolarHBondContact O-N 3.31Å
261	I	94	Very high	92.1	Very high	85 Å²	85	66.4 Å²	66.4	44%	0.436	30%	0.304	S	S	.	.	H	α-helix	trans	-62.5	-43	176.9	-66.2	167.1	0	0	0	110.1	S257 V258 D263 V264 V265	S257-I261 WeakPolarHBondContact O-CG1 3.37Å; S257-I261 PolarHBondContact O-N 2.89Å; V258-I261 PolarHBondContact O-N 2.91Å; I261-D263 VanDerWaalsContact C-N 3.31Å; I261-D263 PolarHBondContact O-N 3.12Å; I261-V264 PolarHBondContact O-N 2.94Å; I261-V265 HydrophobicContact CG2-CG2 4.15Å; I261-V265 WeakPolarHBondContact O-CG2 3.29Å; I261-V265 PolarHBondContact O-N 3.43Å
262	I	93.3	Very high	91.8	Very high	35 Å²	35	61.6 Å²	61.6	18%	0.179	29%	0.289	C	S	.	.	H	α-helix	trans	-58.5	-43.9	174.7	-67.4	166.7	0	0	0	110.9	V258 M259 S260 V264 V265 A266 F298	V258-I262 HydrophobicContact CG1-CD1 4.23Å; V258-I262 WeakPolarHBondContact O-CG1 3.36Å; V258-I262 PolarHBondContact O-N 3.41Å; M259-I262 HydrophobicContact SD-CD1 4.43Å; S260-I262 VanDerWaalsContact C-N 3.32Å; S260-I262 PolarHBondContact O-N 3.42Å; I262-V264 VanDerWaalsContact C-N 3.3Å; I262-V264 PolarHBondContact O-N 2.92Å; I262-V265 PolarHBondContact O-N 3.17Å; I262-A266 WeakPolarHBondContact O-CB 3.41Å; I262-A266 PolarHBondContact O-N 3.06Å; I262-F298 HydrophobicContact CD1-CB 4.48Å; I262-F298 HydrophobicContact CG2-CB 3.79Å
263	D	94	Very high	91.4	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-38.2	177.8	-71.1	-36.8	0	0	0	111.9	Y241 R244 M259 S260 I261 K299 R302	Y241-D263 HydrophobicContact CD2-CB 3.67Å; Y241-D263 HydrophobicContact CE2-CB 4.24Å; R244-D263 IonicContact NH1-OD2 3.28Å; M259-D263 PolarHBondContact O-N 2.81Å; S260-D263 WeakPolarHBondContact O-CB 3.36Å; S260-D263 PolarHBondContact O-N 3.31Å; I261-D263 VanDerWaalsContact C-N 3.31Å; I261-D263 PolarHBondContact O-N 3.12Å; D263-K299 WeakPolarHBondContact OD1-CE 3.2Å; D263-R302 IonicContact OD2-CZ 2.91Å; D263-R302 IonicContact OD2-NE 3.77Å; D263-R302 IonicContact OD2-NH2 3.99Å; D263-R302 PolarHBondContact OD2-NH2 3.35Å
264	V	94.8	Very high	91	Very high	58 Å²	58	50.7 Å²	50.7	35%	0.352	26%	0.259	S	S	.	.	H	α-helix	trans	-72.4	-47.1	176.9	173.8	0	0	0	0	112	Y241 S260 I261 I262 A266 I267 M268	Y241-V264 HydrophobicContact CD2-CG2 4.38Å; Y241-V264 HydrophobicContact CE1-CG2 4Å; Y241-V264 HydrophobicContact CE2-CG2 3.65Å; Y241-V264 VanDerWaalsContact CZ-CG2 3.43Å; Y241-V264 WeakPolarHBondContact OH-CG2 3.36Å; S260-V264 WeakPolarHBondContact O-CG2 3.43Å; S260-V264 PolarHBondContact O-N 3.31Å; I261-V264 PolarHBondContact O-N 2.94Å; I262-V264 VanDerWaalsContact C-N 3.3Å; I262-V264 PolarHBondContact O-N 2.92Å; V264-A266 PolarHBondContact O-N 3.32Å; V264-I267 VanDerWaalsContact O-CG1 3.23Å; V264-I267 WeakPolarHBondContact O-CG1 3.5Å; V264-I267 PolarHBondContact O-N 3.13Å; V264-I267 VanDerWaalsContact O-N 3.12Å; V264-M268 WeakPolarHBondContact O-CB 3.41Å; V264-M268 PolarHBondContact O-N 2.84Å
265	V	93	Very high	90.6	Very high	41 Å²	41	55.6 Å²	55.6	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-30.3	179	173.2	0	0	0	0	111	I261 I262 I267 P269 F295	I261-V265 HydrophobicContact CG2-CG2 4.15Å; I261-V265 WeakPolarHBondContact O-CG2 3.29Å; I261-V265 PolarHBondContact O-N 3.43Å; I262-V265 PolarHBondContact O-N 3.17Å; V265-I267 VanDerWaalsContact C-N 3.33Å; V265-I267 PolarHBondContact O-N 3.29Å; V265-P269 VanDerWaalsContact O-CD 3.22Å; V265-P269 WeakPolarHBondContact O-CD 3.44Å; V265-F295 HydrophobicContact CG1-CB 3.63Å; V265-F295 HydrophobicContact CG1-CD2 4.04Å; V265-F295 HydrophobicContact CG1-CG 3.85Å
266	A	92.6	Very high	89.7	Confident	7 Å²	7	55.4 Å²	55.4	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-67.6	-27.5	177.1	0	0	0	0	0	114.3	I262 V264 R296	I262-A266 WeakPolarHBondContact O-CB 3.41Å; I262-A266 PolarHBondContact O-N 3.06Å; V264-A266 PolarHBondContact O-N 3.32Å; A266-R296 HydrophobicContact CB-CB 4Å
267	I	93.7	Very high	88.5	Confident	15 Å²	15	51.2 Å²	51.2	8%	0.077	28%	0.282	C	S	.	.	H	α-helix	trans	-102.9	-22.5	-179.9	61.9	174.6	0	0	0	113.1	V234 F237 V264 V265 P269 Y270 Y271	V234-I267 HydrophobicContact CG1-CB 4.2Å; V234-I267 HydrophobicContact CG1-CG2 4.23Å; F237-I267 HydrophobicContact CB-CG2 3.54Å; F237-I267 HydrophobicContact CD2-CG2 4.41Å; V264-I267 VanDerWaalsContact O-CG1 3.23Å; V264-I267 WeakPolarHBondContact O-CG1 3.5Å; V264-I267 PolarHBondContact O-N 3.13Å; V264-I267 VanDerWaalsContact O-N 3.12Å; V265-I267 VanDerWaalsContact C-N 3.33Å; V265-I267 PolarHBondContact O-N 3.29Å; I267-P269 VanDerWaalsContact C-CD 3.44Å; I267-Y270 PolarHBondContact O-N 3.29Å; I267-Y271 HydrophobicContact CB-CD2 4.29Å; I267-Y271 HydrophobicContact CB-CE2 4.05Å; I267-Y271 HydrophobicContact CD1-CE2 4.07Å; I267-Y271 HydrophobicContact CG1-CD2 4.42Å; I267-Y271 HydrophobicContact CG1-CE2 4.28Å; I267-Y271 WeakPolarHBondContact O-CD2 3.3Å
268	M	91.4	Very high	87.1	Confident	82 Å²	82	56.2 Å²	56.2	40%	0.404	31%	0.306	S	S	.	.	H	α-helix	trans	-50.5	-45.4	-177.4	172.2	-162.4	172.2	0	0	114.2	V264 Y270 Y271 I272	V264-M268 WeakPolarHBondContact O-CB 3.41Å; V264-M268 PolarHBondContact O-N 2.84Å; M268-Y270 PolarHBondContact O-N 2.83Å; M268-Y271 PolarHBondContact O-N 3.35Å; M268-I272 HydrophobicContact CE-CD1 3.15Å; M268-I272 HydrophobicContact CG-CD1 3.41Å; M268-I272 VanDerWaalsContact CG-CD1 3.41Å; M268-I272 HydrophobicContact CG-CG1 4.09Å; M268-I272 WeakPolarHBondContact O-CG1 3.14Å; M268-I272 PolarHBondContact O-N 2.88Å; M268-I272 HydrophobicContact SD-CD1 4.07Å
269	P	90.1	Very high	86.1	Confident	9 Å²	9	56.3 Å²	56.3	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-35.3	-175.9	-26.4	36.2	0	0	0	113.4	V265 I267 G273 F292 R293	V265-P269 VanDerWaalsContact O-CD 3.22Å; V265-P269 WeakPolarHBondContact O-CD 3.44Å; I267-P269 VanDerWaalsContact C-CD 3.44Å; P269-G273 PolarHBondContact O-N 3.34Å; P269-F292 HydrophobicContact CB-CB 4.35Å; P269-F292 HydrophobicContact CG-CB 3.57Å; P269-R293 HydrophobicContact CB-CG 4.05Å; P269-R293 HydrophobicContact CG-CG 4.49Å
270	Y	90.1	Very high	85	Confident	34 Å²	34	62.9 Å²	62.9	13%	0.133	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-48.2	179.1	179.8	-89.5	0	0	0	111.7	F227 T231 V234 I267 M268 I272 G273 L274	F227-Y270 HydrophobicContact CE2-CE2 4.42Å; T231-Y270 VanDerWaalsContact CG2-OH 3.27Å; T231-Y270 WeakPolarHBondContact CG2-OH 3.42Å; T231-Y270 WeakPolarHBondContact OG1-CE2 3.22Å; T231-Y270 PolarHBondContact OG1-OH 2.74Å; V234-Y270 HydrophobicContact CB-CD1 4.34Å; V234-Y270 HydrophobicContact CB-CD2 4.5Å; V234-Y270 HydrophobicContact CB-CG 4.17Å; V234-Y270 HydrophobicContact CG1-CD1 3.72Å; V234-Y270 HydrophobicContact CG1-CE1 4.4Å; V234-Y270 HydrophobicContact CG1-CG 3.87Å; V234-Y270 HydrophobicContact CG2-CD2 4.16Å; V234-Y270 HydrophobicContact CG2-CG 3.96Å; I267-Y270 PolarHBondContact O-N 3.29Å; M268-Y270 PolarHBondContact O-N 2.83Å; Y270-I272 PolarHBondContact O-N 3.33Å; Y270-G273 CarbonylContact O-C 3.49Å; Y270-G273 WeakPolarHBondContact O-CA 3.47Å; Y270-G273 PolarHBondContact O-N 2.95Å; Y270-L274 PolarHBondContact O-N 3.37Å
271	Y	90.6	Very high	83.6	Confident	82 Å²	82	71 Å²	71	32%	0.322	38%	0.376	S	S	.	.	H	α-helix	trans	-67.4	-37.2	-179.2	-71.7	-71.8	0	0	0	112.7	V234 T238 I267 M268 G273 L274 V275	V234-Y271 HydrophobicContact CG1-CE2 3.9Å; T238-Y271 WeakPolarHBondContact CB-OH 3.48Å; T238-Y271 VanDerWaalsContact CG2-OH 3.26Å; T238-Y271 WeakPolarHBondContact CG2-OH 3.36Å; T238-Y271 PolarHBondContact OG1-OH 2.75Å; I267-Y271 HydrophobicContact CB-CD2 4.29Å; I267-Y271 HydrophobicContact CB-CE2 4.05Å; I267-Y271 HydrophobicContact CD1-CE2 4.07Å; I267-Y271 HydrophobicContact CG1-CD2 4.42Å; I267-Y271 HydrophobicContact CG1-CE2 4.28Å; I267-Y271 WeakPolarHBondContact O-CD2 3.3Å; M268-Y271 PolarHBondContact O-N 3.35Å; Y271-G273 VanDerWaalsContact C-N 3.33Å; Y271-L274 PolarHBondContact O-N 3.42Å; Y271-V275 WeakPolarHBondContact O-CG2 3.27Å; Y271-V275 PolarHBondContact O-N 3.43Å
272	I	87.6	Confident	82.2	Confident	45 Å²	45	68.8 Å²	68.8	23%	0.231	37%	0.367	C	S	.	.	H	α-helix	trans	-65.9	-41.5	173.3	-63.6	176.9	0	0	0	110.3	M268 Y270 L274 V275 M276 L289	M268-I272 HydrophobicContact CE-CD1 3.15Å; M268-I272 HydrophobicContact CG-CD1 3.41Å; M268-I272 VanDerWaalsContact CG-CD1 3.41Å; M268-I272 HydrophobicContact CG-CG1 4.09Å; M268-I272 WeakPolarHBondContact O-CG1 3.14Å; M268-I272 PolarHBondContact O-N 2.88Å; M268-I272 HydrophobicContact SD-CD1 4.07Å; Y270-I272 PolarHBondContact O-N 3.33Å; I272-L274 VanDerWaalsContact C-N 3.28Å; I272-L274 PolarHBondContact O-N 3.19Å; I272-V275 PolarHBondContact O-N 3.39Å; I272-M276 HydrophobicContact CG2-CG 4.3Å; I272-M276 HydrophobicContact CG2-SD 4.14Å; I272-M276 WeakPolarHBondContact O-CB 3.45Å; I272-M276 PolarHBondContact O-N 2.73Å; I272-L289 HydrophobicContact CB-CD1 4.16Å; I272-L289 HydrophobicContact CG2-CD1 3.44Å; I272-L289 VanDerWaalsContact CG2-CD1 3.44Å; I272-L289 HydrophobicContact CG2-CD2 4.25Å
273	G	81.9	Confident	80.7	Confident	17 Å²	17	70.9 Å²	70.9	18%	0.175	39%	0.385	C	S	.	.	H	α-helix	trans	-55.1	-42.9	172.1	0	0	0	0	0	112.4	P269 Y270 Y271 T277 F286	P269-G273 PolarHBondContact O-N 3.34Å; Y270-G273 CarbonylContact O-C 3.49Å; Y270-G273 WeakPolarHBondContact O-CA 3.47Å; Y270-G273 PolarHBondContact O-N 2.95Å; Y271-G273 VanDerWaalsContact C-N 3.33Å; G273-T277 WeakPolarHBondContact O-CG2 3.4Å; G273-F286 VanDerWaalsContact O-CE1 3.23Å; G273-F286 WeakPolarHBondContact O-CE1 3.25Å
274	L	83.6	Confident	79.4	Confident	99 Å²	99	73.2 Å²	73.2	52%	0.518	41%	0.409	S	S	.	.	H	α-helix	trans	-67.1	-45.4	178.3	-170	66.5	0	0	0	112.3	Y270 Y271 I272 T277	Y270-L274 PolarHBondContact O-N 3.37Å; Y271-L274 PolarHBondContact O-N 3.42Å; I272-L274 VanDerWaalsContact C-N 3.28Å; I272-L274 PolarHBondContact O-N 3.19Å; L274-T277 PolarHBondContact O-OG1 3.2Å
275	V	82.6	Confident	78	Confident	117 Å²	117	72.2 Å²	72.2	71%	0.709	41%	0.407	S	S	*	.	H	α-helix	trans	-69.4	-35.2	-175.9	172.2	0	0	0	0	112.7	Y271 I272	Y271-V275 WeakPolarHBondContact O-CG2 3.27Å; Y271-V275 PolarHBondContact O-N 3.43Å; I272-V275 PolarHBondContact O-N 3.39Å
276	M	74.6	Confident	76.8	Confident	76 Å²	76	72.4 Å²	72.4	37%	0.374	40%	0.404	S	S	.	.	H	α-helix	trans	-84	-7	-174.8	-74.7	-162	157.7	0	0	114.7	I272 N278 N279 V282 F286	I272-M276 HydrophobicContact CG2-CG 4.3Å; I272-M276 HydrophobicContact CG2-SD 4.14Å; I272-M276 WeakPolarHBondContact O-CB 3.45Å; I272-M276 PolarHBondContact O-N 2.73Å; M276-N278 PolarHBondContact O-N 3.44Å; M276-N279 PolarHBondContact O-N 3.34Å; M276-V282 HydrophobicContact CB-CG2 4.35Å; M276-F286 VanDerWaalsContact C-CZ 3.4Å; M276-F286 HydrophobicContact CB-CE1 3.73Å; M276-F286 HydrophobicContact CB-CZ 3.61Å; M276-F286 WeakPolarHBondContact O-CZ 3.43Å
277	T	66.7	Low	75.8	Confident	88 Å²	88	76.3 Å²	76.3	54%	0.54	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-12.5	-171	47.8	0	0	0	0	116	G273 L274 F286	G273-T277 WeakPolarHBondContact O-CG2 3.4Å; L274-T277 PolarHBondContact O-OG1 3.2Å; T277-F286 HydrophobicContact CG2-CE1 4.31Å; T277-F286 HydrophobicContact CG2-CZ 4.36Å
278	N	61.1	Low	74.8	Confident	143 Å²	143	79.8 Å²	79.8	77%	0.765	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-2.1	-176.9	-67	-31.1	0	0	0	115.2	M276	M276-N278 PolarHBondContact O-N 3.44Å
279	N	69.6	Low	74.2	Confident	105 Å²	105	77.2 Å²	77.2	56%	0.561	44%	0.437	S	S	*	.			trans	-116.6	112.2	-176.7	-68.6	-30.1	0	0	0	109.9	M276 D281 V282	M276-N279 PolarHBondContact O-N 3.34Å; N279-D281 VanDerWaalsContact C-N 3.28Å; N279-D281 PolarHBondContact O-N 3.34Å; N279-V282 HydrophobicContact CB-CG2 3.52Å; N279-V282 WeakPolarHBondContact O-CG2 3.24Å; N279-V282 PolarHBondContact O-N 3.14Å
280	E	65.2	Low	73.7	Confident	182 Å²	182	82.7 Å²	82.7	85%	0.85	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-65.8	-29.1	-176.7	-62.9	-172.6	159.4	0	0	112.8	V282 S283	E280-V282 PolarHBondContact O-N 3.42Å; E280-S283 WeakPolarHBondContact O-CB 3.43Å; E280-S283 PolarHBondContact O-N 3.29Å
281	D	66	Low	73.4	Confident	169 Å²	169	85.8 Å²	85.8	90%	0.904	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-68.3	-17.2	178.7	-64.7	-36.3	0	0	0	114.3	N279	N279-D281 VanDerWaalsContact C-N 3.28Å; N279-D281 PolarHBondContact O-N 3.34Å
282	V	63.3	Low	73.3	Confident	39 Å²	39	86 Å²	86	24%	0.236	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-99.8	10.4	178.3	-68.3	0	0	0	0	113.1	M276 N279 E280 G284 A285 F286	M276-V282 HydrophobicContact CB-CG2 4.35Å; N279-V282 HydrophobicContact CB-CG2 3.52Å; N279-V282 WeakPolarHBondContact O-CG2 3.24Å; N279-V282 PolarHBondContact O-N 3.14Å; E280-V282 PolarHBondContact O-N 3.42Å; V282-G284 PolarHBondContact O-N 3.07Å; V282-G284 VanDerWaalsContact O-N 3.11Å; V282-A285 HydrophobicContact CB-CB 4.14Å; V282-A285 WeakPolarHBondContact O-CA 3.27Å; V282-A285 VanDerWaalsContact O-CB 3.31Å; V282-A285 WeakPolarHBondContact O-CB 3.27Å; V282-A285 PolarHBondContact O-N 3.19Å; V282-F286 HydrophobicContact CG2-CE2 4.09Å; V282-F286 HydrophobicContact CG2-CZ 4.41Å; V282-F286 WeakPolarHBondContact O-CD2 3.38Å; V282-F286 WeakPolarHBondContact O-CE2 3.44Å; V282-F286 PolarHBondContact O-N 2.96Å
283	S	61.8	Low	73.3	Confident	80 Å²	80	86 Å²	86	56%	0.559	48%	0.479	S	S	*	.	H	α-helix	trans	-52.4	-36.4	175.8	-169.4	0	0	0	0	112.4	E280	E280-S283 WeakPolarHBondContact O-CB 3.43Å; E280-S283 PolarHBondContact O-N 3.29Å
284	G	66.2	Low	73.7	Confident	49 Å²	49	89 Å²	89	51%	0.505	49%	0.494	S	S	.	.	H	α-helix	trans	-69.9	-30.1	174.7	0	0	0	0	0	114.2	V282 F286 V287 T288	V282-G284 PolarHBondContact O-N 3.07Å; V282-G284 VanDerWaalsContact O-N 3.11Å; G284-F286 VanDerWaalsContact C-N 3.33Å; G284-F286 PolarHBondContact O-N 2.96Å; G284-V287 PolarHBondContact O-N 3.35Å; G284-T288 PolarHBondContact O-N 3.41Å; G284-T288 PolarHBondContact O-OG1 3.45Å
285	A	66.6	Low	73.9	Confident	38 Å²	38	88 Å²	88	31%	0.314	49%	0.485	S	S	.	.	H	α-helix	trans	-67.9	-32	177.9	0	0	0	0	0	112	V282 V287 T288 L289	V282-A285 HydrophobicContact CB-CB 4.14Å; V282-A285 WeakPolarHBondContact O-CA 3.27Å; V282-A285 VanDerWaalsContact O-CB 3.31Å; V282-A285 WeakPolarHBondContact O-CB 3.27Å; V282-A285 PolarHBondContact O-N 3.19Å; A285-V287 VanDerWaalsContact C-N 3.28Å; A285-V287 PolarHBondContact O-N 3.47Å; A285-T288 PolarHBondContact O-N 3.49Å; A285-L289 WeakPolarHBondContact O-CG 3.37Å; A285-L289 PolarHBondContact O-N 3.12Å
286	F	66.9	Low	74.4	Confident	45 Å²	45	82.7 Å²	82.7	20%	0.197	45%	0.452	C	S	.	.	H	α-helix	trans	-62.2	-36.5	174.5	-62	-78	0	0	0	112.7	G273 M276 T277 V282 G284 T288 L289 R290	G273-F286 VanDerWaalsContact O-CE1 3.23Å; G273-F286 WeakPolarHBondContact O-CE1 3.25Å; M276-F286 VanDerWaalsContact C-CZ 3.4Å; M276-F286 HydrophobicContact CB-CE1 3.73Å; M276-F286 HydrophobicContact CB-CZ 3.61Å; M276-F286 WeakPolarHBondContact O-CZ 3.43Å; T277-F286 HydrophobicContact CG2-CE1 4.31Å; T277-F286 HydrophobicContact CG2-CZ 4.36Å; V282-F286 HydrophobicContact CG2-CE2 4.09Å; V282-F286 HydrophobicContact CG2-CZ 4.41Å; V282-F286 WeakPolarHBondContact O-CD2 3.38Å; V282-F286 WeakPolarHBondContact O-CE2 3.44Å; V282-F286 PolarHBondContact O-N 2.96Å; G284-F286 VanDerWaalsContact C-N 3.33Å; G284-F286 PolarHBondContact O-N 2.96Å; F286-T288 VanDerWaalsContact C-N 3.32Å; F286-L289 PolarHBondContact O-N 3.49Å; F286-R290 WeakPolarHBondContact O-CG 3.5Å; F286-R290 PolarHBondContact O-N 3.48Å
287	V	71.8	Confident	75.2	Confident	89 Å²	89	82.9 Å²	82.9	54%	0.539	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176.8	-178.1	0	0	0	0	110	G284 A285 R290	G284-V287 PolarHBondContact O-N 3.35Å; A285-V287 VanDerWaalsContact C-N 3.28Å; A285-V287 PolarHBondContact O-N 3.47Å; V287-R290 WeakPolarHBondContact O-CB 3.48Å; V287-R290 PolarHBondContact O-N 3.41Å
288	T	73.9	Confident	76.4	Confident	88 Å²	88	84 Å²	84	54%	0.54	45%	0.451	S	S	.	.	H	α-helix	trans	-67.5	-35.5	176.4	-48	0	0	0	0	112.2	G284 A285 F286 R290 V291	G284-T288 PolarHBondContact O-N 3.41Å; G284-T288 PolarHBondContact O-OG1 3.45Å; A285-T288 PolarHBondContact O-N 3.49Å; F286-T288 VanDerWaalsContact C-N 3.32Å; T288-R290 VanDerWaalsContact C-N 3.26Å; T288-R290 PolarHBondContact O-N 3.1Å; T288-V291 WeakPolarHBondContact O-CB 3.37Å; T288-V291 PolarHBondContact O-N 3.37Å
289	L	78.6	Confident	77.8	Confident	27 Å²	27	77.2 Å²	77.2	14%	0.141	42%	0.415	C	S	.	.	H	α-helix	trans	-64.9	-27.2	177.5	-72.6	173.3	0	0	0	113.3	I272 A285 F286 V291 F292	I272-L289 HydrophobicContact CB-CD1 4.16Å; I272-L289 HydrophobicContact CG2-CD1 3.44Å; I272-L289 VanDerWaalsContact CG2-CD1 3.44Å; I272-L289 HydrophobicContact CG2-CD2 4.25Å; A285-L289 WeakPolarHBondContact O-CG 3.37Å; A285-L289 PolarHBondContact O-N 3.12Å; F286-L289 PolarHBondContact O-N 3.49Å; L289-V291 PolarHBondContact O-N 3.19Å; L289-F292 HydrophobicContact CD2-CD2 4.16Å; L289-F292 HydrophobicContact CD2-CE2 4.43Å; L289-F292 PolarHBondContact O-N 3.25Å; L289-F292 VanDerWaalsContact O-N 3.1Å
290	R	79.6	Confident	78.8	Confident	125 Å²	125	77.2 Å²	77.2	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-60.4	-29.9	175.3	-66	178.9	-163.8	179.6	4.4	112.2	F286 V287 T288 F292 R293	F286-R290 WeakPolarHBondContact O-CG 3.5Å; F286-R290 PolarHBondContact O-N 3.48Å; V287-R290 WeakPolarHBondContact O-CB 3.48Å; V287-R290 PolarHBondContact O-N 3.41Å; T288-R290 VanDerWaalsContact C-N 3.26Å; T288-R290 PolarHBondContact O-N 3.1Å; R290-F292 VanDerWaalsContact C-N 3.29Å; R290-F292 PolarHBondContact O-N 3.46Å; R290-R293 VanDerWaalsContact O-CB 3.27Å; R290-R293 WeakPolarHBondContact O-CB 3.23Å; R290-R293 PolarHBondContact O-N 3.03Å; R290-R293 VanDerWaalsContact O-N 3.13Å
291	V	83.7	Confident	79.9	Confident	99 Å²	99	69.1 Å²	69.1	60%	0.6	37%	0.374	S	S	*	.	H	α-helix	trans	-61.8	-39.1	176.4	179.8	0	0	0	0	111	T288 L289 R293 V294	T288-V291 WeakPolarHBondContact O-CB 3.37Å; T288-V291 PolarHBondContact O-N 3.37Å; L289-V291 PolarHBondContact O-N 3.19Å; V291-R293 PolarHBondContact O-N 2.88Å; V291-R293 VanDerWaalsContact O-N 3.15Å; V291-V294 WeakPolarHBondContact O-CB 3.35Å; V291-V294 WeakPolarHBondContact O-CG1 3.23Å; V291-V294 PolarHBondContact O-N 2.9Å
292	F	87.3	Confident	80.8	Confident	86 Å²	86	62.9 Å²	62.9	38%	0.377	34%	0.338	S	S	.	.	H	α-helix	trans	-65.9	-18	179.7	-68.6	-85.2	0	0	0	113.1	P269 L289 R290 V294 F295	P269-F292 HydrophobicContact CB-CB 4.35Å; P269-F292 HydrophobicContact CG-CB 3.57Å; L289-F292 HydrophobicContact CD2-CD2 4.16Å; L289-F292 HydrophobicContact CD2-CE2 4.43Å; L289-F292 PolarHBondContact O-N 3.25Å; L289-F292 VanDerWaalsContact O-N 3.1Å; R290-F292 VanDerWaalsContact C-N 3.29Å; R290-F292 PolarHBondContact O-N 3.46Å; F292-V294 PolarHBondContact O-N 3.35Å; F292-V294 VanDerWaalsContact O-N 3.16Å; F292-F295 HydrophobicContact CB-CD2 4.01Å; F292-F295 HydrophobicContact CB-CE2 4.33Å; F292-F295 AromaticContact CD1-CD2 3.7Å; F292-F295 HydrophobicContact CD1-CD2 3.7Å; F292-F295 AromaticContact CD1-CE2 3.31Å; F292-F295 HydrophobicContact CD1-CE2 3.31Å; F292-F295 HydrophobicContact CD1-CZ 4.44Å; F292-F295 AromaticContact CE1-CE2 3.93Å; F292-F295 HydrophobicContact CE1-CE2 3.93Å; F292-F295 HydrophobicContact CG-CD2 4.29Å; F292-F295 HydrophobicContact CG-CE2 4.14Å; F292-F295 WeakPolarHBondContact O-CB 3.04Å; F292-F295 VanDerWaalsContact O-CD2 3.25Å; F292-F295 WeakPolarHBondContact O-CD2 3.19Å; F292-F295 PolarHBondContact O-N 3.01Å
293	R	88.6	Confident	81.9	Confident	45 Å²	45	61.9 Å²	61.9	17%	0.17	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-60.7	-23.3	172.1	-63.3	177.3	167.6	167.7	-6.2	111.9	N200 E203 D230 P269 R290 V291 F295 R296	N200-R293 PolarHBondContact ND2-O 3.41Å; N200-R293 VanDerWaalsContact ND2-O 3.15Å; E203-R293 IonicContact OE1-NH1 2.86Å; E203-R293 PolarHBondContact OE1-NH1 2.73Å; E203-R293 IonicContact OE2-NH1 3.51Å; E203-R293 PolarHBondContact OE2-NH1 2.93Å; D230-R293 IonicContact OD2-CZ 3.65Å; D230-R293 VanDerWaalsContact OD2-CZ 3.29Å; D230-R293 IonicContact OD2-NE 3.29Å; D230-R293 PolarHBondContact OD2-NE 2.86Å; D230-R293 IonicContact OD2-NH2 3.96Å; D230-R293 PolarHBondContact OD2-NH2 3.43Å; P269-R293 HydrophobicContact CB-CG 4.05Å; P269-R293 HydrophobicContact CG-CG 4.49Å; R290-R293 VanDerWaalsContact O-CB 3.27Å; R290-R293 WeakPolarHBondContact O-CB 3.23Å; R290-R293 PolarHBondContact O-N 3.03Å; R290-R293 VanDerWaalsContact O-N 3.13Å; V291-R293 PolarHBondContact O-N 2.88Å; V291-R293 VanDerWaalsContact O-N 3.15Å; R293-F295 PolarHBondContact O-N 3.47Å; R293-R296 WeakPolarHBondContact O-CB 3.48Å; R293-R296 WeakPolarHBondContact O-CD 3.39Å; R293-R296 WeakPolarHBondContact O-CG 3.22Å; R293-R296 PolarHBondContact O-N 2.99Å
294	V	89.1	Confident	83	Confident	81 Å²	81	59.5 Å²	59.5	49%	0.491	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-60.1	-30.6	175.7	80.9	0	0	0	0	111.7	V291 F292 R296 I297	V291-V294 WeakPolarHBondContact O-CB 3.35Å; V291-V294 WeakPolarHBondContact O-CG1 3.23Å; V291-V294 PolarHBondContact O-N 2.9Å; F292-V294 PolarHBondContact O-N 3.35Å; F292-V294 VanDerWaalsContact O-N 3.16Å; V294-R296 PolarHBondContact O-N 2.97Å; V294-I297 WeakPolarHBondContact O-CB 3.38Å; V294-I297 WeakPolarHBondContact O-CG2 3.39Å; V294-I297 PolarHBondContact O-N 3.26Å
295	F	89.5	Confident	83.7	Confident	76 Å²	76	62.2 Å²	62.2	33%	0.333	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-62.3	-18.9	-179.4	-69.1	-69.5	0	0	0	113.1	V265 F292 R293 I297 F298	V265-F295 HydrophobicContact CG1-CB 3.63Å; V265-F295 HydrophobicContact CG1-CD2 4.04Å; V265-F295 HydrophobicContact CG1-CG 3.85Å; F292-F295 HydrophobicContact CB-CD2 4.01Å; F292-F295 HydrophobicContact CB-CE2 4.33Å; F292-F295 AromaticContact CD1-CD2 3.7Å; F292-F295 HydrophobicContact CD1-CD2 3.7Å; F292-F295 AromaticContact CD1-CE2 3.31Å; F292-F295 HydrophobicContact CD1-CE2 3.31Å; F292-F295 HydrophobicContact CD1-CZ 4.44Å; F292-F295 AromaticContact CE1-CE2 3.93Å; F292-F295 HydrophobicContact CE1-CE2 3.93Å; F292-F295 HydrophobicContact CG-CD2 4.29Å; F292-F295 HydrophobicContact CG-CE2 4.14Å; F292-F295 WeakPolarHBondContact O-CB 3.04Å; F292-F295 VanDerWaalsContact O-CD2 3.25Å; F292-F295 WeakPolarHBondContact O-CD2 3.19Å; F292-F295 PolarHBondContact O-N 3.01Å; R293-F295 PolarHBondContact O-N 3.47Å; F295-I297 PolarHBondContact O-N 3.13Å; F295-I297 VanDerWaalsContact O-N 3.16Å; F295-F298 HydrophobicContact CB-CD2 4.36Å; F295-F298 AromaticContact CD1-CD2 3.82Å; F295-F298 HydrophobicContact CD1-CD2 3.82Å; F295-F298 AromaticContact CD1-CE2 3.68Å; F295-F298 HydrophobicContact CD1-CE2 3.68Å; F295-F298 HydrophobicContact CE1-CE2 4.21Å; F295-F298 WeakPolarHBondContact O-CB 3.01Å; F295-F298 WeakPolarHBondContact O-CD2 3.44Å; F295-F298 PolarHBondContact O-N 3.39Å
296	R	91.4	Very high	84.4	Confident	6 Å²	6	62.5 Å²	62.5	2%	0.023	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-60.5	-22.8	173.7	81.4	-165.4	176.5	-172.7	-2.2	113.5	S196 V197 N200 D230 A266 R293 V294 F298 K299	S196-R296 VanDerWaalsContact C-NE 3.34Å; S196-R296 VanDerWaalsContact C-NH2 3.34Å; S196-R296 PolarHBondContact O-NE 3.37Å; S196-R296 PolarHBondContact O-NH2 3.49Å; S196-R296 WeakPolarHBondContact OG-CD 3.19Å; S196-R296 PolarHBondContact OG-NE 2.71Å; V197-R296 HydrophobicContact CG2-CG 4.23Å; N200-R296 VanDerWaalsContact ND2-CZ 3.25Å; N200-R296 PolarHBondContact ND2-NE 3.21Å; N200-R296 PolarHBondContact ND2-NH2 2.9Å; N200-R296 PolarHBondContact OD1-NH2 3.15Å; D230-R296 IonicContact OD1-CZ 3.44Å; D230-R296 IonicContact OD1-NH1 3.22Å; D230-R296 PolarHBondContact OD1-NH1 3.14Å; A266-R296 HydrophobicContact CB-CB 4Å; R293-R296 WeakPolarHBondContact O-CB 3.48Å; R293-R296 WeakPolarHBondContact O-CD 3.39Å; R293-R296 WeakPolarHBondContact O-CG 3.22Å; R293-R296 PolarHBondContact O-N 2.99Å; V294-R296 PolarHBondContact O-N 2.97Å; R296-F298 PolarHBondContact O-N 2.72Å; R296-K299 WeakPolarHBondContact O-CB 3.5Å; R296-K299 PolarHBondContact O-N 3.01Å; R296-K299 VanDerWaalsContact O-N 3.09Å
297	I	92.6	Very high	85.2	Confident	81 Å²	81	63.9 Å²	63.9	42%	0.415	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-59.6	-34.7	173.2	-159.6	171.5	0	0	0	111.7	V197 V294 F295 K299 F300	V197-I297 HydrophobicContact CG1-CD1 4.46Å; V197-I297 HydrophobicContact CG2-CB 4.22Å; V197-I297 HydrophobicContact CG2-CG1 4.22Å; V294-I297 WeakPolarHBondContact O-CB 3.38Å; V294-I297 WeakPolarHBondContact O-CG2 3.39Å; V294-I297 PolarHBondContact O-N 3.26Å; F295-I297 PolarHBondContact O-N 3.13Å; F295-I297 VanDerWaalsContact O-N 3.16Å; I297-K299 PolarHBondContact O-N 3.37Å; I297-F300 WeakPolarHBondContact O-CB 3.47Å; I297-F300 PolarHBondContact O-N 3.47Å; I297-F300 VanDerWaalsContact O-N 3.1Å
298	F	91.3	Very high	85.7	Confident	110 Å²	110	63.2 Å²	63.2	48%	0.482	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-69.4	-16.3	179.7	-65.8	-68.4	0	0	0	112.5	I262 F295 R296 F300 S301	I262-F298 HydrophobicContact CD1-CB 4.48Å; I262-F298 HydrophobicContact CG2-CB 3.79Å; F295-F298 HydrophobicContact CB-CD2 4.36Å; F295-F298 AromaticContact CD1-CD2 3.82Å; F295-F298 HydrophobicContact CD1-CD2 3.82Å; F295-F298 AromaticContact CD1-CE2 3.68Å; F295-F298 HydrophobicContact CD1-CE2 3.68Å; F295-F298 HydrophobicContact CE1-CE2 4.21Å; F295-F298 WeakPolarHBondContact O-CB 3.01Å; F295-F298 WeakPolarHBondContact O-CD2 3.44Å; F295-F298 PolarHBondContact O-N 3.39Å; R296-F298 PolarHBondContact O-N 2.72Å; F298-F300 PolarHBondContact O-N 3.08Å; F298-S301 WeakPolarHBondContact O-CB 3.03Å; F298-S301 PolarHBondContact O-N 2.88Å; F298-S301 PolarHBondContact O-OG 2.97Å
299	K	91.7	Very high	86	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.009	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-60.1	-28.1	172.1	-165.4	171.1	176.7	167.1	0	111.8	I193 F237 E240 D263 R296 I297 S301 R302	I193-K299 HydrophobicContact CD1-CB 4.12Å; I193-K299 HydrophobicContact CD1-CD 3.97Å; I193-K299 HydrophobicContact CD1-CG 3.72Å; I193-K299 HydrophobicContact CG1-CB 4.39Å; I193-K299 HydrophobicContact CG1-CD 4.05Å; I193-K299 HydrophobicContact CG1-CG 4.23Å; F237-K299 VanDerWaalsContact CB-NZ 3.35Å; F237-K299 HydrophobicContact CD1-CD 4.31Å; F237-K299 HydrophobicContact CE1-CD 4.43Å; F237-K299 HydrophobicContact CG-CD 4.4Å; F237-K299 VanDerWaalsContact CG-NZ 3.27Å; E240-K299 IonicContact OE1-NZ 2.63Å; E240-K299 VanDerWaalsContact OE2-CE 3.26Å; E240-K299 WeakPolarHBondContact OE2-CE 3.29Å; E240-K299 IonicContact OE2-NZ 3.27Å; E240-K299 PolarHBondContact OE2-NZ 3.12Å; D263-K299 WeakPolarHBondContact OD1-CE 3.2Å; R296-K299 WeakPolarHBondContact O-CB 3.5Å; R296-K299 PolarHBondContact O-N 3.01Å; R296-K299 VanDerWaalsContact O-N 3.09Å; I297-K299 PolarHBondContact O-N 3.37Å; K299-S301 PolarHBondContact O-N 2.77Å; K299-S301 VanDerWaalsContact O-N 3.13Å; K299-R302 PolarHBondContact O-N 2.95Å; K299-R302 VanDerWaalsContact O-N 3.15Å
300	F	89.4	Confident	86.3	Confident	104 Å²	104	62 Å²	62	46%	0.456	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-60.5	-19.7	172.2	-164.4	-103.8	0	0	0	113.3	I193 I297 F298 R302 H303 S304 L307	I193-F300 HydrophobicContact CG2-CB 4.38Å; I297-F300 WeakPolarHBondContact O-CB 3.47Å; I297-F300 PolarHBondContact O-N 3.47Å; I297-F300 VanDerWaalsContact O-N 3.1Å; F298-F300 PolarHBondContact O-N 3.08Å; F300-R302 PolarHBondContact O-N 3.38Å; F300-H303 HydrophobicContact CD2-CB 4.46Å; F300-H303 PolarHBondContact O-N 3.01Å; F300-S304 PolarHBondContact O-N 3.36Å; F300-L307 HydrophobicContact CD1-CD1 4Å
301	S	87.8	Confident	86.5	Confident	12 Å²	12	57.9 Å²	57.9	8%	0.084	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-58.4	-32.6	174.4	67.3	0	0	0	0	112.5	F298 K299 H303 S304 R308	F298-S301 WeakPolarHBondContact O-CB 3.03Å; F298-S301 PolarHBondContact O-N 2.88Å; F298-S301 PolarHBondContact O-OG 2.97Å; K299-S301 PolarHBondContact O-N 2.77Å; K299-S301 VanDerWaalsContact O-N 3.13Å; S301-H303 VanDerWaalsContact C-N 3.26Å; S301-H303 PolarHBondContact O-N 3.26Å; S301-S304 PolarHBondContact O-N 3.25Å; S301-R308 VanDerWaalsContact O-CG 3.23Å; S301-R308 WeakPolarHBondContact O-CG 3.32Å
302	R	85.9	Confident	86.3	Confident	39 Å²	39	59.5 Å²	59.5	15%	0.147	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-65.7	-33.4	175.8	-174	175.1	-67.9	-82	8.2	111.8	M259 D263 K299 F300	M259-R302 VanDerWaalsContact CB-NH2 3.33Å; D263-R302 IonicContact OD2-CZ 2.91Å; D263-R302 IonicContact OD2-NE 3.77Å; D263-R302 IonicContact OD2-NH2 3.99Å; D263-R302 PolarHBondContact OD2-NH2 3.35Å; K299-R302 PolarHBondContact O-N 2.95Å; K299-R302 VanDerWaalsContact O-N 3.15Å; F300-R302 PolarHBondContact O-N 3.38Å
303	H	85.9	Confident	86	Confident	17 Å²	17	55.5 Å²	55.5	8%	0.079	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-19.2	-178.5	-59.2	75.3	0	0	0	113.1	Y186 T189 I193 F300 S301	Y186-H303 AromaticContact CD2-CD2 3.54Å; Y186-H303 HydrophobicContact CE2-CB 3.84Å; Y186-H303 AromaticContact CE2-CD2 3.44Å; Y186-H303 VanDerWaalsContact CE2-CD2 3.44Å; Y186-H303 WeakPolarHBondContact CE2-CD2 3.39Å; Y186-H303 AromaticContact CE2-CG 3.91Å; Y186-H303 AromaticContact CZ-CD2 3.9Å; Y186-H303 PolarHBondContact O-CD2 3.28Å; Y186-H303 PolarHBondContact O-NE2 2.9Å; Y186-H303 PolarHBondContact OH-O 3.21Å; T189-H303 PolarHBondContact OG1-NE2 3.25Å; I193-H303 WeakPolarHBondContact CD1-CE1 3.19Å; F300-H303 HydrophobicContact CD2-CB 4.46Å; F300-H303 PolarHBondContact O-N 3.01Å; S301-H303 VanDerWaalsContact C-N 3.26Å; S301-H303 PolarHBondContact O-N 3.26Å
304	S	86.2	Confident	85.7	Confident	31 Å²	31	57.4 Å²	57.4	22%	0.217	30%	0.295	C	S	.	.			trans	-107.4	109.5	178.8	177.8	0	0	0	0	111.9	F300 S301 G306 L307 R308	F300-S304 PolarHBondContact O-N 3.36Å; S301-S304 PolarHBondContact O-N 3.25Å; S304-G306 PolarHBondContact O-N 3.44Å; S304-G306 PolarHBondContact OG-N 3.42Å; S304-L307 PolarHBondContact O-N 3.46Å; S304-L307 PolarHBondContact OG-N 2.99Å; S304-R308 PolarHBondContact O-N 3Å; S304-R308 VanDerWaalsContact O-N 3.16Å
305	Q	79.4	Confident	85.4	Confident	105 Å²	105	61.6 Å²	61.6	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-56.9	-37.9	171.2	-172.2	-176.7	-12.5	0	0	111.3	L307 R308 I309 D417	Q305-L307 PolarHBondContact O-N 3.15Å; Q305-R308 PolarHBondContact O-N 3.05Å; Q305-I309 HydrophobicContact CG-CD1 3.85Å; Q305-I309 HydrophobicContact CG-CG1 4.36Å; Q305-I309 VanDerWaalsContact O-CG1 3.3Å; Q305-I309 WeakPolarHBondContact O-CG1 3.4Å; Q305-I309 PolarHBondContact O-N 2.62Å; Q305-D417 PolarHBondContact NE2-OD2 2.83Å
306	G	81.2	Confident	84.9	Confident	44 Å²	44	61.8 Å²	61.8	45%	0.454	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-43.7	177.6	0	0	0	0	0	113	S304 I309 L310	S304-G306 PolarHBondContact O-N 3.44Å; S304-G306 PolarHBondContact OG-N 3.42Å; G306-I309 PolarHBondContact O-N 2.95Å; G306-L310 WeakPolarHBondContact O-CB 3.36Å; G306-L310 PolarHBondContact O-N 3.21Å
307	L	83.8	Confident	84.5	Confident	75 Å²	75	61.8 Å²	61.8	39%	0.393	32%	0.318	S	S	.	.	H	α-helix	trans	-68.4	-34.8	177	-71.8	177.8	0	0	0	112.5	F300 S304 Q305 L310 G311	F300-L307 HydrophobicContact CD1-CD1 4Å; S304-L307 PolarHBondContact O-N 3.46Å; S304-L307 PolarHBondContact OG-N 2.99Å; Q305-L307 PolarHBondContact O-N 3.15Å; L307-L310 HydrophobicContact CD2-CD2 4.27Å; L307-L310 PolarHBondContact O-N 3.35Å; L307-G311 PolarHBondContact O-N 3.26Å
308	R	83.3	Confident	84.2	Confident	75 Å²	75	60.4 Å²	60.4	28%	0.283	32%	0.319	S	S	.	.	H	α-helix	trans	-63.7	-48.7	173	-69.1	167.9	57.2	-177.1	0.5	111	M259 S301 S304 Q305 L310 G311 Y312	M259-R308 HydrophobicContact CE-CG 4.17Å; S301-R308 VanDerWaalsContact O-CG 3.23Å; S301-R308 WeakPolarHBondContact O-CG 3.32Å; S304-R308 PolarHBondContact O-N 3Å; S304-R308 VanDerWaalsContact O-N 3.16Å; Q305-R308 PolarHBondContact O-N 3.05Å; R308-L310 VanDerWaalsContact C-N 3.32Å; R308-L310 PolarHBondContact O-N 2.9Å; R308-G311 PolarHBondContact O-N 3.42Å; R308-G311 VanDerWaalsContact O-N 3.15Å; R308-Y312 HydrophobicContact CB-CE2 4.27Å; R308-Y312 WeakPolarHBondContact O-CD2 3.33Å; R308-Y312 PolarHBondContact O-N 3.41Å
309	I	80.7	Confident	83.9	Confident	22 Å²	22	59.7 Å²	59.7	11%	0.113	33%	0.327	C	S	.	.	H	α-helix	trans	-58.9	-46.3	176.8	-67.9	167.3	0	0	0	109.9	Q305 G306 G311 Y312 T313 Y410	Q305-I309 HydrophobicContact CG-CD1 3.85Å; Q305-I309 HydrophobicContact CG-CG1 4.36Å; Q305-I309 VanDerWaalsContact O-CG1 3.3Å; Q305-I309 WeakPolarHBondContact O-CG1 3.4Å; Q305-I309 PolarHBondContact O-N 2.62Å; G306-I309 PolarHBondContact O-N 2.95Å; I309-G311 VanDerWaalsContact C-N 3.3Å; I309-G311 PolarHBondContact O-N 3.3Å; I309-Y312 PolarHBondContact O-N 3.42Å; I309-Y312 VanDerWaalsContact O-N 3.11Å; I309-T313 HydrophobicContact CG2-CG2 4.18Å; I309-T313 WeakPolarHBondContact O-CG2 3.17Å; I309-T313 PolarHBondContact O-N 3.27Å; I309-T313 PolarHBondContact O-OG1 2.84Å; I309-Y410 HydrophobicContact CG2-CD2 4.5Å
310	L	82.9	Confident	83.6	Confident	68 Å²	68	62.3 Å²	62.3	36%	0.356	34%	0.34	S	S	.	.	H	α-helix	trans	-54.4	-47.2	174.8	-179	63.8	0	0	0	111.2	G306 L307 R308 Y312 T313 L314 F406	G306-L310 WeakPolarHBondContact O-CB 3.36Å; G306-L310 PolarHBondContact O-N 3.21Å; L307-L310 HydrophobicContact CD2-CD2 4.27Å; L307-L310 PolarHBondContact O-N 3.35Å; R308-L310 VanDerWaalsContact C-N 3.32Å; R308-L310 PolarHBondContact O-N 2.9Å; L310-Y312 PolarHBondContact O-N 3.11Å; L310-T313 WeakPolarHBondContact CA-OG1 3.38Å; L310-T313 PolarHBondContact O-N 2.63Å; L310-T313 PolarHBondContact O-OG1 2.97Å; L310-L314 HydrophobicContact CD1-CD1 4.39Å; L310-L314 HydrophobicContact CD1-CG 4.34Å; L310-L314 HydrophobicContact CG-CD1 4.14Å; L310-L314 WeakPolarHBondContact O-CB 3.47Å; L310-L314 WeakPolarHBondContact O-CG 3.47Å; L310-L314 PolarHBondContact O-N 3.42Å; L310-F406 HydrophobicContact CD1-CD2 4.44Å; L310-F406 HydrophobicContact CD1-CE2 3.69Å; L310-F406 HydrophobicContact CD1-CZ 4.36Å
311	G	84.1	Confident	83.5	Confident	38 Å²	38	60.2 Å²	60.2	39%	0.392	33%	0.333	S	S	.	.	H	α-helix	trans	-58.6	-43.9	175.4	0	0	0	0	0	113.8	L307 R308 I309 L314 K315	L307-G311 PolarHBondContact O-N 3.26Å; R308-G311 PolarHBondContact O-N 3.42Å; R308-G311 VanDerWaalsContact O-N 3.15Å; I309-G311 VanDerWaalsContact C-N 3.3Å; I309-G311 PolarHBondContact O-N 3.3Å; G311-L314 PolarHBondContact O-N 3.34Å; G311-K315 PolarHBondContact O-N 3.31Å
312	Y	80.3	Confident	83.5	Confident	132 Å²	132	61.3 Å²	61.3	52%	0.518	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-41.2	176.3	-68.2	-62.4	0	0	0	112.3	R308 I309 L310 K315 S316	R308-Y312 HydrophobicContact CB-CE2 4.27Å; R308-Y312 WeakPolarHBondContact O-CD2 3.33Å; R308-Y312 PolarHBondContact O-N 3.41Å; I309-Y312 PolarHBondContact O-N 3.42Å; I309-Y312 VanDerWaalsContact O-N 3.11Å; L310-Y312 PolarHBondContact O-N 3.11Å; Y312-K315 PolarHBondContact O-N 2.74Å; Y312-S316 PolarHBondContact O-N 2.99Å
313	T	80.8	Confident	83.6	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.012	37%	0.367	C	S	.	.	H	α-helix	trans	-64.3	-44	176.6	58.4	0	0	0	0	111.9	I309 L310 K315 S316 C317 F406 I409	I309-T313 HydrophobicContact CG2-CG2 4.18Å; I309-T313 WeakPolarHBondContact O-CG2 3.17Å; I309-T313 PolarHBondContact O-N 3.27Å; I309-T313 PolarHBondContact O-OG1 2.84Å; L310-T313 WeakPolarHBondContact CA-OG1 3.38Å; L310-T313 PolarHBondContact O-N 2.63Å; L310-T313 PolarHBondContact O-OG1 2.97Å; T313-K315 VanDerWaalsContact C-N 3.31Å; T313-K315 PolarHBondContact O-N 3.41Å; T313-S316 WeakPolarHBondContact O-CB 3.34Å; T313-S316 PolarHBondContact O-N 3.16Å; T313-S316 VanDerWaalsContact O-N 3.08Å; T313-C317 PolarHBondContact O-N 2.84Å; T313-F406 HydrophobicContact CG2-CD2 3.79Å; T313-F406 HydrophobicContact CG2-CE2 3.95Å; T313-F406 VanDerWaalsContact OG1-CD2 3.28Å; T313-F406 WeakPolarHBondContact OG1-CD2 3.24Å; T313-F406 VanDerWaalsContact OG1-CE2 3.32Å; T313-F406 WeakPolarHBondContact OG1-CE2 3.37Å; T313-I409 HydrophobicContact CG2-CB 3.86Å; T313-I409 HydrophobicContact CG2-CD1 4.3Å; T313-I409 HydrophobicContact CG2-CG2 3.51Å
314	L	83.4	Confident	83.7	Confident	85 Å²	85	66.1 Å²	66.1	45%	0.445	37%	0.369	S	S	.	.	H	α-helix	trans	-61.8	-39.5	176.4	-72.5	173.5	0	0	0	111.7	L310 G311 S316 C317 A318 L321	L310-L314 HydrophobicContact CD1-CD1 4.39Å; L310-L314 HydrophobicContact CD1-CG 4.34Å; L310-L314 HydrophobicContact CG-CD1 4.14Å; L310-L314 WeakPolarHBondContact O-CB 3.47Å; L310-L314 WeakPolarHBondContact O-CG 3.47Å; L310-L314 PolarHBondContact O-N 3.42Å; G311-L314 PolarHBondContact O-N 3.34Å; L314-S316 VanDerWaalsContact C-N 3.33Å; L314-C317 CarbonylContact O-C 3.6Å; L314-C317 PolarHBondContact O-N 3.21Å; L314-A318 WeakPolarHBondContact O-CA 3.41Å; L314-A318 PolarHBondContact O-N 3.08Å; L314-L321 HydrophobicContact CD2-CD2 4.49Å
315	K	82.6	Confident	83.9	Confident	169 Å²	169	69.1 Å²	69.1	74%	0.735	38%	0.382	S	S	*	.	H	α-helix	trans	-62.7	-41.5	173.3	-176.1	-178.6	177.5	-175.4	0	111.6	G311 Y312 T313 C317 A318	G311-K315 PolarHBondContact O-N 3.31Å; Y312-K315 PolarHBondContact O-N 2.74Å; T313-K315 VanDerWaalsContact C-N 3.31Å; T313-K315 PolarHBondContact O-N 3.41Å; K315-C317 VanDerWaalsContact C-N 3.35Å; K315-A318 WeakPolarHBondContact O-CB 3.19Å; K315-A318 PolarHBondContact O-N 3.35Å
316	S	79.3	Confident	84.5	Confident	80 Å²	80	70.3 Å²	70.3	56%	0.559	39%	0.386	S	S	*	.	H	α-helix	trans	-67.6	-35.2	178.5	-167.4	0	0	0	0	112.5	Y312 T313 L314	Y312-S316 PolarHBondContact O-N 2.99Å; T313-S316 WeakPolarHBondContact O-CB 3.34Å; T313-S316 PolarHBondContact O-N 3.16Å; T313-S316 VanDerWaalsContact O-N 3.08Å; L314-S316 VanDerWaalsContact C-N 3.33Å
317	C	81.9	Confident	84.9	Confident	6 Å²	6	69.7 Å²	69.7	4%	0.041	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	13.2	179	-62.7	0	0	0	0	113	T313 L314 K315 S319 E320 L321 N405	T313-C317 PolarHBondContact O-N 2.84Å; L314-C317 CarbonylContact O-C 3.6Å; L314-C317 PolarHBondContact O-N 3.21Å; K315-C317 VanDerWaalsContact C-N 3.35Å; C317-S319 VanDerWaalsContact C-N 3.27Å; C317-S319 PolarHBondContact O-N 3.26Å; C317-E320 PolarHBondContact O-N 2.91Å; C317-E320 VanDerWaalsContact O-N 3.16Å; C317-L321 WeakPolarHBondContact O-CB 3.34Å; C317-L321 PolarHBondContact O-N 3.05Å; C317-N405 VanDerWaalsContact SG-CB 3.57Å
318	A	85.4	Confident	85.3	Confident	53 Å²	53	67.8 Å²	67.8	44%	0.438	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-33.7	-172.5	0	0	0	0	0	113	L314 K315 G322	L314-A318 WeakPolarHBondContact O-CA 3.41Å; L314-A318 PolarHBondContact O-N 3.08Å; K315-A318 WeakPolarHBondContact O-CB 3.19Å; K315-A318 PolarHBondContact O-N 3.35Å; A318-G322 PolarHBondContact O-N 2.88Å
319	S	85	Confident	85.8	Confident	94 Å²	94	67.8 Å²	67.8	66%	0.657	37%	0.373	S	S	*	.	H	α-helix	trans	-66	-44.3	175.5	50.8	0	0	0	0	112.2	C317 G322 F323	C317-S319 VanDerWaalsContact C-N 3.27Å; C317-S319 PolarHBondContact O-N 3.26Å; S319-G322 PolarHBondContact O-N 3.45Å; S319-F323 PolarHBondContact O-N 3.25Å
320	E	85.8	Confident	86.5	Confident	58 Å²	58	71 Å²	71	27%	0.271	39%	0.389	S	S	.	.	H	α-helix	trans	-69.2	-43.4	179.5	-63.8	172.4	175.2	0	0	111.5	C317 G322 F323 L324 I402 N405	C317-E320 PolarHBondContact O-N 2.91Å; C317-E320 VanDerWaalsContact O-N 3.16Å; E320-G322 VanDerWaalsContact C-N 3.3Å; E320-G322 PolarHBondContact O-N 3.4Å; E320-F323 PolarHBondContact O-N 3.28Å; E320-L324 PolarHBondContact O-N 3.34Å; E320-I402 HydrophobicContact CB-CG1 4.41Å; E320-N405 PolarHBondContact OE1-ND2 3.44Å; E320-N405 PolarHBondContact OE2-ND2 3.3Å
321	L	87.2	Confident	87	Confident	59 Å²	59	68.4 Å²	68.4	31%	0.309	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-40	173.6	-174.9	64.8	0	0	0	111.1	L314 C317 F323 L324 L325 I402	L314-L321 HydrophobicContact CD2-CD2 4.49Å; C317-L321 WeakPolarHBondContact O-CB 3.34Å; C317-L321 PolarHBondContact O-N 3.05Å; L321-F323 VanDerWaalsContact C-N 3.35Å; L321-F323 PolarHBondContact O-N 2.88Å; L321-L324 HydrophobicContact CD1-CD2 4.41Å; L321-L324 PolarHBondContact O-N 3.39Å; L321-L325 HydrophobicContact CG-CD1 4.23Å; L321-L325 WeakPolarHBondContact O-CG 3.27Å; L321-L325 PolarHBondContact O-N 2.98Å; L321-I402 HydrophobicContact CD1-CD1 4.34Å
322	G	89.2	Confident	87.6	Confident	35 Å²	35	67.6 Å²	67.6	36%	0.361	36%	0.364	S	S	.	.	H	α-helix	trans	-60.3	-42.4	175	0	0	0	0	0	112.5	A318 S319 E320 L325 F326	A318-G322 PolarHBondContact O-N 2.88Å; S319-G322 PolarHBondContact O-N 3.45Å; E320-G322 VanDerWaalsContact C-N 3.3Å; E320-G322 PolarHBondContact O-N 3.4Å; G322-L325 PolarHBondContact O-N 3.47Å; G322-F326 VanDerWaalsContact O-CB 3.26Å; G322-F326 WeakPolarHBondContact O-CB 3.4Å; G322-F326 PolarHBondContact O-N 3.11Å
323	F	87.1	Confident	88.4	Confident	135 Å²	135	65 Å²	65	59%	0.592	36%	0.358	S	S	*	.	H	α-helix	trans	-64.5	-42.3	175	178	-100.6	0	0	0	112.7	S319 E320 L321 F326 S327	S319-F323 PolarHBondContact O-N 3.25Å; E320-F323 PolarHBondContact O-N 3.28Å; L321-F323 VanDerWaalsContact C-N 3.35Å; L321-F323 PolarHBondContact O-N 2.88Å; F323-F326 PolarHBondContact O-N 2.94Å; F323-S327 WeakPolarHBondContact O-CB 3.32Å; F323-S327 PolarHBondContact O-N 3.23Å; F323-S327 PolarHBondContact O-OG 3.33Å
324	L	88.3	Confident	89.1	Confident	23 Å²	23	69.2 Å²	69.2	12%	0.12	38%	0.379	C	S	.	.	H	α-helix	trans	-60.5	-49.1	173.8	166.6	59.3	0	0	0	111.2	E320 L321 F326 S327 L328 P398 I402	E320-L324 PolarHBondContact O-N 3.34Å; L321-L324 HydrophobicContact CD1-CD2 4.41Å; L321-L324 PolarHBondContact O-N 3.39Å; L324-F326 VanDerWaalsContact C-N 3.33Å; L324-F326 PolarHBondContact O-N 3.27Å; L324-S327 PolarHBondContact O-N 2.97Å; L324-S327 PolarHBondContact O-OG 3.46Å; L324-L328 VanDerWaalsContact O-CB 3.28Å; L324-L328 WeakPolarHBondContact O-CB 3.43Å; L324-L328 PolarHBondContact O-N 3.44Å; L324-P398 HydrophobicContact CB-CB 3.98Å; L324-P398 HydrophobicContact CB-CG 3.8Å; L324-P398 HydrophobicContact CD1-CB 4.42Å; L324-P398 HydrophobicContact CD1-CG 3.33Å; L324-P398 HydrophobicContact CD2-CG 4.04Å; L324-P398 HydrophobicContact CG-CB 4.5Å; L324-P398 HydrophobicContact CG-CG 3.87Å; L324-I402 HydrophobicContact CD2-CD1 3.95Å
325	L	90.1	Very high	89.7	Confident	93 Å²	93	66.8 Å²	66.8	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-39	179.7	-70.8	175	0	0	0	112.1	L321 G322 T329	L321-L325 HydrophobicContact CG-CD1 4.23Å; L321-L325 WeakPolarHBondContact O-CG 3.27Å; L321-L325 PolarHBondContact O-N 2.98Å; G322-L325 PolarHBondContact O-N 3.47Å; L325-T329 VanDerWaalsContact O-CB 3.31Å; L325-T329 WeakPolarHBondContact O-CB 3.35Å; L325-T329 PolarHBondContact O-N 3.38Å; L325-T329 PolarHBondContact O-OG1 2.95Å
326	F	91.8	Very high	90.4	Very high	131 Å²	131	58.7 Å²	58.7	58%	0.575	33%	0.33	S	S	*	.	H	α-helix	trans	-63.7	-49.9	176.4	175.7	-102.5	0	0	0	111.9	G322 F323 L324 T329 M330	G322-F326 VanDerWaalsContact O-CB 3.26Å; G322-F326 WeakPolarHBondContact O-CB 3.4Å; G322-F326 PolarHBondContact O-N 3.11Å; F323-F326 PolarHBondContact O-N 2.94Å; L324-F326 VanDerWaalsContact C-N 3.33Å; L324-F326 PolarHBondContact O-N 3.27Å; F326-T329 PolarHBondContact O-N 3.02Å; F326-M330 HydrophobicContact CE2-CE 4.47Å; F326-M330 HydrophobicContact CZ-CE 4.05Å; F326-M330 WeakPolarHBondContact O-CB 3.11Å; F326-M330 PolarHBondContact O-N 2.96Å
327	S	90.8	Very high	91.3	Very high	31 Å²	31	57 Å²	57	22%	0.217	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-39.1	179.9	58.9	0	0	0	0	112.5	F323 L324 M330 A331	F323-S327 WeakPolarHBondContact O-CB 3.32Å; F323-S327 PolarHBondContact O-N 3.23Å; F323-S327 PolarHBondContact O-OG 3.33Å; L324-S327 PolarHBondContact O-N 2.97Å; L324-S327 PolarHBondContact O-OG 3.46Å; S327-M330 PolarHBondContact O-N 3.39Å; S327-A331 WeakPolarHBondContact O-CB 3.17Å; S327-A331 PolarHBondContact O-N 3.35Å
328	L	91.8	Very high	91.9	Very high	34 Å²	34	59 Å²	59	18%	0.178	33%	0.329	C	S	.	.	H	α-helix	trans	-62.2	-46.7	173.7	-170.1	86.7	0	0	0	111.5	L324 M330 A331 I332 M365 V394 I395	L324-L328 VanDerWaalsContact O-CB 3.28Å; L324-L328 WeakPolarHBondContact O-CB 3.43Å; L324-L328 PolarHBondContact O-N 3.44Å; L328-M330 PolarHBondContact O-N 3.45Å; L328-A331 PolarHBondContact O-N 3.19Å; L328-I332 HydrophobicContact CD2-CD1 4.01Å; L328-I332 HydrophobicContact CG-CD1 3.87Å; L328-I332 WeakPolarHBondContact O-CD1 3.37Å; L328-I332 VanDerWaalsContact O-CG1 3.26Å; L328-I332 WeakPolarHBondContact O-CG1 3.3Å; L328-I332 PolarHBondContact O-N 3.13Å; L328-M365 HydrophobicContact CD1-CE 4.42Å; L328-V394 HydrophobicContact CD1-CG1 4.31Å; L328-I395 HydrophobicContact CD1-CD1 4.36Å; L328-I395 HydrophobicContact CD1-CG1 4.05Å
329	T	93.9	Very high	92.4	Very high	76 Å²	76	56.6 Å²	56.6	47%	0.466	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-44.1	179.4	-58.1	0	0	0	0	111.2	L325 F326 A331 I332 I333	L325-T329 VanDerWaalsContact O-CB 3.31Å; L325-T329 WeakPolarHBondContact O-CB 3.35Å; L325-T329 PolarHBondContact O-N 3.38Å; L325-T329 PolarHBondContact O-OG1 2.95Å; F326-T329 PolarHBondContact O-N 3.02Å; T329-A331 PolarHBondContact O-N 2.9Å; T329-I332 PolarHBondContact O-N 3.48Å; T329-I333 HydrophobicContact CG2-CD1 4.06Å; T329-I333 WeakPolarHBondContact O-CG1 3.41Å; T329-I333 PolarHBondContact O-N 3.14Å
330	M	94.6	Very high	92.9	Very high	90 Å²	90	53.5 Å²	53.5	44%	0.443	28%	0.283	S	S	.	.	H	α-helix	trans	-58.9	-47.4	175.7	-174.4	66	74.4	0	0	111.4	F326 S327 L328 I333 I334	F326-M330 HydrophobicContact CE2-CE 4.47Å; F326-M330 HydrophobicContact CZ-CE 4.05Å; F326-M330 WeakPolarHBondContact O-CB 3.11Å; F326-M330 PolarHBondContact O-N 2.96Å; S327-M330 PolarHBondContact O-N 3.39Å; L328-M330 PolarHBondContact O-N 3.45Å; M330-I333 PolarHBondContact O-N 3.39Å; M330-I334 HydrophobicContact CG-CD1 4.01Å; M330-I334 WeakPolarHBondContact O-CG1 3.46Å; M330-I334 PolarHBondContact O-N 2.88Å; M330-I334 VanDerWaalsContact O-N 3.08Å; M330-I334 HydrophobicContact SD-CD1 4.42Å
331	A	94	Very high	93.4	Very high	13 Å²	13	57.4 Å²	57.4	11%	0.107	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-40.9	178.5	0	0	0	0	0	112.4	S327 L328 T329 I333 I334 F335 M365	S327-A331 WeakPolarHBondContact O-CB 3.17Å; S327-A331 PolarHBondContact O-N 3.35Å; L328-A331 PolarHBondContact O-N 3.19Å; T329-A331 PolarHBondContact O-N 2.9Å; A331-I333 VanDerWaalsContact C-N 3.33Å; A331-I333 PolarHBondContact O-N 3.46Å; A331-I334 PolarHBondContact O-N 2.87Å; A331-F335 HydrophobicContact CB-CD2 4.41Å; A331-F335 VanDerWaalsContact O-CD2 3.23Å; A331-F335 WeakPolarHBondContact O-CD2 3.25Å; A331-F335 PolarHBondContact O-N 2.58Å; A331-M365 HydrophobicContact CB-CE 3.54Å; A331-M365 HydrophobicContact CB-SD 4.19Å
332	I	95.9	Very high	93.7	Very high	20 Å²	20	55.6 Å²	55.6	10%	0.103	29%	0.29	C	S	.	.	H	α-helix	trans	-58	-46.4	174.9	-70.9	160.8	0	0	0	110.5	L328 T329 I334 A336 F358 T361 I362 M365	L328-I332 HydrophobicContact CD2-CD1 4.01Å; L328-I332 HydrophobicContact CG-CD1 3.87Å; L328-I332 WeakPolarHBondContact O-CD1 3.37Å; L328-I332 VanDerWaalsContact O-CG1 3.26Å; L328-I332 WeakPolarHBondContact O-CG1 3.3Å; L328-I332 PolarHBondContact O-N 3.13Å; T329-I332 PolarHBondContact O-N 3.48Å; I332-I334 PolarHBondContact O-N 2.7Å; I332-A336 WeakPolarHBondContact O-CB 3.48Å; I332-A336 PolarHBondContact O-N 3.45Å; I332-F358 HydrophobicContact CG2-CB 4.3Å; I332-F358 HydrophobicContact CG2-CD1 3.65Å; I332-F358 HydrophobicContact CG2-CE1 4.28Å; I332-F358 HydrophobicContact CG2-CG 4.15Å; I332-T361 HydrophobicContact CB-CG2 4.32Å; I332-T361 HydrophobicContact CG1-CG2 4.3Å; I332-T361 HydrophobicContact CG2-CG2 4.29Å; I332-I362 HydrophobicContact CD1-CG1 3.73Å; I332-I362 HydrophobicContact CG1-CG1 4.14Å; I332-I362 HydrophobicContact CG2-CG1 4.17Å; I332-M365 HydrophobicContact CG1-SD 4.01Å
333	I	96.9	Very high	93.9	Very high	78 Å²	78	54 Å²	54	40%	0.4	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-46.2	179.9	-67.8	166.8	0	0	0	111.2	T329 M330 A331 T337 F358	T329-I333 HydrophobicContact CG2-CD1 4.06Å; T329-I333 WeakPolarHBondContact O-CG1 3.41Å; T329-I333 PolarHBondContact O-N 3.14Å; M330-I333 PolarHBondContact O-N 3.39Å; A331-I333 VanDerWaalsContact C-N 3.33Å; A331-I333 PolarHBondContact O-N 3.46Å; I333-T337 WeakPolarHBondContact O-CB 3.44Å; I333-T337 PolarHBondContact O-N 3.04Å; I333-T337 VanDerWaalsContact O-N 3.11Å; I333-T337 PolarHBondContact O-OG1 3.35Å; I333-F358 HydrophobicContact CG1-CE1 4.22Å; I333-F358 HydrophobicContact CG1-CZ 4.21Å
334	I	96.6	Very high	94	Very high	90 Å²	90	54.1 Å²	54.1	46%	0.462	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-54.8	-179.3	-66.9	166.6	0	0	0	110.5	M330 A331 I332 A336 T337 V338	M330-I334 HydrophobicContact CG-CD1 4.01Å; M330-I334 WeakPolarHBondContact O-CG1 3.46Å; M330-I334 PolarHBondContact O-N 2.88Å; M330-I334 VanDerWaalsContact O-N 3.08Å; M330-I334 HydrophobicContact SD-CD1 4.42Å; A331-I334 PolarHBondContact O-N 2.87Å; I332-I334 PolarHBondContact O-N 2.7Å; I334-A336 PolarHBondContact O-N 3.39Å; I334-T337 PolarHBondContact O-N 2.92Å; I334-V338 WeakPolarHBondContact O-CG2 3.16Å; I334-V338 PolarHBondContact O-N 2.93Å
335	F	96.3	Very high	93.6	Very high	34 Å²	34	57 Å²	57	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-67.8	-37.3	-176	-75.8	-65	0	0	0	112.5	A331 T337 V338 M339 T361 M365 I386 C387 S390	A331-F335 HydrophobicContact CB-CD2 4.41Å; A331-F335 VanDerWaalsContact O-CD2 3.23Å; A331-F335 WeakPolarHBondContact O-CD2 3.25Å; A331-F335 PolarHBondContact O-N 2.58Å; F335-T337 VanDerWaalsContact C-N 3.31Å; F335-T337 PolarHBondContact O-N 3.38Å; F335-V338 PolarHBondContact O-N 3.37Å; F335-M339 VanDerWaalsContact O-CB 3.3Å; F335-M339 WeakPolarHBondContact O-CB 3.47Å; F335-M339 WeakPolarHBondContact O-CG 3.39Å; F335-M339 PolarHBondContact O-N 2.85Å; F335-T361 HydrophobicContact CB-CG2 3.71Å; F335-M365 HydrophobicContact CD2-SD 4.16Å; F335-I386 HydrophobicContact CE1-CG2 4.06Å; F335-I386 HydrophobicContact CZ-CG2 4.35Å; F335-C387 HydrophobicContact CB-CB 4.36Å; F335-C387 HydrophobicContact CD1-CB 3.68Å; F335-C387 HydrophobicContact CE1-CB 4.09Å; F335-C387 HydrophobicContact CG-CB 3.95Å; F335-S390 WeakPolarHBondContact CE2-OG 3.26Å; F335-S390 WeakPolarHBondContact CZ-OG 3.33Å
336	A	96.9	Very high	93.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-37.4	175.8	0	0	0	0	0	112.4	I332 I334 F340 S357 F358 T361	I332-A336 WeakPolarHBondContact O-CB 3.48Å; I332-A336 PolarHBondContact O-N 3.45Å; I334-A336 PolarHBondContact O-N 3.39Å; A336-F340 WeakPolarHBondContact O-CB 3.41Å; A336-F340 PolarHBondContact O-N 2.71Å; A336-S357 WeakPolarHBondContact O-CB 3.4Å; A336-F358 HydrophobicContact CB-CD1 3.36Å; A336-F358 HydrophobicContact CB-CE1 3.72Å; A336-T361 WeakPolarHBondContact CA-OG1 3.43Å; A336-T361 PolarHBondContact N-OG1 3.48Å
337	T	96.9	Very high	92.5	Very high	45 Å²	45	54.5 Å²	54.5	28%	0.276	32%	0.315	S	S	.	.	H	α-helix	trans	-65.9	-47.5	175.2	-56.4	0	0	0	0	110.9	I333 I334 F335 M339 F340 Y341 I354	I333-T337 WeakPolarHBondContact O-CB 3.44Å; I333-T337 PolarHBondContact O-N 3.04Å; I333-T337 VanDerWaalsContact O-N 3.11Å; I333-T337 PolarHBondContact O-OG1 3.35Å; I334-T337 PolarHBondContact O-N 2.92Å; F335-T337 VanDerWaalsContact C-N 3.31Å; F335-T337 PolarHBondContact O-N 3.38Å; T337-M339 PolarHBondContact O-N 3.31Å; T337-F340 PolarHBondContact O-N 3.44Å; T337-Y341 HydrophobicContact CG2-CD2 3.93Å; T337-Y341 HydrophobicContact CG2-CE2 3.82Å; T337-Y341 VanDerWaalsContact O-CD2 3.24Å; T337-Y341 WeakPolarHBondContact O-CD2 3.36Å; T337-Y341 PolarHBondContact O-N 3.23Å; T337-Y341 VanDerWaalsContact O-N 3.14Å; T337-I354 HydrophobicContact CG2-CD1 4.45Å
338	V	96.1	Very high	92	Very high	48 Å²	48	56.3 Å²	56.3	29%	0.291	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-45.9	176.7	172.3	0	0	0	0	111.2	I334 F335 F340 Y341 A342 F383	I334-V338 WeakPolarHBondContact O-CG2 3.16Å; I334-V338 PolarHBondContact O-N 2.93Å; F335-V338 PolarHBondContact O-N 3.37Å; V338-F340 PolarHBondContact O-N 2.93Å; V338-Y341 PolarHBondContact O-N 3.2Å; V338-A342 VanDerWaalsContact O-CB 3.31Å; V338-A342 WeakPolarHBondContact O-CB 3.1Å; V338-A342 PolarHBondContact O-N 3.27Å; V338-F383 HydrophobicContact CG1-CB 3.99Å; V338-F383 HydrophobicContact CG1-CD1 3.59Å; V338-F383 HydrophobicContact CG1-CD2 3.8Å; V338-F383 HydrophobicContact CG1-CE1 3.95Å; V338-F383 HydrophobicContact CG1-CE2 4.16Å; V338-F383 HydrophobicContact CG1-CG 3.52Å; V338-F383 HydrophobicContact CG1-CZ 4.22Å
339	M	95.6	Very high	91.7	Very high	1 Å²	1	56 Å²	56	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-42.5	178.9	-75	-53.8	-53.8	0	0	112.4	F335 T337 Y341 A342 E343 F351 Y360 P375 F383	F335-M339 VanDerWaalsContact O-CB 3.3Å; F335-M339 WeakPolarHBondContact O-CB 3.47Å; F335-M339 WeakPolarHBondContact O-CG 3.39Å; F335-M339 PolarHBondContact O-N 2.85Å; T337-M339 PolarHBondContact O-N 3.31Å; M339-Y341 PolarHBondContact O-N 2.83Å; M339-A342 PolarHBondContact O-N 3.07Å; M339-E343 HydrophobicContact CE-CG 4.23Å; M339-E343 WeakPolarHBondContact O-CB 3.12Å; M339-E343 PolarHBondContact O-N 3.22Å; M339-F351 HydrophobicContact CB-CE1 4.31Å; M339-F351 HydrophobicContact CE-CE1 4.3Å; M339-F351 HydrophobicContact CE-CZ 3.98Å; M339-Y360 HydrophobicContact CE-CD1 4.46Å; M339-Y360 HydrophobicContact CE-CE1 3.81Å; M339-Y360 HydrophobicContact CG-CD1 4.19Å; M339-Y360 HydrophobicContact CG-CE1 3.94Å; M339-Y360 HydrophobicContact SD-CE1 4.14Å; M339-P375 HydrophobicContact CE-CB 3.73Å; M339-P375 HydrophobicContact CE-CG 4.11Å; M339-F383 HydrophobicContact SD-CB 3.89Å
340	F	95.8	Very high	91.5	Very high	29 Å²	29	58.5 Å²	58.5	13%	0.127	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-49.2	175.6	173	-106.6	0	0	0	111.3	A336 T337 V338 E343 K344 I354	A336-F340 WeakPolarHBondContact O-CB 3.41Å; A336-F340 PolarHBondContact O-N 2.71Å; T337-F340 PolarHBondContact O-N 3.44Å; V338-F340 PolarHBondContact O-N 2.93Å; F340-E343 PolarHBondContact O-N 3.09Å; F340-K344 HydrophobicContact CE1-CD 4.28Å; F340-K344 HydrophobicContact CZ-CD 4.35Å; F340-K344 WeakPolarHBondContact O-CB 3.46Å; F340-K344 PolarHBondContact O-N 3.15Å; F340-I354 HydrophobicContact CB-CG1 4.22Å; F340-I354 HydrophobicContact CD1-CG1 3.9Å; F340-I354 HydrophobicContact CE1-CG1 4.48Å; F340-I354 HydrophobicContact CG-CG1 4.03Å
341	Y	95.6	Very high	91.4	Very high	141 Å²	141	54.6 Å²	54.6	55%	0.553	32%	0.317	S	S	*	.	H	α-helix	trans	-70.7	-34.5	-179.7	-77	-67.7	0	0	0	113.4	T337 V338 M339 E343 K344	T337-Y341 HydrophobicContact CG2-CD2 3.93Å; T337-Y341 HydrophobicContact CG2-CE2 3.82Å; T337-Y341 VanDerWaalsContact O-CD2 3.24Å; T337-Y341 WeakPolarHBondContact O-CD2 3.36Å; T337-Y341 PolarHBondContact O-N 3.23Å; T337-Y341 VanDerWaalsContact O-N 3.14Å; V338-Y341 PolarHBondContact O-N 3.2Å; M339-Y341 PolarHBondContact O-N 2.83Å; Y341-E343 VanDerWaalsContact C-N 3.29Å; Y341-E343 PolarHBondContact O-N 3.21Å; Y341-K344 HydrophobicContact CD1-CD 4.26Å; Y341-K344 HydrophobicContact CE1-CD 4.48Å
342	A	94.4	Very high	91.3	Very high	21 Å²	21	59.3 Å²	59.3	17%	0.174	35%	0.345	C	S	.	.	H	α-helix	trans	-64.3	-34.1	175.8	0	0	0	0	0	112.5	V338 M339 T377 A379 F383	V338-A342 VanDerWaalsContact O-CB 3.31Å; V338-A342 WeakPolarHBondContact O-CB 3.1Å; V338-A342 PolarHBondContact O-N 3.27Å; M339-A342 PolarHBondContact O-N 3.07Å; A342-T377 PolarHBondContact O-OG1 2.86Å; A342-A379 HydrophobicContact CB-CB 4.36Å; A342-F383 HydrophobicContact CB-CD2 4.11Å
343	E	93.5	Very high	91.2	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-100.6	-4.6	-176.1	-66.9	-72.8	137.5	0	0	114.2	M339 F340 Y341 G345 S346 F351 P375 K376 T377 G380	M339-E343 HydrophobicContact CE-CG 4.23Å; M339-E343 WeakPolarHBondContact O-CB 3.12Å; M339-E343 PolarHBondContact O-N 3.22Å; F340-E343 PolarHBondContact O-N 3.09Å; Y341-E343 VanDerWaalsContact C-N 3.29Å; Y341-E343 PolarHBondContact O-N 3.21Å; E343-G345 PolarHBondContact O-N 3.16Å; E343-G345 VanDerWaalsContact O-N 3.07Å; E343-S346 PolarHBondContact O-N 3.04Å; E343-S346 VanDerWaalsContact O-N 3.17Å; E343-F351 HydrophobicContact CB-CB 4.11Å; E343-F351 HydrophobicContact CB-CD2 3.7Å; E343-F351 HydrophobicContact CB-CE2 4.42Å; E343-F351 HydrophobicContact CB-CG 4.07Å; E343-F351 HydrophobicContact CG-CD2 3.62Å; E343-F351 HydrophobicContact CG-CE2 3.84Å; E343-F351 HydrophobicContact CG-CG 4.27Å; E343-P375 HydrophobicContact CG-CB 4.28Å; E343-P375 WeakPolarHBondContact OE1-CA 3.45Å; E343-P375 VanDerWaalsContact OE1-CB 3.23Å; E343-P375 WeakPolarHBondContact OE1-CB 3.41Å; E343-K376 PolarHBondContact OE1-N 3.3Å; E343-K376 PolarHBondContact OE2-N 3.26Å; E343-T377 VanDerWaalsContact OE1-CB 3.28Å; E343-T377 WeakPolarHBondContact OE1-CB 3.27Å; E343-T377 PolarHBondContact OE1-N 3.32Å; E343-T377 PolarHBondContact OE1-OG1 2.9Å; E343-T377 PolarHBondContact OE2-N 3.02Å; E343-G380 WeakPolarHBondContact OE1-CA 3.37Å
344	K	88.7	Confident	91.2	Very high	139 Å²	139	59.4 Å²	59.4	60%	0.604	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.3	-177.4	-169.3	173.8	-179.8	-179	0	114	F340 Y341	F340-K344 HydrophobicContact CE1-CD 4.28Å; F340-K344 HydrophobicContact CZ-CD 4.35Å; F340-K344 WeakPolarHBondContact O-CB 3.46Å; F340-K344 PolarHBondContact O-N 3.15Å; Y341-K344 HydrophobicContact CD1-CD 4.26Å; Y341-K344 HydrophobicContact CE1-CD 4.48Å
345	G	79	Confident	91.1	Very high	82 Å²	82	59.1 Å²	59.1	85%	0.845	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.1	-178	0	0	0	0	0	115.8	E343	E343-G345 PolarHBondContact O-N 3.16Å; E343-G345 VanDerWaalsContact O-N 3.07Å
346	S	83.8	Confident	91	Very high	37 Å²	37	58.8 Å²	58.8	26%	0.259	36%	0.357	S	S	.	.			trans	-105.5	124	-177.5	-172.6	0	0	0	0	111.9	E343 A348 S349	E343-S346 PolarHBondContact O-N 3.04Å; E343-S346 VanDerWaalsContact O-N 3.17Å; S346-A348 PolarHBondContact O-N 3.1Å; S346-S349 VanDerWaalsContact O-CB 3.22Å; S346-S349 WeakPolarHBondContact O-CB 3.31Å; S346-S349 PolarHBondContact O-N 3.22Å
347	S	75.8	Confident	91	Very high	136 Å²	136	58.8 Å²	58.8	95%	0.951	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-15.5	177.7	48.2	0	0	0	0	114.3
348	A	79.6	Confident	90.9	Very high	69 Å²	69	59.8 Å²	59.8	57%	0.57	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	10	176.8	0	0	0	0	0	113.4	S346	S346-A348 PolarHBondContact O-N 3.1Å
349	S	85.6	Confident	91	Very high	27 Å²	27	62.9 Å²	62.9	19%	0.189	36%	0.364	C	S	.	.			trans	-79.9	137.1	-178.8	173.7	0	0	0	0	111.9	S346 F351	S346-S349 VanDerWaalsContact O-CB 3.22Å; S346-S349 WeakPolarHBondContact O-CB 3.31Å; S346-S349 PolarHBondContact O-N 3.22Å; S349-F351 VanDerWaalsContact C-N 3.33Å; S349-F351 WeakPolarHBondContact OG-CB 3.33Å; S349-F351 WeakPolarHBondContact OG-CD2 3.28Å; S349-F351 PolarHBondContact OG-N 3.22Å
350	K	89.8	Confident	91	Very high	129 Å²	129	63.8 Å²	63.8	56%	0.561	37%	0.367	S	S	*	.			trans	-88.6	0.7	170.8	-64.3	-174.5	-178.9	-178	0	112.8	T352 D372 M373	K350-T352 PolarHBondContact O-N 3.46Å; K350-T352 VanDerWaalsContact O-N 3.08Å; K350-D372 VanDerWaalsContact CD-O 3.29Å; K350-D372 WeakPolarHBondContact CD-O 3.34Å; K350-D372 WeakPolarHBondContact CE-O 3.33Å; K350-D372 PolarHBondContact NZ-O 3.23Å; K350-M373 HydrophobicContact CB-CE 4.16Å; K350-M373 HydrophobicContact CB-CG 4.14Å; K350-M373 HydrophobicContact CD-CG 4.23Å; K350-M373 WeakPolarHBondContact O-CE 3.45Å
351	F	91.7	Very high	91	Very high	8 Å²	8	62.4 Å²	62.4	4%	0.035	36%	0.361	C	S	.	.			trans	-83.6	77.3	-177.5	-63	-88.8	0	0	0	111	M339 E343 S349 S357 Y360 M373	M339-F351 HydrophobicContact CB-CE1 4.31Å; M339-F351 HydrophobicContact CE-CE1 4.3Å; M339-F351 HydrophobicContact CE-CZ 3.98Å; E343-F351 HydrophobicContact CB-CB 4.11Å; E343-F351 HydrophobicContact CB-CD2 3.7Å; E343-F351 HydrophobicContact CB-CE2 4.42Å; E343-F351 HydrophobicContact CB-CG 4.07Å; E343-F351 HydrophobicContact CG-CD2 3.62Å; E343-F351 HydrophobicContact CG-CE2 3.84Å; E343-F351 HydrophobicContact CG-CG 4.27Å; S349-F351 VanDerWaalsContact C-N 3.33Å; S349-F351 WeakPolarHBondContact OG-CB 3.33Å; S349-F351 WeakPolarHBondContact OG-CD2 3.28Å; S349-F351 PolarHBondContact OG-N 3.22Å; F351-S357 WeakPolarHBondContact CD1-OG 3.32Å; F351-Y360 AromaticContact CE1-CD1 3.61Å; F351-Y360 HydrophobicContact CE1-CD1 3.61Å; F351-Y360 HydrophobicContact CE1-CD2 4.22Å; F351-Y360 HydrophobicContact CE1-CE1 4.33Å; F351-Y360 AromaticContact CE1-CG 3.54Å; F351-Y360 HydrophobicContact CE1-CG 3.54Å; F351-Y360 AromaticContact CZ-CD1 3.87Å; F351-Y360 HydrophobicContact CZ-CD1 3.87Å; F351-Y360 AromaticContact CZ-CD2 3.91Å; F351-Y360 HydrophobicContact CZ-CD2 3.91Å; F351-Y360 HydrophobicContact CZ-CE1 4.23Å; F351-Y360 HydrophobicContact CZ-CE2 4.25Å; F351-Y360 AromaticContact CZ-CG 3.69Å; F351-Y360 HydrophobicContact CZ-CG 3.69Å; F351-M373 HydrophobicContact CD1-CE 3.99Å; F351-M373 HydrophobicContact CE1-CE 4.18Å; F351-M373 HydrophobicContact CG-CE 4.35Å
352	T	92.5	Very high	91	Very high	112 Å²	112	59 Å²	59	69%	0.687	35%	0.352	S	S	*	.			trans	-79.5	-30.2	-173.1	56.6	0	0	0	0	114.5	K350 A356	K350-T352 PolarHBondContact O-N 3.46Å; K350-T352 VanDerWaalsContact O-N 3.08Å; T352-A356 WeakPolarHBondContact OG1-CB 3.5Å
353	S	94.7	Very high	91.1	Very high	46 Å²	46	58.3 Å²	58.3	32%	0.322	35%	0.346	S	S	.	.	S	Bend	trans	-154.9	162.3	-177.6	65.4	0	0	0	0	110.6	A356 S357	S353-A356 WeakPolarHBondContact O-CB 3.33Å; S353-A356 PolarHBondContact O-N 3.48Å; S353-A356 VanDerWaalsContact O-N 3.11Å; S353-A356 WeakPolarHBondContact OG-CB 3.35Å; S353-A356 PolarHBondContact OG-N 3.16Å; S353-S357 PolarHBondContact O-N 2.91Å; S353-S357 PolarHBondContact O-OG 3.35Å
354	I	95.6	Very high	91.2	Very high	53 Å²	53	59.4 Å²	59.4	27%	0.272	35%	0.352	S	S	.	.	H	α-helix	trans	-58.2	-44.1	177.1	-58.8	171.4	0	0	0	111.5	T337 F340 A356 S357 F358	T337-I354 HydrophobicContact CG2-CD1 4.45Å; F340-I354 HydrophobicContact CB-CG1 4.22Å; F340-I354 HydrophobicContact CD1-CG1 3.9Å; F340-I354 HydrophobicContact CE1-CG1 4.48Å; F340-I354 HydrophobicContact CG-CG1 4.03Å; I354-A356 VanDerWaalsContact C-N 3.34Å; I354-A356 PolarHBondContact O-N 3.3Å; I354-S357 WeakPolarHBondContact O-CA 3.26Å; I354-S357 VanDerWaalsContact O-CB 3.32Å; I354-S357 WeakPolarHBondContact O-CB 3.48Å; I354-S357 PolarHBondContact O-N 3.25Å; I354-S357 VanDerWaalsContact O-N 3.09Å; I354-F358 HydrophobicContact CG2-CE1 3.94Å; I354-F358 HydrophobicContact CG2-CZ 4.21Å; I354-F358 PolarHBondContact O-N 3.33Å; I354-F358 VanDerWaalsContact O-N 3.1Å
355	P	96	Very high	91.4	Very high	85 Å²	85	52.8 Å²	52.8	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-63.3	-35.1	173.7	-24.8	36.3	0	0	0	114	S357 F358	P355-S357 VanDerWaalsContact C-N 3.28Å; P355-S357 PolarHBondContact O-N 3.25Å; P355-F358 HydrophobicContact CB-CD2 4.3Å; P355-F358 HydrophobicContact CB-CE2 4.49Å; P355-F358 VanDerWaalsContact O-CB 3.3Å; P355-F358 WeakPolarHBondContact O-CB 3.43Å; P355-F358 PolarHBondContact O-N 3.28Å; P355-F358 VanDerWaalsContact O-N 3.15Å
356	A	94	Very high	92.1	Very high	27 Å²	27	51.1 Å²	51.1	22%	0.223	30%	0.297	C	S	.	.	H	α-helix	trans	-65.1	-34.9	172.7	0	0	0	0	0	111.5	T352 S353 I354 F358 W359	T352-A356 WeakPolarHBondContact OG1-CB 3.5Å; S353-A356 WeakPolarHBondContact O-CB 3.33Å; S353-A356 PolarHBondContact O-N 3.48Å; S353-A356 VanDerWaalsContact O-N 3.11Å; S353-A356 WeakPolarHBondContact OG-CB 3.35Å; S353-A356 PolarHBondContact OG-N 3.16Å; I354-A356 VanDerWaalsContact C-N 3.34Å; I354-A356 PolarHBondContact O-N 3.3Å; A356-F358 VanDerWaalsContact C-N 3.29Å; A356-F358 PolarHBondContact O-N 3.13Å; A356-W359 PolarHBondContact O-N 3.15Å
357	S	95.6	Very high	92.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-25	172.6	-57	0	0	0	0	113.2	A336 F351 S353 I354 P355 W359 Y360 T361	A336-S357 WeakPolarHBondContact O-CB 3.4Å; F351-S357 WeakPolarHBondContact CD1-OG 3.32Å; S353-S357 PolarHBondContact O-N 2.91Å; S353-S357 PolarHBondContact O-OG 3.35Å; I354-S357 WeakPolarHBondContact O-CA 3.26Å; I354-S357 VanDerWaalsContact O-CB 3.32Å; I354-S357 WeakPolarHBondContact O-CB 3.48Å; I354-S357 PolarHBondContact O-N 3.25Å; I354-S357 VanDerWaalsContact O-N 3.09Å; P355-S357 VanDerWaalsContact C-N 3.28Å; P355-S357 PolarHBondContact O-N 3.25Å; S357-W359 VanDerWaalsContact C-N 3.25Å; S357-W359 PolarHBondContact O-N 3.1Å; S357-Y360 PolarHBondContact O-N 3.25Å; S357-T361 PolarHBondContact O-N 3Å; S357-T361 PolarHBondContact O-OG1 2.85Å
358	F	96.8	Very high	93.6	Very high	65 Å²	65	52.5 Å²	52.5	29%	0.285	29%	0.294	S	S	.	.	H	α-helix	trans	-57.7	-39.5	173.9	-66.5	-24.2	0	0	0	111.7	I332 I333 A336 I354 P355 A356 Y360 T361 I362	I332-F358 HydrophobicContact CG2-CB 4.3Å; I332-F358 HydrophobicContact CG2-CD1 3.65Å; I332-F358 HydrophobicContact CG2-CE1 4.28Å; I332-F358 HydrophobicContact CG2-CG 4.15Å; I333-F358 HydrophobicContact CG1-CE1 4.22Å; I333-F358 HydrophobicContact CG1-CZ 4.21Å; A336-F358 HydrophobicContact CB-CD1 3.36Å; A336-F358 HydrophobicContact CB-CE1 3.72Å; I354-F358 HydrophobicContact CG2-CE1 3.94Å; I354-F358 HydrophobicContact CG2-CZ 4.21Å; I354-F358 PolarHBondContact O-N 3.33Å; I354-F358 VanDerWaalsContact O-N 3.1Å; P355-F358 HydrophobicContact CB-CD2 4.3Å; P355-F358 HydrophobicContact CB-CE2 4.49Å; P355-F358 VanDerWaalsContact O-CB 3.3Å; P355-F358 WeakPolarHBondContact O-CB 3.43Å; P355-F358 PolarHBondContact O-N 3.28Å; P355-F358 VanDerWaalsContact O-N 3.15Å; A356-F358 VanDerWaalsContact C-N 3.29Å; A356-F358 PolarHBondContact O-N 3.13Å; F358-Y360 PolarHBondContact O-N 3.05Å; F358-T361 PolarHBondContact O-N 2.96Å; F358-I362 HydrophobicContact CB-CD1 4.29Å; F358-I362 VanDerWaalsContact O-CB 3.32Å; F358-I362 WeakPolarHBondContact O-CB 3.31Å; F358-I362 WeakPolarHBondContact O-CD1 3.33Å; F358-I362 WeakPolarHBondContact O-CG1 3.29Å; F358-I362 PolarHBondContact O-N 3.39Å
359	W	96.5	Very high	94.3	Very high	114 Å²	114	51.7 Å²	51.7	43%	0.432	29%	0.293	S	S	.	.	H	α-helix	trans	-57.7	-51.8	177.6	173.6	-109.8	0	0	0	111.5	A356 S357 T361 I362 V363 Y370 D372	A356-W359 PolarHBondContact O-N 3.15Å; S357-W359 VanDerWaalsContact C-N 3.25Å; S357-W359 PolarHBondContact O-N 3.1Å; W359-T361 PolarHBondContact O-N 3.39Å; W359-I362 PolarHBondContact O-N 2.94Å; W359-V363 HydrophobicContact CD2-CG2 4.04Å; W359-V363 HydrophobicContact CE3-CG2 4.21Å; W359-V363 HydrophobicContact CH2-CG2 4.14Å; W359-V363 HydrophobicContact CZ2-CG2 3.96Å; W359-V363 HydrophobicContact CZ3-CG2 4.26Å; W359-V363 WeakPolarHBondContact O-CB 3.35Å; W359-V363 VanDerWaalsContact O-CG2 3.23Å; W359-V363 WeakPolarHBondContact O-CG2 3.5Å; W359-V363 PolarHBondContact O-N 2.94Å; W359-Y370 HydrophobicContact CH2-CD2 4.13Å; W359-Y370 AromaticContact CH2-CE2 3.79Å; W359-Y370 HydrophobicContact CH2-CE2 3.79Å; W359-Y370 AromaticContact CZ2-CD2 3.69Å; W359-Y370 HydrophobicContact CZ2-CD2 3.69Å; W359-Y370 AromaticContact CZ2-CE2 3.85Å; W359-Y370 HydrophobicContact CZ2-CE2 3.85Å; W359-D372 PolarHBondContact NE1-OD2 2.66Å
360	Y	95.8	Very high	94.7	Very high	19 Å²	19	57.4 Å²	57.4	8%	0.075	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-47.5	175.6	170.5	-97.4	0	0	0	112	M339 F351 S357 F358 V363 T364 M373 P375	M339-Y360 HydrophobicContact CE-CD1 4.46Å; M339-Y360 HydrophobicContact CE-CE1 3.81Å; M339-Y360 HydrophobicContact CG-CD1 4.19Å; M339-Y360 HydrophobicContact CG-CE1 3.94Å; M339-Y360 HydrophobicContact SD-CE1 4.14Å; F351-Y360 AromaticContact CE1-CD1 3.61Å; F351-Y360 HydrophobicContact CE1-CD1 3.61Å; F351-Y360 HydrophobicContact CE1-CD2 4.22Å; F351-Y360 HydrophobicContact CE1-CE1 4.33Å; F351-Y360 AromaticContact CE1-CG 3.54Å; F351-Y360 HydrophobicContact CE1-CG 3.54Å; F351-Y360 AromaticContact CZ-CD1 3.87Å; F351-Y360 HydrophobicContact CZ-CD1 3.87Å; F351-Y360 AromaticContact CZ-CD2 3.91Å; F351-Y360 HydrophobicContact CZ-CD2 3.91Å; F351-Y360 HydrophobicContact CZ-CE1 4.23Å; F351-Y360 HydrophobicContact CZ-CE2 4.25Å; F351-Y360 AromaticContact CZ-CG 3.69Å; F351-Y360 HydrophobicContact CZ-CG 3.69Å; S357-Y360 PolarHBondContact O-N 3.25Å; F358-Y360 PolarHBondContact O-N 3.05Å; Y360-V363 PolarHBondContact O-N 3.43Å; Y360-T364 WeakPolarHBondContact CE2-OG1 3.31Å; Y360-T364 VanDerWaalsContact O-CB 3.24Å; Y360-T364 WeakPolarHBondContact O-CB 3.43Å; Y360-T364 PolarHBondContact O-N 3.06Å; Y360-T364 PolarHBondContact O-OG1 3.16Å; Y360-M373 HydrophobicContact CD2-CB 4.26Å; Y360-M373 VanDerWaalsContact CD2-O 3.23Å; Y360-M373 WeakPolarHBondContact CD2-O 3.48Å; Y360-P375 WeakPolarHBondContact OH-CD 3.47Å
361	T	96.1	Very high	94.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-41.7	-177.2	-61.7	0	0	0	0	112	I332 F335 A336 S357 F358 W359 T364 M365	I332-T361 HydrophobicContact CB-CG2 4.32Å; I332-T361 HydrophobicContact CG1-CG2 4.3Å; I332-T361 HydrophobicContact CG2-CG2 4.29Å; F335-T361 HydrophobicContact CB-CG2 3.71Å; A336-T361 WeakPolarHBondContact CA-OG1 3.43Å; A336-T361 PolarHBondContact N-OG1 3.48Å; S357-T361 PolarHBondContact O-N 3Å; S357-T361 PolarHBondContact O-OG1 2.85Å; F358-T361 PolarHBondContact O-N 2.96Å; W359-T361 PolarHBondContact O-N 3.39Å; T361-T364 PolarHBondContact O-N 2.92Å; T361-M365 HydrophobicContact CG2-CG 4.07Å; T361-M365 HydrophobicContact CG2-SD 3.72Å; T361-M365 VanDerWaalsContact O-CB 3.24Å; T361-M365 WeakPolarHBondContact O-CB 3.2Å; T361-M365 VanDerWaalsContact O-CG 3.27Å; T361-M365 WeakPolarHBondContact O-CG 3.32Å; T361-M365 PolarHBondContact O-N 2.91Å
362	I	95.8	Very high	94.9	Very high	71 Å²	71	56.3 Å²	56.3	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-51.2	175.5	-70.2	163.6	0	0	0	109.9	I332 F358 W359 T364 M365 T366	I332-I362 HydrophobicContact CD1-CG1 3.73Å; I332-I362 HydrophobicContact CG1-CG1 4.14Å; I332-I362 HydrophobicContact CG2-CG1 4.17Å; F358-I362 HydrophobicContact CB-CD1 4.29Å; F358-I362 VanDerWaalsContact O-CB 3.32Å; F358-I362 WeakPolarHBondContact O-CB 3.31Å; F358-I362 WeakPolarHBondContact O-CD1 3.33Å; F358-I362 WeakPolarHBondContact O-CG1 3.29Å; F358-I362 PolarHBondContact O-N 3.39Å; W359-I362 PolarHBondContact O-N 2.94Å; I362-T364 VanDerWaalsContact C-N 3.29Å; I362-T364 PolarHBondContact O-N 3.41Å; I362-M365 PolarHBondContact O-N 3.41Å; I362-T366 WeakPolarHBondContact O-CB 3.47Å; I362-T366 VanDerWaalsContact O-CG2 3.32Å; I362-T366 WeakPolarHBondContact O-CG2 3.33Å; I362-T366 PolarHBondContact O-N 3.24Å; I362-T366 PolarHBondContact O-OG1 3.46Å
363	V	96.1	Very high	94.9	Very high	6 Å²	6	52 Å²	52	4%	0.036	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-35.4	-179.2	169.7	0	0	0	0	111.9	W359 Y360 T367 L368 G369 Y370	W359-V363 HydrophobicContact CD2-CG2 4.04Å; W359-V363 HydrophobicContact CE3-CG2 4.21Å; W359-V363 HydrophobicContact CH2-CG2 4.14Å; W359-V363 HydrophobicContact CZ2-CG2 3.96Å; W359-V363 HydrophobicContact CZ3-CG2 4.26Å; W359-V363 WeakPolarHBondContact O-CB 3.35Å; W359-V363 VanDerWaalsContact O-CG2 3.23Å; W359-V363 WeakPolarHBondContact O-CG2 3.5Å; W359-V363 PolarHBondContact O-N 2.94Å; Y360-V363 PolarHBondContact O-N 3.43Å; V363-T367 PolarHBondContact O-N 2.83Å; V363-L368 HydrophobicContact CG1-CB 4.05Å; V363-L368 PolarHBondContact O-N 3.2Å; V363-G369 VanDerWaalsContact CG1-N 3.3Å; V363-G369 PolarHBondContact O-N 3.04Å; V363-Y370 HydrophobicContact CB-CD2 4.38Å; V363-Y370 HydrophobicContact CG1-CD2 3.68Å; V363-Y370 HydrophobicContact CG1-CE2 4.33Å; V363-Y370 HydrophobicContact CG1-CG 4.24Å; V363-Y370 HydrophobicContact CG2-CD2 3.68Å; V363-Y370 HydrophobicContact CG2-CE2 3.84Å
364	T	95.3	Very high	94.9	Very high	22 Å²	22	52.7 Å²	52.7	14%	0.135	30%	0.298	C	S	.	.	H	α-helix	trans	-78.2	-45.7	179.6	-56.4	0	0	0	0	112.1	Y360 T361 I362 T366 T367	Y360-T364 WeakPolarHBondContact CE2-OG1 3.31Å; Y360-T364 VanDerWaalsContact O-CB 3.24Å; Y360-T364 WeakPolarHBondContact O-CB 3.43Å; Y360-T364 PolarHBondContact O-N 3.06Å; Y360-T364 PolarHBondContact O-OG1 3.16Å; T361-T364 PolarHBondContact O-N 2.92Å; I362-T364 VanDerWaalsContact C-N 3.29Å; I362-T364 PolarHBondContact O-N 3.41Å; T364-T366 VanDerWaalsContact C-N 3.33Å; T364-T366 PolarHBondContact O-N 3.24Å; T364-T367 PolarHBondContact O-N 3.11Å
365	M	93.9	Very high	94.8	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-68	-32.4	-179.9	-74.3	-173	73	0	0	112.7	L328 A331 I332 F335 T361 I362 T367 G391	L328-M365 HydrophobicContact CD1-CE 4.42Å; A331-M365 HydrophobicContact CB-CE 3.54Å; A331-M365 HydrophobicContact CB-SD 4.19Å; I332-M365 HydrophobicContact CG1-SD 4.01Å; F335-M365 HydrophobicContact CD2-SD 4.16Å; T361-M365 HydrophobicContact CG2-CG 4.07Å; T361-M365 HydrophobicContact CG2-SD 3.72Å; T361-M365 VanDerWaalsContact O-CB 3.24Å; T361-M365 WeakPolarHBondContact O-CB 3.2Å; T361-M365 VanDerWaalsContact O-CG 3.27Å; T361-M365 WeakPolarHBondContact O-CG 3.32Å; T361-M365 PolarHBondContact O-N 2.91Å; I362-M365 PolarHBondContact O-N 3.41Å; M365-T367 PolarHBondContact O-N 2.9Å; M365-G391 CarbonylContact O-C 3.51Å
366	T	93.9	Very high	94.7	Very high	47 Å²	47	52.3 Å²	52.3	29%	0.288	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	6.9	173.1	58.6	0	0	0	0	113.2	I362 T364 L368 I395	I362-T366 WeakPolarHBondContact O-CB 3.47Å; I362-T366 VanDerWaalsContact O-CG2 3.32Å; I362-T366 WeakPolarHBondContact O-CG2 3.33Å; I362-T366 PolarHBondContact O-N 3.24Å; I362-T366 PolarHBondContact O-OG1 3.46Å; T364-T366 VanDerWaalsContact C-N 3.33Å; T364-T366 PolarHBondContact O-N 3.24Å; T366-L368 PolarHBondContact O-N 3.4Å; T366-L368 VanDerWaalsContact O-N 3.12Å; T366-I395 HydrophobicContact CG2-CD1 4.29Å
367	T	94.4	Very high	94.7	Very high	101 Å²	101	52.6 Å²	52.6	62%	0.62	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	25.3	179	70.8	0	0	0	0	114.8	V363 T364 M365 V392	V363-T367 PolarHBondContact O-N 2.83Å; T364-T367 PolarHBondContact O-N 3.11Å; M365-T367 PolarHBondContact O-N 2.9Å; T367-V392 HydrophobicContact CG2-CG2 3.54Å
368	L	95.9	Very high	94.6	Very high	100 Å²	100	59 Å²	59	52%	0.524	32%	0.319	S	S	.	.			trans	-76.6	-48.8	177.8	-69.8	174.1	0	0	0	111.4	V363 T366 Y370	V363-L368 HydrophobicContact CG1-CB 4.05Å; V363-L368 PolarHBondContact O-N 3.2Å; T366-L368 PolarHBondContact O-N 3.4Å; T366-L368 VanDerWaalsContact O-N 3.12Å; L368-Y370 HydrophobicContact CD1-CE2 4.29Å
369	G	94.3	Very high	94.5	Very high	53 Å²	53	57.9 Å²	57.9	55%	0.546	32%	0.322	S	S	.	.			trans	59	51.4	171.4	0	0	0	0	0	116.2	V363 G371	V363-G369 VanDerWaalsContact CG1-N 3.3Å; V363-G369 PolarHBondContact O-N 3.04Å; G369-G371 PolarHBondContact O-N 3.48Å
370	Y	94.6	Very high	94.4	Very high	146 Å²	146	52.5 Å²	52.5	57%	0.573	30%	0.301	S	S	*	.			trans	-55.9	-25.8	179.8	-64.6	-56.6	0	0	0	114.9	W359 V363 L368 D372	W359-Y370 HydrophobicContact CH2-CD2 4.13Å; W359-Y370 AromaticContact CH2-CE2 3.79Å; W359-Y370 HydrophobicContact CH2-CE2 3.79Å; W359-Y370 AromaticContact CZ2-CD2 3.69Å; W359-Y370 HydrophobicContact CZ2-CD2 3.69Å; W359-Y370 AromaticContact CZ2-CE2 3.85Å; W359-Y370 HydrophobicContact CZ2-CE2 3.85Å; V363-Y370 HydrophobicContact CB-CD2 4.38Å; V363-Y370 HydrophobicContact CG1-CD2 3.68Å; V363-Y370 HydrophobicContact CG1-CE2 4.33Å; V363-Y370 HydrophobicContact CG1-CG 4.24Å; V363-Y370 HydrophobicContact CG2-CD2 3.68Å; V363-Y370 HydrophobicContact CG2-CE2 3.84Å; L368-Y370 HydrophobicContact CD1-CE2 4.29Å; Y370-D372 VanDerWaalsContact C-N 3.28Å; Y370-D372 PolarHBondContact O-N 3.35Å
371	G	92.8	Very high	94.4	Very high	49 Å²	49	57.2 Å²	57.2	51%	0.505	32%	0.322	S	S	.	.	S	Bend	trans	79.2	5.6	177.3	0	0	0	0	0	114.9	G369	G369-G371 PolarHBondContact O-N 3.48Å
372	D	93	Very high	94.4	Very high	66 Å²	66	61.8 Å²	61.8	35%	0.353	35%	0.346	S	S	.	.	S	Bend	trans	-70.9	-33.1	176.3	65.8	-46.1	0	0	0	112.4	K350 W359 Y370	K350-D372 VanDerWaalsContact CD-O 3.29Å; K350-D372 WeakPolarHBondContact CD-O 3.34Å; K350-D372 WeakPolarHBondContact CE-O 3.33Å; K350-D372 PolarHBondContact NZ-O 3.23Å; W359-D372 PolarHBondContact NE1-OD2 2.66Å; Y370-D372 VanDerWaalsContact C-N 3.28Å; Y370-D372 PolarHBondContact O-N 3.35Å
373	M	92.8	Very high	94.4	Very high	22 Å²	22	62.3 Å²	62.3	11%	0.108	35%	0.345	C	S	.	.	S	Bend	trans	-122.4	127.5	170	-66.9	-176.1	61.1	0	0	110.1	K350 F351 Y360	K350-M373 HydrophobicContact CB-CE 4.16Å; K350-M373 HydrophobicContact CB-CG 4.14Å; K350-M373 HydrophobicContact CD-CG 4.23Å; K350-M373 WeakPolarHBondContact O-CE 3.45Å; F351-M373 HydrophobicContact CD1-CE 3.99Å; F351-M373 HydrophobicContact CE1-CE 4.18Å; F351-M373 HydrophobicContact CG-CE 4.35Å; Y360-M373 HydrophobicContact CD2-CB 4.26Å; Y360-M373 VanDerWaalsContact CD2-O 3.23Å; Y360-M373 WeakPolarHBondContact CD2-O 3.48Å
374	V	94.2	Very high	94.3	Very high	59 Å²	59	62.3 Å²	62.3	36%	0.358	35%	0.347	S	S	.	.			trans	-144.9	143.5	179	-64.4	0	0	0	0	110.9
375	P	94.3	Very high	94.3	Very high	16 Å²	16	65 Å²	65	10%	0.104	37%	0.366	C	S	.	.			trans	-67.7	137.9	176.6	25.7	-32.1	0	0	0	111.9	M339 E343 Y360 G380 K381	M339-P375 HydrophobicContact CE-CB 3.73Å; M339-P375 HydrophobicContact CE-CG 4.11Å; E343-P375 HydrophobicContact CG-CB 4.28Å; E343-P375 WeakPolarHBondContact OE1-CA 3.45Å; E343-P375 VanDerWaalsContact OE1-CB 3.23Å; E343-P375 WeakPolarHBondContact OE1-CB 3.41Å; Y360-P375 WeakPolarHBondContact OH-CD 3.47Å; P375-G380 VanDerWaalsContact CB-C 3.44Å; P375-K381 HydrophobicContact CG-CG 4.25Å
376	K	92.7	Very high	94.4	Very high	115 Å²	115	69 Å²	69	50%	0.5	39%	0.387	S	S	.	.			trans	-100.2	-31.5	178.3	-60.5	-56.8	-177.1	-178.1	0	111.3	E343	E343-K376 PolarHBondContact OE1-N 3.3Å; E343-K376 PolarHBondContact OE2-N 3.26Å
377	T	94.4	Very high	94.5	Very high	32 Å²	32	66.7 Å²	66.7	20%	0.196	37%	0.373	C	S	.	.	S	Bend	trans	-75.4	155.6	180	72.7	0	0	0	0	112.1	A342 E343 A379 G380 K381	A342-T377 PolarHBondContact O-OG1 2.86Å; E343-T377 VanDerWaalsContact OE1-CB 3.28Å; E343-T377 WeakPolarHBondContact OE1-CB 3.27Å; E343-T377 PolarHBondContact OE1-N 3.32Å; E343-T377 PolarHBondContact OE1-OG1 2.9Å; E343-T377 PolarHBondContact OE2-N 3.02Å; T377-A379 VanDerWaalsContact C-N 3.33Å; T377-G380 PolarHBondContact O-N 2.9Å; T377-G380 PolarHBondContact OG1-N 2.82Å; T377-K381 VanDerWaalsContact O-CG 3.3Å; T377-K381 WeakPolarHBondContact O-CG 3.14Å; T377-K381 PolarHBondContact O-N 3.41Å
378	I	93.8	Very high	94.5	Very high	136 Å²	136	64.2 Å²	64.2	70%	0.697	36%	0.36	S	S	*	.	H	α-helix	trans	-63.4	-43.1	174.1	-60.5	171.3	0	0	0	110	K381 I382	I378-K381 PolarHBondContact O-N 3.47Å; I378-I382 HydrophobicContact CG2-CD1 4.11Å; I378-I382 WeakPolarHBondContact O-CG1 3.42Å; I378-I382 PolarHBondContact O-N 3.01Å
379	A	93.9	Very high	94.4	Very high	41 Å²	41	65 Å²	65	34%	0.339	36%	0.364	S	S	.	.	H	α-helix	trans	-59.3	-48.5	177.1	0	0	0	0	0	111.6	A342 T377 K381 I382 F383	A342-A379 HydrophobicContact CB-CB 4.36Å; T377-A379 VanDerWaalsContact C-N 3.33Å; A379-K381 VanDerWaalsContact C-N 3.3Å; A379-K381 PolarHBondContact O-N 3.37Å; A379-I382 PolarHBondContact O-N 3.39Å; A379-I382 VanDerWaalsContact O-N 3.16Å; A379-F383 HydrophobicContact CB-CD2 4.49Å; A379-F383 HydrophobicContact CB-CE2 4.47Å; A379-F383 WeakPolarHBondContact O-CD2 3.14Å; A379-F383 PolarHBondContact O-N 3.4Å
380	G	94.6	Very high	94.4	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62.6	-33.4	176.4	0	0	0	0	0	113.2	E343 P375 T377 G384	E343-G380 WeakPolarHBondContact OE1-CA 3.37Å; P375-G380 VanDerWaalsContact CB-C 3.44Å; T377-G380 PolarHBondContact O-N 2.9Å; T377-G380 PolarHBondContact OG1-N 2.82Å; G380-G384 WeakPolarHBondContact O-CA 3.25Å; G380-G384 PolarHBondContact O-N 3.29Å
381	K	95.3	Very high	94.3	Very high	119 Å²	119	56.6 Å²	56.6	52%	0.517	32%	0.318	S	S	.	.	H	α-helix	trans	-67	-41.7	172.3	-71.3	173.8	-174.3	-178.5	0	112.1	P375 T377 I378 A379 G384 S385	P375-K381 HydrophobicContact CG-CG 4.25Å; T377-K381 VanDerWaalsContact O-CG 3.3Å; T377-K381 WeakPolarHBondContact O-CG 3.14Å; T377-K381 PolarHBondContact O-N 3.41Å; I378-K381 PolarHBondContact O-N 3.47Å; A379-K381 VanDerWaalsContact C-N 3.3Å; A379-K381 PolarHBondContact O-N 3.37Å; K381-G384 PolarHBondContact O-N 2.87Å; K381-S385 PolarHBondContact O-N 3.16Å; K381-S385 PolarHBondContact O-OG 2.93Å
382	I	96.6	Very high	94.3	Very high	96 Å²	96	57.7 Å²	57.7	49%	0.492	32%	0.315	S	S	.	.	H	α-helix	trans	-63.3	-51.4	176.1	-67	167.5	0	0	0	110.3	I378 A379 G384 S385 I386	I378-I382 HydrophobicContact CG2-CD1 4.11Å; I378-I382 WeakPolarHBondContact O-CG1 3.42Å; I378-I382 PolarHBondContact O-N 3.01Å; A379-I382 PolarHBondContact O-N 3.39Å; A379-I382 VanDerWaalsContact O-N 3.16Å; I382-G384 VanDerWaalsContact C-N 3.3Å; I382-G384 PolarHBondContact O-N 3.25Å; I382-S385 PolarHBondContact O-N 3.15Å; I382-I386 HydrophobicContact CG2-CD1 4.1Å; I382-I386 WeakPolarHBondContact O-CG1 3.43Å; I382-I386 PolarHBondContact O-N 2.88Å
383	F	95.4	Very high	94.2	Very high	81 Å²	81	59.4 Å²	59.4	36%	0.355	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-32.8	178.4	-70.5	-61.4	0	0	0	112.6	V338 M339 A342 A379 I386 C387	V338-F383 HydrophobicContact CG1-CB 3.99Å; V338-F383 HydrophobicContact CG1-CD1 3.59Å; V338-F383 HydrophobicContact CG1-CD2 3.8Å; V338-F383 HydrophobicContact CG1-CE1 3.95Å; V338-F383 HydrophobicContact CG1-CE2 4.16Å; V338-F383 HydrophobicContact CG1-CG 3.52Å; V338-F383 HydrophobicContact CG1-CZ 4.22Å; M339-F383 HydrophobicContact SD-CB 3.89Å; A342-F383 HydrophobicContact CB-CD2 4.11Å; A379-F383 HydrophobicContact CB-CD2 4.49Å; A379-F383 HydrophobicContact CB-CE2 4.47Å; A379-F383 WeakPolarHBondContact O-CD2 3.14Å; A379-F383 PolarHBondContact O-N 3.4Å; F383-I386 HydrophobicContact CD1-CD1 4.46Å; F383-I386 PolarHBondContact O-N 3.04Å; F383-C387 WeakPolarHBondContact O-CB 3.5Å; F383-C387 PolarHBondContact O-N 2.72Å
384	G	94.8	Very high	94.1	Very high	6 Å²	6	60 Å²	60	6%	0.062	33%	0.328	C	S	.	.	H	α-helix	trans	-62.4	-42.8	171.9	0	0	0	0	0	112.6	G380 K381 I382 C387 S388	G380-G384 WeakPolarHBondContact O-CA 3.25Å; G380-G384 PolarHBondContact O-N 3.29Å; K381-G384 PolarHBondContact O-N 2.87Å; I382-G384 VanDerWaalsContact C-N 3.3Å; I382-G384 PolarHBondContact O-N 3.25Å; G384-C387 WeakPolarHBondContact O-CB 3.35Å; G384-C387 PolarHBondContact O-N 2.9Å; G384-S388 PolarHBondContact O-N 3.18Å
385	S	95.1	Very high	93.9	Very high	78 Å²	78	59.8 Å²	59.8	55%	0.545	32%	0.324	S	S	.	.	H	α-helix	trans	-65.6	-40	174.5	-62.5	0	0	0	0	112.6	K381 I382 C387 S388 L389	K381-S385 PolarHBondContact O-N 3.16Å; K381-S385 PolarHBondContact O-OG 2.93Å; I382-S385 PolarHBondContact O-N 3.15Å; S385-C387 VanDerWaalsContact C-N 3.32Å; S385-S388 PolarHBondContact O-OG 3.28Å; S385-L389 PolarHBondContact O-N 3.08Å
386	I	95.6	Very high	93.6	Very high	85 Å²	85	61.5 Å²	61.5	44%	0.436	34%	0.34	S	S	.	.	H	α-helix	trans	-66.1	-39.6	174.6	-64.7	168	0	0	0	110.3	F335 I382 F383 L389 S390	F335-I386 HydrophobicContact CE1-CG2 4.06Å; F335-I386 HydrophobicContact CZ-CG2 4.35Å; I382-I386 HydrophobicContact CG2-CD1 4.1Å; I382-I386 WeakPolarHBondContact O-CG1 3.43Å; I382-I386 PolarHBondContact O-N 2.88Å; F383-I386 HydrophobicContact CD1-CD1 4.46Å; F383-I386 PolarHBondContact O-N 3.04Å; I386-L389 PolarHBondContact O-N 2.69Å; I386-S390 VanDerWaalsContact O-CB 3.29Å; I386-S390 WeakPolarHBondContact O-CB 3.38Å; I386-S390 PolarHBondContact O-N 3.36Å; I386-S390 PolarHBondContact O-OG 3.24Å; I386-S390 VanDerWaalsContact O-OG 3.13Å
387	C	95.3	Very high	93.3	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-64.8	-41.1	178.4	178.4	0	0	0	0	112.7	F335 F383 G384 S385 S390 G391	F335-C387 HydrophobicContact CB-CB 4.36Å; F335-C387 HydrophobicContact CD1-CB 3.68Å; F335-C387 HydrophobicContact CE1-CB 4.09Å; F335-C387 HydrophobicContact CG-CB 3.95Å; F383-C387 WeakPolarHBondContact O-CB 3.5Å; F383-C387 PolarHBondContact O-N 2.72Å; G384-C387 WeakPolarHBondContact O-CB 3.35Å; G384-C387 PolarHBondContact O-N 2.9Å; S385-C387 VanDerWaalsContact C-N 3.32Å; C387-S390 WeakPolarHBondContact CA-OG 3.22Å; C387-S390 PolarHBondContact O-OG 2.71Å; C387-G391 PolarHBondContact O-N 3.03Å
388	S	94.8	Very high	92.9	Very high	49 Å²	49	61.5 Å²	61.5	34%	0.343	35%	0.345	S	S	.	.	H	α-helix	trans	-67.1	-43.8	176.6	64.2	0	0	0	0	111.5	G384 S385 G391 V392	G384-S388 PolarHBondContact O-N 3.18Å; S385-S388 PolarHBondContact O-OG 3.28Å; S388-G391 PolarHBondContact O-N 2.89Å; S388-V392 PolarHBondContact O-N 3.41Å
389	L	94.7	Very high	92.6	Very high	116 Å²	116	57.9 Å²	57.9	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-64.3	-44	177.7	-176.2	63.2	0	0	0	112	S385 I386 V392 L393	S385-L389 PolarHBondContact O-N 3.08Å; I386-L389 PolarHBondContact O-N 2.69Å; L389-V392 PolarHBondContact O-N 3.12Å; L389-L393 WeakPolarHBondContact O-CG 3.47Å; L389-L393 PolarHBondContact O-N 3.05Å
390	S	93	Very high	92.4	Very high	23 Å²	23	59.5 Å²	59.5	16%	0.161	34%	0.336	C	S	.	.	H	α-helix	trans	-66.5	-36.8	178.3	69.5	0	0	0	0	112.1	F335 I386 C387 V392 L393 V394	F335-S390 WeakPolarHBondContact CE2-OG 3.26Å; F335-S390 WeakPolarHBondContact CZ-OG 3.33Å; I386-S390 VanDerWaalsContact O-CB 3.29Å; I386-S390 WeakPolarHBondContact O-CB 3.38Å; I386-S390 PolarHBondContact O-N 3.36Å; I386-S390 PolarHBondContact O-OG 3.24Å; I386-S390 VanDerWaalsContact O-OG 3.13Å; C387-S390 WeakPolarHBondContact CA-OG 3.22Å; C387-S390 PolarHBondContact O-OG 2.71Å; S390-V392 PolarHBondContact O-N 2.9Å; S390-L393 PolarHBondContact O-N 2.88Å; S390-V394 WeakPolarHBondContact O-CB 3.23Å; S390-V394 VanDerWaalsContact O-CG2 3.27Å; S390-V394 WeakPolarHBondContact O-CG2 3.45Å; S390-V394 PolarHBondContact O-N 3.34Å
391	G	92.6	Very high	91.9	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-59	-45.7	176.1	0	0	0	0	0	112.9	M365 C387 S388 L393 V394 I395	M365-G391 CarbonylContact O-C 3.51Å; C387-G391 PolarHBondContact O-N 3.03Å; S388-G391 PolarHBondContact O-N 2.89Å; G391-L393 VanDerWaalsContact C-N 3.35Å; G391-L393 PolarHBondContact O-N 3.4Å; G391-V394 PolarHBondContact O-N 3.37Å; G391-I395 WeakPolarHBondContact O-CG1 3.31Å; G391-I395 PolarHBondContact O-N 3.47Å
392	V	92.8	Very high	91.4	Very high	72 Å²	72	58.9 Å²	58.9	44%	0.436	34%	0.34	S	S	.	.	H	α-helix	trans	-59.2	-46.2	175.2	175.9	0	0	0	0	110.9	T367 S388 L389 S390 I395 A396	T367-V392 HydrophobicContact CG2-CG2 3.54Å; S388-V392 PolarHBondContact O-N 3.41Å; L389-V392 PolarHBondContact O-N 3.12Å; S390-V392 PolarHBondContact O-N 2.9Å; V392-I395 PolarHBondContact O-N 2.88Å; V392-A396 WeakPolarHBondContact O-CB 3.42Å; V392-A396 PolarHBondContact O-N 3.24Å
393	L	91.2	Very high	91	Very high	101 Å²	101	58.5 Å²	58.5	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-64.5	-44.3	179.6	-67	172.1	0	0	0	112.4	L389 S390 G391 I395 A396 L397	L389-L393 WeakPolarHBondContact O-CG 3.47Å; L389-L393 PolarHBondContact O-N 3.05Å; S390-L393 PolarHBondContact O-N 2.88Å; G391-L393 VanDerWaalsContact C-N 3.35Å; G391-L393 PolarHBondContact O-N 3.4Å; L393-I395 VanDerWaalsContact C-N 3.33Å; L393-I395 PolarHBondContact O-N 3.24Å; L393-A396 PolarHBondContact O-N 3.28Å; L393-L397 VanDerWaalsContact O-CG 3.29Å; L393-L397 WeakPolarHBondContact O-CG 3.27Å; L393-L397 PolarHBondContact O-N 3.38Å
394	V	90.1	Very high	90.4	Very high	36 Å²	36	58.3 Å²	58.3	22%	0.218	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-38.6	-179.5	170.1	0	0	0	0	111.5	L328 S390 G391 P398	L328-V394 HydrophobicContact CD1-CG1 4.31Å; S390-V394 WeakPolarHBondContact O-CB 3.23Å; S390-V394 VanDerWaalsContact O-CG2 3.27Å; S390-V394 WeakPolarHBondContact O-CG2 3.45Å; S390-V394 PolarHBondContact O-N 3.34Å; G391-V394 PolarHBondContact O-N 3.37Å; V394-P398 WeakPolarHBondContact O-CD 3.28Å
395	I	90.2	Very high	89.8	Confident	53 Å²	53	58.9 Å²	58.9	27%	0.272	35%	0.353	S	S	.	.	H	α-helix	trans	-78.1	-39.1	177.4	-64	173	0	0	0	111.1	L328 T366 G391 V392 L393 L397 P398 V399	L328-I395 HydrophobicContact CD1-CD1 4.36Å; L328-I395 HydrophobicContact CD1-CG1 4.05Å; T366-I395 HydrophobicContact CG2-CD1 4.29Å; G391-I395 WeakPolarHBondContact O-CG1 3.31Å; G391-I395 PolarHBondContact O-N 3.47Å; V392-I395 PolarHBondContact O-N 2.88Å; L393-I395 VanDerWaalsContact C-N 3.33Å; L393-I395 PolarHBondContact O-N 3.24Å; I395-L397 VanDerWaalsContact C-N 3.32Å; I395-L397 PolarHBondContact O-N 3.19Å; I395-P398 WeakPolarHBondContact O-CD 3.48Å; I395-V399 HydrophobicContact CG2-CG2 3.92Å; I395-V399 WeakPolarHBondContact O-CB 3.49Å; I395-V399 WeakPolarHBondContact O-CG2 3.12Å; I395-V399 PolarHBondContact O-N 3.19Å
396	A	89.3	Confident	89.1	Confident	53 Å²	53	58.7 Å²	58.7	44%	0.438	34%	0.342	S	S	.	.	H	α-helix	trans	-68.3	-25.4	-174.7	0	0	0	0	0	114.2	V392 L393 P400	V392-A396 WeakPolarHBondContact O-CB 3.42Å; V392-A396 PolarHBondContact O-N 3.24Å; L393-A396 PolarHBondContact O-N 3.28Å; A396-P400 WeakPolarHBondContact O-CD 3.34Å; A396-P400 VanDerWaalsContact O-CG 3.27Å; A396-P400 WeakPolarHBondContact O-CG 3.38Å
397	L	86.3	Confident	88.4	Confident	131 Å²	131	57 Å²	57	69%	0.686	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-51.4	-177.5	-69	172.4	0	0	0	114.1	L393 I395	L393-L397 VanDerWaalsContact O-CG 3.29Å; L393-L397 WeakPolarHBondContact O-CG 3.27Å; L393-L397 PolarHBondContact O-N 3.38Å; I395-L397 VanDerWaalsContact C-N 3.32Å; I395-L397 PolarHBondContact O-N 3.19Å
398	P	84.9	Confident	87.8	Confident	16 Å²	16	63.8 Å²	63.8	10%	0.104	36%	0.363	C	S	.	.	H	α-helix	trans	-83	-24.5	-177.9	30.9	-36.3	0	0	0	114	L324 V394 I395 V401 I402	L324-P398 HydrophobicContact CB-CB 3.98Å; L324-P398 HydrophobicContact CB-CG 3.8Å; L324-P398 HydrophobicContact CD1-CB 4.42Å; L324-P398 HydrophobicContact CD1-CG 3.33Å; L324-P398 HydrophobicContact CD2-CG 4.04Å; L324-P398 HydrophobicContact CG-CB 4.5Å; L324-P398 HydrophobicContact CG-CG 3.87Å; V394-P398 WeakPolarHBondContact O-CD 3.28Å; I395-P398 WeakPolarHBondContact O-CD 3.48Å; P398-V401 WeakPolarHBondContact O-CB 3.12Å; P398-V401 PolarHBondContact O-N 3.23Å; P398-V401 VanDerWaalsContact O-N 3.16Å; P398-I402 WeakPolarHBondContact O-CG1 3.44Å; P398-I402 PolarHBondContact O-N 3.35Å
399	V	88.2	Confident	87	Confident	59 Å²	59	62.5 Å²	62.5	36%	0.358	35%	0.353	S	S	.	.	H	α-helix	trans	-59	-46.8	-177.7	168	0	0	0	0	112.5	I395 V401 I402 V403	I395-V399 HydrophobicContact CG2-CG2 3.92Å; I395-V399 WeakPolarHBondContact O-CB 3.49Å; I395-V399 WeakPolarHBondContact O-CG2 3.12Å; I395-V399 PolarHBondContact O-N 3.19Å; V399-V401 VanDerWaalsContact C-N 3.28Å; V399-V401 PolarHBondContact O-N 3.03Å; V399-I402 PolarHBondContact O-N 3.46Å; V399-V403 HydrophobicContact CG1-CG2 4.12Å; V399-V403 WeakPolarHBondContact O-CB 3.42Å; V399-V403 VanDerWaalsContact O-CG2 3.27Å; V399-V403 WeakPolarHBondContact O-CG2 3.17Å; V399-V403 PolarHBondContact O-N 3.38Å
400	P	89	Confident	86.4	Confident	76 Å²	76	61.9 Å²	61.9	49%	0.494	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-34.5	175.7	-26.2	35.7	0	0	0	113.7	A396 V403 S404	A396-P400 WeakPolarHBondContact O-CD 3.34Å; A396-P400 VanDerWaalsContact O-CG 3.27Å; A396-P400 WeakPolarHBondContact O-CG 3.38Å; P400-V403 PolarHBondContact O-N 2.82Å; P400-S404 VanDerWaalsContact O-CB 3.23Å; P400-S404 WeakPolarHBondContact O-CB 2.99Å; P400-S404 PolarHBondContact O-N 3.48Å
401	V	83.9	Confident	85.8	Confident	71 Å²	71	64.9 Å²	64.9	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-65.3	-48.1	175.9	-179	0	0	0	0	109.9	P398 V399 V403 S404 N405	P398-V401 WeakPolarHBondContact O-CB 3.12Å; P398-V401 PolarHBondContact O-N 3.23Å; P398-V401 VanDerWaalsContact O-N 3.16Å; V399-V401 VanDerWaalsContact C-N 3.28Å; V399-V401 PolarHBondContact O-N 3.03Å; V401-V403 VanDerWaalsContact C-N 3.34Å; V401-V403 PolarHBondContact O-N 3.46Å; V401-S404 PolarHBondContact O-N 3.46Å; V401-N405 WeakPolarHBondContact O-CB 3.42Å; V401-N405 PolarHBondContact O-N 2.82Å
402	I	85.6	Confident	85.1	Confident	35 Å²	35	67.7 Å²	67.7	18%	0.179	37%	0.367	C	S	.	.	H	α-helix	trans	-60.8	-44.5	176.6	-63.5	166	0	0	0	110.5	E320 L321 L324 P398 V399 N405 F406	E320-I402 HydrophobicContact CB-CG1 4.41Å; L321-I402 HydrophobicContact CD1-CD1 4.34Å; L324-I402 HydrophobicContact CD2-CD1 3.95Å; P398-I402 WeakPolarHBondContact O-CG1 3.44Å; P398-I402 PolarHBondContact O-N 3.35Å; V399-I402 PolarHBondContact O-N 3.46Å; I402-N405 PolarHBondContact O-N 2.9Å; I402-F406 VanDerWaalsContact O-CB 3.25Å; I402-F406 WeakPolarHBondContact O-CB 3.42Å; I402-F406 PolarHBondContact O-N 2.95Å
403	V	87.4	Confident	84.2	Confident	88 Å²	88	66.6 Å²	66.6	53%	0.533	36%	0.359	S	S	.	.	H	α-helix	trans	-64.7	-41.9	178.9	170.8	0	0	0	0	111.4	V399 P400 V401 F406 S407	V399-V403 HydrophobicContact CG1-CG2 4.12Å; V399-V403 WeakPolarHBondContact O-CB 3.42Å; V399-V403 VanDerWaalsContact O-CG2 3.27Å; V399-V403 WeakPolarHBondContact O-CG2 3.17Å; V399-V403 PolarHBondContact O-N 3.38Å; P400-V403 PolarHBondContact O-N 2.82Å; V401-V403 VanDerWaalsContact C-N 3.34Å; V401-V403 PolarHBondContact O-N 3.46Å; V403-F406 PolarHBondContact O-N 3.38Å; V403-S407 WeakPolarHBondContact O-CB 3.07Å; V403-S407 PolarHBondContact O-N 3.48Å
404	S	84.6	Confident	83.7	Confident	77 Å²	77	65.4 Å²	65.4	54%	0.538	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-45.9	176.2	-177.3	0	0	0	0	111.2	P400 V401 S407 R408	P400-S404 VanDerWaalsContact O-CB 3.23Å; P400-S404 WeakPolarHBondContact O-CB 2.99Å; P400-S404 PolarHBondContact O-N 3.48Å; V401-S404 PolarHBondContact O-N 3.46Å; S404-S407 PolarHBondContact O-N 2.9Å; S404-R408 WeakPolarHBondContact O-CB 2.89Å; S404-R408 PolarHBondContact O-N 3.49Å
405	N	80.4	Confident	83.1	Confident	18 Å²	18	71.7 Å²	71.7	10%	0.096	37%	0.37	C	S	.	.	H	α-helix	trans	-65.7	-43	176.8	-82.1	-30.1	0	0	0	113	C317 E320 V401 I402 R408 I409	C317-N405 VanDerWaalsContact SG-CB 3.57Å; E320-N405 PolarHBondContact OE1-ND2 3.44Å; E320-N405 PolarHBondContact OE2-ND2 3.3Å; V401-N405 WeakPolarHBondContact O-CB 3.42Å; V401-N405 PolarHBondContact O-N 2.82Å; I402-N405 PolarHBondContact O-N 2.9Å; N405-R408 PolarHBondContact O-N 3.31Å; N405-R408 PolarHBondContact OD1-NH2 3.03Å; N405-I409 WeakPolarHBondContact O-CG1 3.27Å; N405-I409 PolarHBondContact O-N 3.28Å
406	F	80.2	Confident	82.4	Confident	74 Å²	74	70.5 Å²	70.5	33%	0.325	37%	0.368	S	S	.	.	H	α-helix	trans	-59.3	-47.6	174	-178.9	-94.7	0	0	0	111.1	L310 T313 I402 V403 R408 I409 Y410	L310-F406 HydrophobicContact CD1-CD2 4.44Å; L310-F406 HydrophobicContact CD1-CE2 3.69Å; L310-F406 HydrophobicContact CD1-CZ 4.36Å; T313-F406 HydrophobicContact CG2-CD2 3.79Å; T313-F406 HydrophobicContact CG2-CE2 3.95Å; T313-F406 VanDerWaalsContact OG1-CD2 3.28Å; T313-F406 WeakPolarHBondContact OG1-CD2 3.24Å; T313-F406 VanDerWaalsContact OG1-CE2 3.32Å; T313-F406 WeakPolarHBondContact OG1-CE2 3.37Å; I402-F406 VanDerWaalsContact O-CB 3.25Å; I402-F406 WeakPolarHBondContact O-CB 3.42Å; I402-F406 PolarHBondContact O-N 2.95Å; V403-F406 PolarHBondContact O-N 3.38Å; F406-R408 PolarHBondContact O-N 3.36Å; F406-I409 PolarHBondContact O-N 2.71Å; F406-Y410 WeakPolarHBondContact O-CB 3.3Å; F406-Y410 PolarHBondContact O-N 2.69Å
407	S	82.8	Confident	81.7	Confident	50 Å²	50	70.9 Å²	70.9	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-59.4	-45.4	177.9	-179.7	0	0	0	0	111.8	V403 S404 Y410 H411	V403-S407 WeakPolarHBondContact O-CB 3.07Å; V403-S407 PolarHBondContact O-N 3.48Å; S404-S407 PolarHBondContact O-N 2.9Å; S407-Y410 PolarHBondContact O-N 3.01Å; S407-H411 WeakPolarHBondContact O-CB 3.49Å; S407-H411 PolarHBondContact O-CD2 2.97Å; S407-H411 VanDerWaalsContact O-CD2 3.23Å; S407-H411 PolarHBondContact O-N 3.43Å; S407-H411 PolarHBondContact OG-CD2 3.24Å
408	R	82.2	Confident	81.2	Confident	141 Å²	141	70.7 Å²	70.7	53%	0.532	36%	0.357	S	S	.	.	H	α-helix	trans	-57.8	-53.6	176	178.6	173.1	61.6	171.4	-1.1	111.7	S404 N405 F406 Y410 H411 Q412	S404-R408 WeakPolarHBondContact O-CB 2.89Å; S404-R408 PolarHBondContact O-N 3.49Å; N405-R408 PolarHBondContact O-N 3.31Å; N405-R408 PolarHBondContact OD1-NH2 3.03Å; F406-R408 PolarHBondContact O-N 3.36Å; R408-Y410 VanDerWaalsContact C-N 3.34Å; R408-Y410 PolarHBondContact O-N 2.89Å; R408-H411 PolarHBondContact O-N 3.49Å; R408-Q412 WeakPolarHBondContact O-CB 3.27Å; R408-Q412 VanDerWaalsContact O-CG 3.26Å; R408-Q412 WeakPolarHBondContact O-CG 3.49Å; R408-Q412 PolarHBondContact O-N 3.39Å
409	I	78.6	Confident	80.7	Confident	23 Å²	23	77.1 Å²	77.1	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-65.9	-39.1	-178.4	-63.2	166.9	0	0	0	110.8	T313 N405 F406 Q412 N413	T313-I409 HydrophobicContact CG2-CB 3.86Å; T313-I409 HydrophobicContact CG2-CD1 4.3Å; T313-I409 HydrophobicContact CG2-CG2 3.51Å; N405-I409 WeakPolarHBondContact O-CG1 3.27Å; N405-I409 PolarHBondContact O-N 3.28Å; F406-I409 PolarHBondContact O-N 2.71Å; I409-Q412 PolarHBondContact O-N 3.03Å; I409-N413 WeakPolarHBondContact O-CB 3.29Å; I409-N413 PolarHBondContact O-N 2.81Å; I409-N413 PolarHBondContact O-ND2 3.1Å
410	Y	80.4	Confident	80	Confident	103 Å²	103	78.4 Å²	78.4	40%	0.404	38%	0.377	S	S	.	.	H	α-helix	trans	-61.7	-48.5	177.2	-178.9	-99.7	0	0	0	111.7	I309 F406 S407 R408 N413 Q414	I309-Y410 HydrophobicContact CG2-CD2 4.5Å; F406-Y410 WeakPolarHBondContact O-CB 3.3Å; F406-Y410 PolarHBondContact O-N 2.69Å; S407-Y410 PolarHBondContact O-N 3.01Å; R408-Y410 VanDerWaalsContact C-N 3.34Å; R408-Y410 PolarHBondContact O-N 2.89Å; Y410-N413 PolarHBondContact O-N 3.33Å; Y410-Q414 WeakPolarHBondContact O-CB 3.33Å; Y410-Q414 PolarHBondContact O-N 2.73Å
411	H	80.2	Confident	79.3	Confident	85 Å²	85	77.6 Å²	77.6	39%	0.394	38%	0.377	S	S	.	.	H	α-helix	trans	-68.4	-35.7	177.4	-78.2	-56.6	0	0	0	113.2	S407 R408 Q414 R415	S407-H411 WeakPolarHBondContact O-CB 3.49Å; S407-H411 PolarHBondContact O-CD2 2.97Å; S407-H411 VanDerWaalsContact O-CD2 3.23Å; S407-H411 PolarHBondContact O-N 3.43Å; S407-H411 PolarHBondContact OG-CD2 3.24Å; R408-H411 PolarHBondContact O-N 3.49Å; H411-Q414 PolarHBondContact O-N 3.08Å; H411-R415 WeakPolarHBondContact O-CB 3.34Å; H411-R415 VanDerWaalsContact O-CG 3.27Å; H411-R415 WeakPolarHBondContact O-CG 3.26Å; H411-R415 PolarHBondContact O-N 3.43Å
412	Q	78	Confident	78.9	Confident	60 Å²	60	80.8 Å²	80.8	28%	0.28	39%	0.387	S	S	.	.	H	α-helix	trans	-60.1	-50.1	172.8	-77.7	171.4	-23.8	0	0	110.9	E142 R408 I409 Q414 R415 A416	E142-Q412 PolarHBondContact OE1-NE2 3.1Å; R408-Q412 WeakPolarHBondContact O-CB 3.27Å; R408-Q412 VanDerWaalsContact O-CG 3.26Å; R408-Q412 WeakPolarHBondContact O-CG 3.49Å; R408-Q412 PolarHBondContact O-N 3.39Å; I409-Q412 PolarHBondContact O-N 3.03Å; Q412-Q414 VanDerWaalsContact C-N 3.34Å; Q412-Q414 PolarHBondContact O-N 3.41Å; Q412-R415 PolarHBondContact O-N 3.15Å; Q412-A416 WeakPolarHBondContact O-CB 3.42Å; Q412-A416 PolarHBondContact O-N 3.46Å
413	N	75.4	Confident	78.3	Confident	48 Å²	48	82.9 Å²	82.9	26%	0.257	40%	0.395	S	S	.	.	H	α-helix	trans	-60.3	-42.1	176.4	-79.2	-32.1	0	0	0	112	I409 Y410 R415 A416 D417	I409-N413 WeakPolarHBondContact O-CB 3.29Å; I409-N413 PolarHBondContact O-N 2.81Å; I409-N413 PolarHBondContact O-ND2 3.1Å; Y410-N413 PolarHBondContact O-N 3.33Å; N413-R415 VanDerWaalsContact C-N 3.34Å; N413-R415 PolarHBondContact O-N 3.12Å; N413-A416 PolarHBondContact O-N 2.84Å; N413-D417 PolarHBondContact O-N 3.01Å
414	Q	79.9	Confident	77.7	Confident	76 Å²	76	85.3 Å²	85.3	36%	0.355	40%	0.398	S	S	.	.	H	α-helix	trans	-63.3	-39.2	177.2	-168.3	-176.7	46.3	0	0	112.5	Y410 H411 Q412 K418	Y410-Q414 WeakPolarHBondContact O-CB 3.33Å; Y410-Q414 PolarHBondContact O-N 2.73Å; H411-Q414 PolarHBondContact O-N 3.08Å; Q412-Q414 VanDerWaalsContact C-N 3.34Å; Q412-Q414 PolarHBondContact O-N 3.41Å; Q414-K418 WeakPolarHBondContact O-CG 3.36Å; Q414-K418 PolarHBondContact O-N 3.32Å; Q414-K418 VanDerWaalsContact O-N 3.08Å
415	R	78.6	Confident	77.3	Confident	169 Å²	169	83.9 Å²	83.9	64%	0.638	39%	0.391	S	S	*	.	H	α-helix	trans	-68	-41.2	175.3	-72.6	173.6	-176.1	-172.5	2	111.3	H411 Q412 N413 K418 R419	H411-R415 WeakPolarHBondContact O-CB 3.34Å; H411-R415 VanDerWaalsContact O-CG 3.27Å; H411-R415 WeakPolarHBondContact O-CG 3.26Å; H411-R415 PolarHBondContact O-N 3.43Å; Q412-R415 PolarHBondContact O-N 3.15Å; N413-R415 VanDerWaalsContact C-N 3.34Å; N413-R415 PolarHBondContact O-N 3.12Å; R415-K418 PolarHBondContact O-N 3.47Å; R415-R419 WeakPolarHBondContact O-CG 3.4Å; R415-R419 PolarHBondContact O-N 2.72Å
416	A	74.1	Confident	77.2	Confident	27 Å²	27	91.6 Å²	91.6	22%	0.223	42%	0.419	C	S	.	.	H	α-helix	trans	-60.8	-44.6	175.3	0	0	0	0	0	111.3	Q412 N413 K418 R419 R420	Q412-A416 WeakPolarHBondContact O-CB 3.42Å; Q412-A416 PolarHBondContact O-N 3.46Å; N413-A416 PolarHBondContact O-N 2.84Å; A416-K418 PolarHBondContact O-N 3.16Å; A416-R419 PolarHBondContact O-N 3.21Å; A416-R420 WeakPolarHBondContact O-CB 3.23Å; A416-R420 VanDerWaalsContact O-CG 3.29Å; A416-R420 WeakPolarHBondContact O-CG 3.34Å; A416-R420 PolarHBondContact O-N 2.96Å
417	D	74.4	Confident	77.1	Confident	61 Å²	61	91.2 Å²	91.2	33%	0.326	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-42.8	176.7	-76.9	-16.6	0	0	0	112.3	Q305 N413 R420 A421	Q305-D417 PolarHBondContact NE2-OD2 2.83Å; N413-D417 PolarHBondContact O-N 3.01Å; D417-R420 PolarHBondContact O-N 3.37Å; D417-A421 WeakPolarHBondContact O-CB 3.38Å; D417-A421 PolarHBondContact O-N 2.92Å
418	K	75.6	Confident	76.7	Confident	128 Å²	128	91.2 Å²	91.2	56%	0.557	42%	0.422	S	S	*	.	H	α-helix	trans	-60.1	-45.4	173.8	-74.6	178.9	179.9	-175.8	0	111.9	Q414 R415 A416 A421 Q422	Q414-K418 WeakPolarHBondContact O-CG 3.36Å; Q414-K418 PolarHBondContact O-N 3.32Å; Q414-K418 VanDerWaalsContact O-N 3.08Å; R415-K418 PolarHBondContact O-N 3.47Å; A416-K418 PolarHBondContact O-N 3.16Å; K418-A421 PolarHBondContact O-N 3.04Å; K418-Q422 WeakPolarHBondContact O-CG 3.32Å; K418-Q422 PolarHBondContact O-N 3.4Å
419	R	74.9	Confident	76.6	Confident	150 Å²	150	93.7 Å²	93.7	57%	0.566	43%	0.432	S	S	*	.	H	α-helix	trans	-62.4	-44.1	176.7	-72.4	175.4	-178.1	-171.7	-0.9	111.5	R415 A416 A421 Q422 K423	R415-R419 WeakPolarHBondContact O-CG 3.4Å; R415-R419 PolarHBondContact O-N 2.72Å; A416-R419 PolarHBondContact O-N 3.21Å; R419-A421 VanDerWaalsContact C-N 3.34Å; R419-A421 PolarHBondContact O-N 2.98Å; R419-Q422 PolarHBondContact O-N 2.95Å; R419-K423 WeakPolarHBondContact O-CB 3.32Å; R419-K423 PolarHBondContact O-N 3.42Å
420	R	73.3	Confident	76.5	Confident	87 Å²	87	96.8 Å²	96.8	33%	0.328	45%	0.448	S	S	.	.	H	α-helix	trans	-61.8	-40.8	176.3	-73.5	173	175.6	-176.5	-0.4	111.5	D149 S153 A416 D417 K424	D149-R420 PolarHBondContact O-NH2 3.25Å; S153-R420 PolarHBondContact OG-NH2 2.95Å; A416-R420 WeakPolarHBondContact O-CB 3.23Å; A416-R420 VanDerWaalsContact O-CG 3.29Å; A416-R420 WeakPolarHBondContact O-CG 3.34Å; A416-R420 PolarHBondContact O-N 2.96Å; D417-R420 PolarHBondContact O-N 3.37Å; R420-K424 WeakPolarHBondContact O-CB 3.05Å; R420-K424 VanDerWaalsContact O-CG 3.29Å; R420-K424 WeakPolarHBondContact O-CG 3.47Å; R420-K424 PolarHBondContact O-N 3.44Å
421	A	73.8	Confident	76.3	Confident	58 Å²	58	100.5 Å²	100.5	48%	0.479	46%	0.461	S	S	.	.	H	α-helix	trans	-64.2	-45.4	174.8	0	0	0	0	0	112	D417 K418 R419 K424 A425	D417-A421 WeakPolarHBondContact O-CB 3.38Å; D417-A421 PolarHBondContact O-N 2.92Å; K418-A421 PolarHBondContact O-N 3.04Å; R419-A421 VanDerWaalsContact C-N 3.34Å; R419-A421 PolarHBondContact O-N 2.98Å; A421-K424 PolarHBondContact O-N 3.48Å; A421-A425 WeakPolarHBondContact O-CB 3.37Å; A421-A425 PolarHBondContact O-N 3.01Å
422	Q	76.5	Confident	76.3	Confident	139 Å²	139	101.6 Å²	101.6	65%	0.65	47%	0.473	S	S	*	.	H	α-helix	trans	-62.4	-44	176.1	-73.3	176	-15.6	0	0	112.2	K418 R419 A425 R426	K418-Q422 WeakPolarHBondContact O-CG 3.32Å; K418-Q422 PolarHBondContact O-N 3.4Å; R419-Q422 PolarHBondContact O-N 2.95Å; Q422-A425 PolarHBondContact O-N 2.01Å; Q422-R426 WeakPolarHBondContact O-CB 3.45Å; Q422-R426 PolarHBondContact O-N 3.28Å
423	K	73.5	Confident	76.2	Confident	78 Å²	78	101.9 Å²	101.9	34%	0.339	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-45.3	176.1	-171.5	176.7	-176.1	175.2	0	111.5	E154 R419 A425 R426 L427	E154-K423 VanDerWaalsContact CD-NZ 3.33Å; E154-K423 IonicContact OE1-NZ 3.87Å; E154-K423 PolarHBondContact OE1-NZ 2.96Å; R419-K423 WeakPolarHBondContact O-CB 3.32Å; R419-K423 PolarHBondContact O-N 3.42Å; K423-A425 PolarHBondContact O-N 2.87Å; K423-R426 PolarHBondContact O-N 3.31Å; K423-L427 HydrophobicContact CG-CD1 4.17Å; K423-L427 WeakPolarHBondContact O-CB 3.47Å; K423-L427 WeakPolarHBondContact O-CG 3.4Å; K423-L427 PolarHBondContact O-N 2.94Å
424	K	74.3	Confident	76.3	Confident	140 Å²	140	107 Å²	107	61%	0.609	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-44.4	174.7	-75.7	176.1	-178.5	179.8	0	111.9	R420 A421 L427 A428	R420-K424 WeakPolarHBondContact O-CB 3.05Å; R420-K424 VanDerWaalsContact O-CG 3.29Å; R420-K424 WeakPolarHBondContact O-CG 3.47Å; R420-K424 PolarHBondContact O-N 3.44Å; A421-K424 PolarHBondContact O-N 3.48Å; K424-L427 PolarHBondContact O-N 3.35Å; K424-A428 WeakPolarHBondContact O-CB 3.27Å; K424-A428 PolarHBondContact O-N 3.36Å
425	A	75.3	Confident	76	Confident	46 Å²	46	106.9 Å²	106.9	38%	0.38	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-43.7	176.6	0	0	0	0	0	112	A421 Q422 K423 A428 R429	A421-A425 WeakPolarHBondContact O-CB 3.37Å; A421-A425 PolarHBondContact O-N 3.01Å; Q422-A425 PolarHBondContact O-N 2.01Å; K423-A425 PolarHBondContact O-N 2.87Å; A425-A428 PolarHBondContact O-N 3.34Å; A425-R429 WeakPolarHBondContact O-CG 3.48Å; A425-R429 PolarHBondContact O-N 3.42Å
426	R	79	Confident	75.5	Confident	181 Å²	181	100.7 Å²	100.7	68%	0.683	50%	0.5	S	S	*	.	H	α-helix	trans	-61.7	-46.5	175.7	-176.2	178.9	176	-170.8	-1.1	111.8	Q422 K423 A428 R429 I430	Q422-R426 WeakPolarHBondContact O-CB 3.45Å; Q422-R426 PolarHBondContact O-N 3.28Å; K423-R426 PolarHBondContact O-N 3.31Å; R426-A428 VanDerWaalsContact C-N 3.35Å; R426-A428 PolarHBondContact O-N 3.48Å; R426-R429 WeakPolarHBondContact O-CB 3.24Å; R426-R429 PolarHBondContact O-N 3.06Å; R426-I430 HydrophobicContact CG-CD1 4.05Å; R426-I430 WeakPolarHBondContact O-CG1 3.32Å; R426-I430 PolarHBondContact O-N 3.25Å
427	L	77.4	Confident	75.4	Confident	65 Å²	65	103.5 Å²	103.5	34%	0.34	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-38.6	177.6	-73	171.5	0	0	0	112.2	K423 K424 I430 R431	K423-L427 HydrophobicContact CG-CD1 4.17Å; K423-L427 WeakPolarHBondContact O-CB 3.47Å; K423-L427 WeakPolarHBondContact O-CG 3.4Å; K423-L427 PolarHBondContact O-N 2.94Å; K424-L427 PolarHBondContact O-N 3.35Å; L427-I430 PolarHBondContact O-N 2.85Å; L427-R431 WeakPolarHBondContact O-CB 3.37Å; L427-R431 PolarHBondContact O-N 2.86Å
428	A	75.4	Confident	75.1	Confident	50 Å²	50	103.5 Å²	103.5	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-61.5	-43.6	173.6	0	0	0	0	0	111.4	K424 A425 R426 R431 V432	K424-A428 WeakPolarHBondContact O-CB 3.27Å; K424-A428 PolarHBondContact O-N 3.36Å; A425-A428 PolarHBondContact O-N 3.34Å; R426-A428 VanDerWaalsContact C-N 3.35Å; R426-A428 PolarHBondContact O-N 3.48Å; A428-R431 PolarHBondContact O-N 3.28Å; A428-V432 WeakPolarHBondContact O-CG2 3.35Å; A428-V432 PolarHBondContact O-N 2.72Å
429	R	78.9	Confident	74.6	Confident	193 Å²	193	102 Å²	102	73%	0.728	52%	0.52	S	S	*	.	H	α-helix	trans	-61.3	-46.3	174.8	-69.5	175.4	-171.9	-177	1.5	112.1	A425 R426 R431 V432 A433	A425-R429 WeakPolarHBondContact O-CG 3.48Å; A425-R429 PolarHBondContact O-N 3.42Å; R426-R429 WeakPolarHBondContact O-CB 3.24Å; R426-R429 PolarHBondContact O-N 3.06Å; R429-R431 VanDerWaalsContact C-N 3.31Å; R429-R431 PolarHBondContact O-N 3.47Å; R429-V432 PolarHBondContact O-N 3.43Å; R429-A433 WeakPolarHBondContact O-CB 3.08Å; R429-A433 PolarHBondContact O-N 3.08Å
430	I	77.6	Confident	74.1	Confident	89 Å²	89	97.8 Å²	97.8	46%	0.456	52%	0.518	S	S	.	.	H	α-helix	trans	-60.6	-42	177.1	-67.5	166.8	0	0	0	110.7	R426 L427 A433 K434	R426-I430 HydrophobicContact CG-CD1 4.05Å; R426-I430 WeakPolarHBondContact O-CG1 3.32Å; R426-I430 PolarHBondContact O-N 3.25Å; L427-I430 PolarHBondContact O-N 2.85Å; I430-A433 PolarHBondContact O-N 3.32Å; I430-K434 WeakPolarHBondContact O-CB 3.2Å; I430-K434 PolarHBondContact O-N 3.49Å
431	R	76.7	Confident	73.8	Confident	180 Å²	180	101.2 Å²	101.2	68%	0.679	53%	0.532	S	S	*	.	H	α-helix	trans	-62.7	-45.5	177.3	-172.3	-178.7	-68.9	156.1	-2.3	111.5	L427 A428 R429 K434 T435	L427-R431 WeakPolarHBondContact O-CB 3.37Å; L427-R431 PolarHBondContact O-N 2.86Å; A428-R431 PolarHBondContact O-N 3.28Å; R429-R431 VanDerWaalsContact C-N 3.31Å; R429-R431 PolarHBondContact O-N 3.47Å; R431-K434 PolarHBondContact O-N 3.11Å; R431-T435 PolarHBondContact O-N 3.33Å; R431-T435 PolarHBondContact O-OG1 3.48Å; R431-T435 VanDerWaalsContact O-OG1 3.05Å
432	V	78.7	Confident	73.5	Confident	108 Å²	108	103.4 Å²	103.4	66%	0.655	54%	0.535	S	S	*	.	H	α-helix	trans	-61.4	-43.7	176.1	172.8	0	0	0	0	111	A428 R429 K434 T435 G436	A428-V432 WeakPolarHBondContact O-CG2 3.35Å; A428-V432 PolarHBondContact O-N 2.72Å; R429-V432 PolarHBondContact O-N 3.43Å; V432-K434 PolarHBondContact O-N 3.3Å; V432-T435 PolarHBondContact O-N 3.03Å; V432-G436 PolarHBondContact O-N 3.01Å
433	A	77.1	Confident	72.9	Confident	66 Å²	66	101.5 Å²	101.5	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-41.4	176.4	0	0	0	0	0	112.5	R429 I430 G436 S437	R429-A433 WeakPolarHBondContact O-CB 3.08Å; R429-A433 PolarHBondContact O-N 3.08Å; I430-A433 PolarHBondContact O-N 3.32Å; A433-G436 PolarHBondContact O-N 3.35Å; A433-S437 WeakPolarHBondContact O-CB 3.3Å; A433-S437 PolarHBondContact O-N 2.91Å
434	K	76.8	Confident	72.7	Confident	157 Å²	157	101.5 Å²	101.5	68%	0.683	54%	0.535	S	S	*	.	H	α-helix	trans	-67	-41.9	177.9	-169.3	173.5	-177.6	175.5	0	112.2	I430 R431 V432 S438	I430-K434 WeakPolarHBondContact O-CB 3.2Å; I430-K434 PolarHBondContact O-N 3.49Å; R431-K434 PolarHBondContact O-N 3.11Å; V432-K434 PolarHBondContact O-N 3.3Å; K434-S438 WeakPolarHBondContact O-CB 3.23Å; K434-S438 PolarHBondContact O-N 2.62Å; K434-S438 PolarHBondContact O-OG 3.03Å
435	T	73.1	Confident	72.4	Confident	72 Å²	72	100.7 Å²	100.7	44%	0.442	53%	0.532	S	S	.	.	H	α-helix	trans	-67.1	-40.3	174.1	-55.4	0	0	0	0	111.2	R431 V432 S438 N439	R431-T435 PolarHBondContact O-N 3.33Å; R431-T435 PolarHBondContact O-OG1 3.48Å; R431-T435 VanDerWaalsContact O-OG1 3.05Å; V432-T435 PolarHBondContact O-N 3.03Å; T435-S438 PolarHBondContact O-N 3.12Å; T435-N439 WeakPolarHBondContact O-CB 3.1Å; T435-N439 PolarHBondContact O-N 3.43Å
436	G	69.9	Low	72.1	Confident	40 Å²	40	106.5 Å²	106.5	41%	0.412	54%	0.544	S	S	.	.	H	α-helix	trans	-60.6	-45.4	174.8	0	0	0	0	0	112.5	V432 A433 N439 A440	V432-G436 PolarHBondContact O-N 3.01Å; A433-G436 PolarHBondContact O-N 3.35Å; G436-N439 PolarHBondContact O-N 3.46Å; G436-A440 WeakPolarHBondContact O-CB 2.98Å; G436-A440 PolarHBondContact O-N 2.8Å
437	S	70.6	Confident	71.4	Confident	85 Å²	85	100.9 Å²	100.9	59%	0.594	53%	0.528	S	S	*	.	H	α-helix	trans	-66.9	-38.1	177.5	-159	0	0	0	0	112.4	A433 A440 Y441	A433-S437 WeakPolarHBondContact O-CB 3.3Å; A433-S437 PolarHBondContact O-N 2.91Å; S437-A440 PolarHBondContact O-N 3.5Å; S437-Y441 WeakPolarHBondContact O-CB 3.29Å; S437-Y441 PolarHBondContact O-N 3.28Å
438	S	68.8	Low	70.9	Confident	61 Å²	61	99.7 Å²	99.7	43%	0.427	53%	0.531	S	S	.	.	H	α-helix	trans	-66.3	-40.8	174.6	-56.3	0	0	0	0	112.2	K434 T435 Y441 L442	K434-S438 WeakPolarHBondContact O-CB 3.23Å; K434-S438 PolarHBondContact O-N 2.62Å; K434-S438 PolarHBondContact O-OG 3.03Å; T435-S438 PolarHBondContact O-N 3.12Å; S438-Y441 PolarHBondContact O-N 3.45Å; S438-L442 WeakPolarHBondContact O-CG 3.24Å; S438-L442 PolarHBondContact O-N 3Å
439	N	65.6	Low	70.6	Confident	97 Å²	97	102.3 Å²	102.3	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-68.5	-38	175.6	-78	-16.9	0	0	0	112.1	T435 G436 L442 H443	T435-N439 WeakPolarHBondContact O-CB 3.1Å; T435-N439 PolarHBondContact O-N 3.43Å; G436-N439 PolarHBondContact O-N 3.46Å; N439-L442 PolarHBondContact O-N 3.46Å; N439-H443 WeakPolarHBondContact O-CB 3.39Å; N439-H443 PolarHBondContact O-N 3.49Å
440	A	63.4	Low	70	Confident	62 Å²	62	98 Å²	98	51%	0.512	53%	0.528	S	S	.	.	H	α-helix	trans	-63	-43.1	174.2	0	0	0	0	0	111.6	G436 S437 H443 S444	G436-A440 WeakPolarHBondContact O-CB 2.98Å; G436-A440 PolarHBondContact O-N 2.8Å; S437-A440 PolarHBondContact O-N 3.5Å; A440-H443 PolarHBondContact O-N 2.83Å; A440-S444 PolarHBondContact O-N 3.27Å
441	Y	68.2	Low	69.2	Low	159 Å²	159	97.9 Å²	97.9	62%	0.624	53%	0.529	S	S	*	.	H	α-helix	trans	-61.7	-46.4	173.9	177.5	-98.5	0	0	0	112.3	S437 S438 H443 S444 K445	S437-Y441 WeakPolarHBondContact O-CB 3.29Å; S437-Y441 PolarHBondContact O-N 3.28Å; S438-Y441 PolarHBondContact O-N 3.45Å; Y441-H443 VanDerWaalsContact C-N 3.32Å; Y441-H443 PolarHBondContact O-N 3.36Å; Y441-S444 PolarHBondContact O-N 3.47Å; Y441-K445 PolarHBondContact O-N 3.49Å
442	L	66.9	Low	68.4	Low	104 Å²	104	94.8 Å²	94.8	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-62.8	-37.9	176.8	-73.8	174.5	0	0	0	112.4	S438 N439 K445 R446	S438-L442 WeakPolarHBondContact O-CG 3.24Å; S438-L442 PolarHBondContact O-N 3Å; N439-L442 PolarHBondContact O-N 3.46Å; L442-K445 PolarHBondContact O-N 3.37Å; L442-R446 WeakPolarHBondContact O-CB 3.24Å; L442-R446 PolarHBondContact O-N 3.45Å
443	H	64.3	Low	67.5	Low	98 Å²	98	92.2 Å²	92.2	45%	0.454	51%	0.512	S	S	.	.	H	α-helix	trans	-67.8	-41.6	176.9	-164.1	-88.5	0	0	0	112	N439 A440 Y441 R446 N447	N439-H443 WeakPolarHBondContact O-CB 3.39Å; N439-H443 PolarHBondContact O-N 3.49Å; A440-H443 PolarHBondContact O-N 2.83Å; Y441-H443 VanDerWaalsContact C-N 3.32Å; Y441-H443 PolarHBondContact O-N 3.36Å; H443-R446 PolarHBondContact O-N 3.44Å; H443-N447 PolarHBondContact CE1-ND2 3.44Å; H443-N447 VanDerWaalsContact CE1-ND2 3.31Å; H443-N447 PolarHBondContact ND1-ND2 3.34Å; H443-N447 WeakPolarHBondContact O-CB 3.39Å; H443-N447 VanDerWaalsContact O-CG 3.28Å; H443-N447 PolarHBondContact O-N 3.49Å; H443-N447 PolarHBondContact O-OD1 3.15Å
444	S	68.5	Low	66.5	Low	78 Å²	78	94.3 Å²	94.3	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-60.5	-45.3	173.5	176.1	0	0	0	0	111.6	A440 Y441 R446 N447 G448	A440-S444 PolarHBondContact O-N 3.27Å; Y441-S444 PolarHBondContact O-N 3.47Å; S444-R446 PolarHBondContact O-N 3.06Å; S444-N447 PolarHBondContact O-N 3.37Å; S444-G448 PolarHBondContact O-N 3.1Å
445	K	67.6	Low	65.5	Low	123 Å²	123	94.4 Å²	94.4	54%	0.535	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-40.4	176.8	-171.6	174.2	-178.4	175.9	0	112.7	Y441 L442 G448 L449	Y441-K445 PolarHBondContact O-N 3.49Å; L442-K445 PolarHBondContact O-N 3.37Å; K445-G448 PolarHBondContact O-N 3.47Å; K445-L449 PolarHBondContact O-N 3.09Å; K445-L449 VanDerWaalsContact O-N 3.07Å
446	R	69.8	Low	64.7	Low	168 Å²	168	98 Å²	98	63%	0.634	53%	0.532	S	S	*	.	H	α-helix	trans	-65.2	-40.7	176.4	-167.8	179	75.5	137.9	1	111.8	L442 H443 S444 L449 L450	L442-R446 WeakPolarHBondContact O-CB 3.24Å; L442-R446 PolarHBondContact O-N 3.45Å; H443-R446 PolarHBondContact O-N 3.44Å; S444-R446 PolarHBondContact O-N 3.06Å; R446-L449 PolarHBondContact O-N 2.92Å; R446-L450 WeakPolarHBondContact O-CB 3.36Å; R446-L450 PolarHBondContact O-N 3.43Å
447	N	65.1	Low	63.9	Low	64 Å²	64	101.6 Å²	101.6	34%	0.342	55%	0.546	S	S	.	.	H	α-helix	trans	-69.2	-36.3	176.8	-72.7	6.6	0	0	0	112	H443 S444 L450 N451	H443-N447 PolarHBondContact CE1-ND2 3.44Å; H443-N447 VanDerWaalsContact CE1-ND2 3.31Å; H443-N447 PolarHBondContact ND1-ND2 3.34Å; H443-N447 WeakPolarHBondContact O-CB 3.39Å; H443-N447 VanDerWaalsContact O-CG 3.28Å; H443-N447 PolarHBondContact O-N 3.49Å; H443-N447 PolarHBondContact O-OD1 3.15Å; S444-N447 PolarHBondContact O-N 3.37Å; N447-L450 PolarHBondContact O-N 3.11Å; N447-N451 PolarHBondContact O-N 3.16Å
448	G	65.9	Low	62.5	Low	39 Å²	39	100.4 Å²	100.4	40%	0.402	55%	0.547	S	S	.	.	H	α-helix	trans	-59.9	-48.5	172.2	0	0	0	0	0	112.2	S444 K445 L450 N451 E452	S444-G448 PolarHBondContact O-N 3.1Å; K445-G448 PolarHBondContact O-N 3.47Å; G448-L450 VanDerWaalsContact C-N 3.32Å; G448-L450 PolarHBondContact O-N 3.22Å; G448-N451 PolarHBondContact O-N 3.41Å; G448-E452 PolarHBondContact O-N 3.28Å
449	L	70.1	Confident	61.1	Low	105 Å²	105	103.9 Å²	103.9	55%	0.55	57%	0.566	S	S	.	*	H	α-helix	trans	-64.4	-33.4	175.7	-84.6	166.8	0	0	0	113.4	K445 R446 A453	K445-L449 PolarHBondContact O-N 3.09Å; K445-L449 VanDerWaalsContact O-N 3.07Å; R446-L449 PolarHBondContact O-N 2.92Å; L449-A453 WeakPolarHBondContact O-CB 3.49Å; L449-A453 PolarHBondContact O-N 2.96Å
450	L	65.5	Low	59.8	Low	102 Å²	102	105 Å²	105	53%	0.534	58%	0.578	S	S	.	*	H	α-helix	trans	-68.4	-40.1	176.5	-167	82.8	0	0	0	111.5	R446 N447 G448 A453 L454	R446-L450 WeakPolarHBondContact O-CB 3.36Å; R446-L450 PolarHBondContact O-N 3.43Å; N447-L450 PolarHBondContact O-N 3.11Å; G448-L450 VanDerWaalsContact C-N 3.32Å; G448-L450 PolarHBondContact O-N 3.22Å; L450-A453 PolarHBondContact O-N 3.4Å; L450-L454 HydrophobicContact CG-CD1 4.24Å; L450-L454 WeakPolarHBondContact O-CD1 3.46Å; L450-L454 PolarHBondContact O-N 2.89Å
451	N	60.1	Low	58.3	Low	88 Å²	88	111 Å²	111	47%	0.471	60%	0.596	S	S	.	*	H	α-helix	trans	-65.7	-43	175.6	-80.6	5.6	0	0	0	111.4	N447 G448 A453 L454 E455	N447-N451 PolarHBondContact O-N 3.16Å; G448-N451 PolarHBondContact O-N 3.41Å; N451-A453 VanDerWaalsContact C-N 3.29Å; N451-A453 PolarHBondContact O-N 2.99Å; N451-L454 PolarHBondContact O-N 3.24Å; N451-L454 VanDerWaalsContact O-N 3.13Å; N451-E455 PolarHBondContact O-N 3.28Å
452	E	61.4	Low	56.6	Low	115 Å²	115	112.5 Å²	112.5	54%	0.537	61%	0.608	S	S	.	*	H	α-helix	trans	-62.5	-36.7	176.2	-164.9	174.6	169.1	0	0	111.7	G448 L456	G448-E452 PolarHBondContact O-N 3.28Å; E452-L456 WeakPolarHBondContact O-CD1 3.16Å; E452-L456 PolarHBondContact O-N 3.17Å
453	A	58.4	Low	55.3	Low	53 Å²	53	116.8 Å²	116.8	44%	0.438	63%	0.626	S	S	.	*	H	α-helix	trans	-70.7	-33.9	173.1	0	0	0	0	0	113.4	L449 L450 N451 T457	L449-A453 WeakPolarHBondContact O-CB 3.49Å; L449-A453 PolarHBondContact O-N 2.96Å; L450-A453 PolarHBondContact O-N 3.4Å; N451-A453 VanDerWaalsContact C-N 3.29Å; N451-A453 PolarHBondContact O-N 2.99Å; A453-T457 PolarHBondContact O-OG1 2.92Å
454	L	56.6	Low	53.8	Low	111 Å²	111	120 Å²	120	58%	0.581	64%	0.641	S	S	*	*	H	α-helix	trans	-68.4	-39.7	175	-109.4	95.5	0	0	0	111.7	L450 N451 L456 T457 G458	L450-L454 HydrophobicContact CG-CD1 4.24Å; L450-L454 WeakPolarHBondContact O-CD1 3.46Å; L450-L454 PolarHBondContact O-N 2.89Å; N451-L454 PolarHBondContact O-N 3.24Å; N451-L454 VanDerWaalsContact O-N 3.13Å; L454-L456 VanDerWaalsContact C-N 3.26Å; L454-L456 PolarHBondContact O-N 3.44Å; L454-T457 PolarHBondContact O-N 3.28Å; L454-T457 VanDerWaalsContact O-N 3.11Å; L454-T457 PolarHBondContact O-OG1 3.47Å; L454-G458 PolarHBondContact O-N 2.83Å
455	E	55.2	Low	52	Low	159 Å²	159	124.5 Å²	124.5	74%	0.743	66%	0.655	S	S	*	*	H	α-helix	trans	-63.1	-31.1	177	-77.1	-179.5	169.3	0	0	112.6	N451 T457	N451-E455 PolarHBondContact O-N 3.28Å; E455-T457 PolarHBondContact O-N 2.96Å
456	L	56.3	Low	50.4	Low	148 Å²	148	121.7 Å²	121.7	78%	0.775	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-6	176.1	-77.2	158.5	0	0	0	114.2	E452 L454	E452-L456 WeakPolarHBondContact O-CD1 3.16Å; E452-L456 PolarHBondContact O-N 3.17Å; L454-L456 VanDerWaalsContact C-N 3.26Å; L454-L456 PolarHBondContact O-N 3.44Å
457	T	54.7	Low	48.9	Very low	115 Å²	115	122.6 Å²	122.6	71%	0.706	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	2.1	-178.4	44.3	0	0	0	0	115.1	A453 L454 E455	A453-T457 PolarHBondContact O-OG1 2.92Å; L454-T457 PolarHBondContact O-N 3.28Å; L454-T457 VanDerWaalsContact O-N 3.11Å; L454-T457 PolarHBondContact O-OG1 3.47Å; E455-T457 PolarHBondContact O-N 2.96Å
458	G	40	Very low	47.7	Very low	60 Å²	60	125.7 Å²	125.7	62%	0.619	69%	0.691	S	S	*	*			trans	-95.4	121.3	-179.1	0	0	0	0	0	113.9	L454	L454-G458 PolarHBondContact O-N 2.83Å
459	T	39.2	Very low	46.9	Very low	134 Å²	134	128.6 Å²	128.6	82%	0.822	70%	0.701	S	S	*	*			trans	-70	151.6	165.4	45.2	0	0	0	0	111.3	E461	T459-E461 PolarHBondContact O-N 3.36Å
460	P	38.4	Very low	46.1	Very low	120 Å²	120	127.1 Å²	127.1	78%	0.779	70%	0.7	S	S	*	*			trans	-84.3	114	-171.4	33.1	-28.3	0	0	0	109.9
461	E	32.4	Very low	45.4	Very low	188 Å²	188	127.6 Å²	127.6	88%	0.879	70%	0.702	S	S	*	*			trans	-164.7	134.2	151.7	-109.3	163.5	-152.5	0	0	111.1	T459	T459-E461 PolarHBondContact O-N 3.36Å
462	E	32	Very low	45	Very low	190 Å²	190	129.9 Å²	129.9	89%	0.888	71%	0.713	S	S	*	*			trans	81	110	167.4	-60.2	-168.6	155.7	0	0	120.9	H464	E462-H464 PolarHBondContact O-N 2.94Å
463	E	40.6	Very low	44.5	Very low	195 Å²	195	129.6 Å²	129.6	91%	0.911	71%	0.711	S	S	*	*			trans	-59	115.5	157.9	-70.9	173.8	117.8	0	0	111.8
464	H	31.9	Very low	44.3	Very low	165 Å²	165	130.4 Å²	130.4	76%	0.764	71%	0.714	S	S	*	*				-178.5	137.4	126.1	-133.6	58	0	0	0	112.3	E462	E462-H464 PolarHBondContact O-N 2.94Å
465	M	31.7	Very low	44.2	Very low	173 Å²	173	130.9 Å²	130.9	85%	0.852	71%	0.713	S	S	*	*			trans	78.1	109.4	152.1	-147.7	98.2	76	0	0	119
466	G	32.3	Very low	44.4	Very low	64 Å²	64	128.8 Å²	128.8	66%	0.66	70%	0.703	S	S	*	*			trans	158.9	70.8	155	0	0	0	0	0	116.2	T468	G466-T468 PolarHBondContact O-N 3.13Å
467	K	39.4	Very low	44.4	Very low	187 Å²	187	127.3 Å²	127.3	81%	0.813	69%	0.692	S	S	*	*			trans	-57.3	100.2	168	-70.4	173.5	175.9	175.9	0	110.6	T469	K467-T469 VanDerWaalsContact C-N 3.29Å; K467-T469 PolarHBondContact O-N 2.99Å
468	T	38.8	Very low	44.7	Very low	128 Å²	128	127.9 Å²	127.9	79%	0.785	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	48.4	167.8	47.8	0	0	0	0	111.9	G466	G466-T468 PolarHBondContact O-N 3.13Å
469	T	49.8	Very low	46	Very low	100 Å²	100	130.4 Å²	130.4	61%	0.613	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	14.1	161.3	27.9	0	0	0	0	112	K467 E473	K467-T469 VanDerWaalsContact C-N 3.29Å; K467-T469 PolarHBondContact O-N 2.99Å; T469-E473 WeakPolarHBondContact O-CB 3.47Å
470	S	52.6	Low	47.1	Very low	75 Å²	75	127.9 Å²	127.9	52%	0.524	67%	0.666	S	S	.	*	H	α-helix	trans	-90.5	-15.4	-162.4	73.6	0	0	0	0	116.9	S474	S470-S474 WeakPolarHBondContact O-CB 3.31Å; S470-S474 PolarHBondContact O-N 3.14Å; S470-S474 PolarHBondContact O-OG 3.42Å
471	L	50.7	Low	48	Very low	112 Å²	112	127.5 Å²	127.5	59%	0.586	65%	0.654	S	S	*	*	H	α-helix	trans	-88.7	-43.5	-169.5	-153.6	150.4	0	0	0	113.2	Q475	L471-Q475 HydrophobicContact CD2-CG 4.32Å; L471-Q475 VanDerWaalsContact O-CB 3.28Å; L471-Q475 WeakPolarHBondContact O-CB 3.49Å; L471-Q475 VanDerWaalsContact O-CG 3.23Å; L471-Q475 WeakPolarHBondContact O-CG 3.41Å; L471-Q475 PolarHBondContact O-N 2.74Å
472	I	52.6	Low	49.6	Very low	136 Å²	136	121.6 Å²	121.6	70%	0.697	63%	0.632	S	S	*	*	H	α-helix	trans	-72.5	-39.3	174.6	-71.8	167.4	0	0	0	110.2	Q475 H476	I472-Q475 PolarHBondContact O-N 3.08Å; I472-H476 WeakPolarHBondContact O-CB 3.46Å; I472-H476 PolarHBondContact O-N 3.18Å
473	E	51.8	Low	50.7	Low	108 Å²	108	116.7 Å²	116.7	51%	0.505	61%	0.612	S	S	.	*	H	α-helix	trans	-68.9	-39.6	178.5	-162.6	168.5	-166.1	0	0	111.5	T469 H476 H477	T469-E473 WeakPolarHBondContact O-CB 3.47Å; E473-H476 PolarHBondContact O-N 2.89Å; E473-H477 WeakPolarHBondContact O-CB 3.41Å; E473-H477 PolarHBondContact O-CD2 2.87Å; E473-H477 VanDerWaalsContact O-CD2 3.31Å; E473-H477 PolarHBondContact O-N 2.74Å
474	S	53.4	Low	51.6	Low	70 Å²	70	113.8 Å²	113.8	49%	0.49	60%	0.598	S	S	.	*	H	α-helix	trans	-71.9	-34.7	173.7	93.3	0	0	0	0	112.8	S470 H478	S470-S474 WeakPolarHBondContact O-CB 3.31Å; S470-S474 PolarHBondContact O-N 3.14Å; S470-S474 PolarHBondContact O-OG 3.42Å; S474-H478 VanDerWaalsContact O-CB 3.25Å; S474-H478 WeakPolarHBondContact O-CB 3.33Å; S474-H478 PolarHBondContact O-N 3.19Å
475	Q	54.3	Low	52.7	Low	121 Å²	121	114.1 Å²	114.1	57%	0.565	60%	0.598	S	S	*	*	H	α-helix	trans	-67.8	-37.8	174.1	-77.5	-172.7	-1.5	0	0	111.5	L471 I472 H478 L479	L471-Q475 HydrophobicContact CD2-CG 4.32Å; L471-Q475 VanDerWaalsContact O-CB 3.28Å; L471-Q475 WeakPolarHBondContact O-CB 3.49Å; L471-Q475 VanDerWaalsContact O-CG 3.23Å; L471-Q475 WeakPolarHBondContact O-CG 3.41Å; L471-Q475 PolarHBondContact O-N 2.74Å; I472-Q475 PolarHBondContact O-N 3.08Å; Q475-H478 PolarHBondContact O-N 3.49Å; Q475-L479 WeakPolarHBondContact O-CB 3.23Å; Q475-L479 PolarHBondContact O-N 3.48Å
476	H	59.2	Low	53.4	Low	116 Å²	116	111.4 Å²	111.4	54%	0.537	59%	0.591	S	S	.	*	H	α-helix	trans	-66.2	-45.2	175.2	-170.5	72.4	0	0	0	111.7	I472 E473 H478 L479 L480	I472-H476 WeakPolarHBondContact O-CB 3.46Å; I472-H476 PolarHBondContact O-N 3.18Å; E473-H476 PolarHBondContact O-N 2.89Å; H476-H478 PolarHBondContact O-N 2.93Å; H476-L479 PolarHBondContact O-N 3.06Å; H476-L480 WeakPolarHBondContact O-CB 3.29Å; H476-L480 WeakPolarHBondContact O-CG 3.23Å; H476-L480 PolarHBondContact O-N 2.89Å
477	H	55.5	Low	54.3	Low	117 Å²	117	113.4 Å²	113.4	54%	0.542	59%	0.59	S	S	.	*	H	α-helix	trans	-64.3	-38	174.5	-89.5	-67.4	0	0	0	113	E473 L479 L480 H481	E473-H477 WeakPolarHBondContact O-CB 3.41Å; E473-H477 PolarHBondContact O-CD2 2.87Å; E473-H477 VanDerWaalsContact O-CD2 3.31Å; E473-H477 PolarHBondContact O-N 2.74Å; H477-L479 VanDerWaalsContact C-N 3.34Å; H477-L480 PolarHBondContact O-N 3.48Å; H477-H481 VanDerWaalsContact O-CB 3.25Å; H477-H481 WeakPolarHBondContact O-CB 3.45Å; H477-H481 PolarHBondContact O-N 3.39Å
478	H	61.7	Low	54.4	Low	127 Å²	127	107.7 Å²	107.7	59%	0.588	59%	0.585	S	S	*	*	H	α-helix	trans	-68.1	-35.3	175.3	-167.4	-62.6	0	0	0	111.7	S474 Q475 H476 C482	S474-H478 VanDerWaalsContact O-CB 3.25Å; S474-H478 WeakPolarHBondContact O-CB 3.33Å; S474-H478 PolarHBondContact O-N 3.19Å; Q475-H478 PolarHBondContact O-N 3.49Å; H476-H478 PolarHBondContact O-N 2.93Å; H478-C482 WeakPolarHBondContact O-CB 3.39Å; H478-C482 PolarHBondContact O-N 3.01Å
479	L	67.6	Low	54.4	Low	113 Å²	113	109.5 Å²	109.5	59%	0.592	59%	0.589	S	S	*	*	H	α-helix	trans	-70.1	-42.1	176	-137.4	108.4	0	0	0	111.6	Q475 H476 H477 C482 L483	Q475-L479 WeakPolarHBondContact O-CB 3.23Å; Q475-L479 PolarHBondContact O-N 3.48Å; H476-L479 PolarHBondContact O-N 3.06Å; H477-L479 VanDerWaalsContact C-N 3.34Å; L479-C482 PolarHBondContact O-N 3.37Å; L479-L483 HydrophobicContact CD2-CD1 4.14Å; L479-L483 WeakPolarHBondContact O-CB 3.47Å; L479-L483 WeakPolarHBondContact O-CG 3.39Å; L479-L483 PolarHBondContact O-N 3.07Å
480	L	61.3	Low	53.8	Low	81 Å²	81	109.8 Å²	109.8	42%	0.424	60%	0.595	S	S	.	*	H	α-helix	trans	-62.3	-44.1	174.5	-79.4	168.3	0	0	0	111.4	H476 H477 L483 E484	H476-L480 WeakPolarHBondContact O-CB 3.29Å; H476-L480 WeakPolarHBondContact O-CG 3.23Å; H476-L480 PolarHBondContact O-N 2.89Å; H477-L480 PolarHBondContact O-N 3.48Å; L480-L483 PolarHBondContact O-N 3.39Å; L480-E484 VanDerWaalsContact O-CB 3.22Å; L480-E484 WeakPolarHBondContact O-CB 3.22Å; L480-E484 PolarHBondContact O-N 3.49Å
481	H	58.4	Low	52.8	Low	112 Å²	112	116.4 Å²	116.4	52%	0.519	61%	0.61	S	S	.	*	H	α-helix	trans	-68.2	-36.1	177.1	-175.4	-90.2	0	0	0	112.4	H477 K485	H477-H481 VanDerWaalsContact O-CB 3.25Å; H477-H481 WeakPolarHBondContact O-CB 3.45Å; H477-H481 PolarHBondContact O-N 3.39Å; H481-K485 VanDerWaalsContact O-CB 3.25Å; H481-K485 WeakPolarHBondContact O-CB 3.12Å; H481-K485 PolarHBondContact O-N 2.83Å
482	C	65.4	Low	52	Low	63 Å²	63	119.5 Å²	119.5	43%	0.426	63%	0.626	S	S	.	*	H	α-helix	trans	-65.2	-42.8	170.9	-86.5	0	0	0	0	111.8	H478 L479 K485 T486	H478-C482 WeakPolarHBondContact O-CB 3.39Å; H478-C482 PolarHBondContact O-N 3.01Å; L479-C482 PolarHBondContact O-N 3.37Å; C482-K485 PolarHBondContact O-N 3.07Å; C482-T486 PolarHBondContact O-N 3.21Å; C482-T486 VanDerWaalsContact O-N 3.07Å; C482-T486 PolarHBondContact O-OG1 2.96Å
483	L	55.3	Low	51.1	Low	88 Å²	88	118.3 Å²	118.3	46%	0.461	63%	0.625	S	S	.	*	H	α-helix	trans	-63.6	-49.1	177.6	-83.6	162.7	0	0	0	111.3	L479 L480 K485 T486 T487	L479-L483 HydrophobicContact CD2-CD1 4.14Å; L479-L483 WeakPolarHBondContact O-CB 3.47Å; L479-L483 WeakPolarHBondContact O-CG 3.39Å; L479-L483 PolarHBondContact O-N 3.07Å; L480-L483 PolarHBondContact O-N 3.39Å; L483-K485 VanDerWaalsContact C-N 3.28Å; L483-K485 PolarHBondContact O-N 2.74Å; L483-T486 VanDerWaalsContact CA-OG1 3.29Å; L483-T486 WeakPolarHBondContact CA-OG1 3.3Å; L483-T486 CarbonylContact O-C 3.55Å; L483-T486 WeakPolarHBondContact O-CA 3.28Å; L483-T486 PolarHBondContact O-N 3.23Å; L483-T486 PolarHBondContact O-OG1 3.31Å; L483-T487 PolarHBondContact O-N 3.31Å; L483-T487 PolarHBondContact O-OG1 3Å
484	E	60.3	Low	50.3	Low	133 Å²	133	120.6 Å²	120.6	62%	0.621	64%	0.64	S	S	*	*	H	α-helix	trans	-60.3	-36.2	177.6	-168.8	175.6	-159.4	0	0	112	L480 T486 T487 G488	L480-E484 VanDerWaalsContact O-CB 3.22Å; L480-E484 WeakPolarHBondContact O-CB 3.22Å; L480-E484 PolarHBondContact O-N 3.49Å; E484-T486 VanDerWaalsContact C-N 3.34Å; E484-T487 WeakPolarHBondContact CA-OG1 3.42Å; E484-T487 PolarHBondContact O-N 2.87Å; E484-G488 WeakPolarHBondContact O-CA 3.42Å; E484-G488 PolarHBondContact O-N 3.41Å
485	K	53.7	Low	49.1	Very low	173 Å²	173	124.9 Å²	124.9	75%	0.752	66%	0.658	S	S	*	*	H	α-helix	trans	-73.5	-25	174.7	-156.8	176.7	-173.5	-177.5	0	113.2	H481 C482 L483	H481-K485 VanDerWaalsContact O-CB 3.25Å; H481-K485 WeakPolarHBondContact O-CB 3.12Å; H481-K485 PolarHBondContact O-N 2.83Å; C482-K485 PolarHBondContact O-N 3.07Å; L483-K485 VanDerWaalsContact C-N 3.28Å; L483-K485 PolarHBondContact O-N 2.74Å
486	T	48	Very low	48.4	Very low	116 Å²	116	124.1 Å²	124.1	71%	0.712	66%	0.663	S	S	*	*	H	α-helix	trans	-86.8	-22.6	171.5	40	0	0	0	0	114	C482 L483 E484	C482-T486 PolarHBondContact O-N 3.21Å; C482-T486 VanDerWaalsContact O-N 3.07Å; C482-T486 PolarHBondContact O-OG1 2.96Å; L483-T486 VanDerWaalsContact CA-OG1 3.29Å; L483-T486 WeakPolarHBondContact CA-OG1 3.3Å; L483-T486 CarbonylContact O-C 3.55Å; L483-T486 WeakPolarHBondContact O-CA 3.28Å; L483-T486 PolarHBondContact O-N 3.23Å; L483-T486 PolarHBondContact O-OG1 3.31Å; E484-T486 VanDerWaalsContact C-N 3.34Å
487	T	50.8	Low	47.3	Very low	105 Å²	105	126.4 Å²	126.4	64%	0.644	68%	0.679	S	S	*	*	H	α-helix	trans	-107	-4.5	-178	55.5	0	0	0	0	114.3	L483 E484 L489	L483-T487 PolarHBondContact O-N 3.31Å; L483-T487 PolarHBondContact O-OG1 3Å; E484-T487 WeakPolarHBondContact CA-OG1 3.42Å; E484-T487 PolarHBondContact O-N 2.87Å; T487-L489 VanDerWaalsContact C-N 3.33Å; T487-L489 PolarHBondContact O-N 2.98Å
488	G	40.3	Very low	46	Very low	68 Å²	68	128.4 Å²	128.4	70%	0.701	69%	0.693	S	S	*	*			trans	-70	77.4	-177.2	0	0	0	0	0	114.5	E484	E484-G488 WeakPolarHBondContact O-CA 3.42Å; E484-G488 PolarHBondContact O-N 3.41Å
489	L	40.6	Very low	44.4	Very low	165 Å²	165	127.3 Å²	127.3	86%	0.864	70%	0.699	S	S	*	*			trans	-119.9	125.9	151.6	-162.1	77.9	0	0	0	109.1	T487	T487-L489 VanDerWaalsContact C-N 3.33Å; T487-L489 PolarHBondContact O-N 2.98Å
490	S	36.8	Very low	42.7	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	71%	0.71	S	S	*	*			trans	92.7	106.3	160.5	-152.1	0	0	0	0	117.8
491	Y	31.1	Very low	41.1	Very low	215 Å²	215	135.8 Å²	135.8	84%	0.843	73%	0.732	S	S	*	*			trans	-156.8	105.2	131	-110.9	-82.2	0	0	0	108.6	V493	Y491-V493 HydrophobicContact CD1-CG2 4.29Å; Y491-V493 HydrophobicContact CE1-CG2 4.39Å
492	L	33.9	Very low	40	Very low	176 Å²	176	137 Å²	137	92%	0.921	75%	0.748	S	S	*	*			trans	-143.7	120.2	146.1	-95.1	-179.5	0	0	0	108.5
493	V	34	Very low	38.1	Very low	112 Å²	112	139.3 Å²	139.3	68%	0.679	77%	0.765	S	S	*	*			trans	-79.8	151.4	178	171.8	0	0	0	0	109.6	Y491	Y491-V493 HydrophobicContact CD1-CG2 4.29Å; Y491-V493 HydrophobicContact CE1-CG2 4.39Å
494	D	33.7	Very low	36.8	Very low	155 Å²	155	141.6 Å²	141.6	83%	0.829	78%	0.782	S	S	*	*			trans	-49.9	151.4	-167.1	-62.7	-72.9	0	0	0	119.2
495	D	28.2	Very low	35.3	Very low	161 Å²	161	142.8 Å²	142.8	86%	0.861	79%	0.792	S	S	*	*			trans	-144.6	136.9	137.2	-140.3	-3.9	0	0	0	109.3
496	P	41.6	Very low	34.1	Very low	104 Å²	104	144 Å²	144	68%	0.675	80%	0.797	S	S	*	*			trans	-100.1	109.8	-168.4	34.3	-23.8	0	0	0	111.5
497	L	34.6	Very low	33.3	Very low	164 Å²	164	145.8 Å²	145.8	86%	0.859	80%	0.802	S	S	*	*			trans	179.6	129.6	145.3	-99.2	150.1	0	0	0	111.6
498	L	29.6	Very low	32.4	Very low	160 Å²	160	149.9 Å²	149.9	84%	0.838	81%	0.813	S	S	*	*			trans	79.7	117.8	166.4	-93.7	92.4	0	0	0	121.1
499	S	26.3	Very low	32	Very low	103 Å²	103	155 Å²	155	72%	0.72	82%	0.819	S	S	*	*			trans	83.8	94.8	131.2	-174.8	0	0	0	0	120.1
500	V	33	Very low	31.5	Very low	135 Å²	135	157 Å²	157	82%	0.818	82%	0.821	S	S	*	*			trans	10.9	114.7	135.3	-175.6	0	0	0	0	117
501	R	26.8	Very low	31.5	Very low	238 Å²	238	158.7 Å²	158.7	90%	0.898	82%	0.82	S	S	*	*			trans	-154.5	115.5	138.6	-152	173.4	-114.7	171.8	-1.8	111.4
502	T	35.2	Very low	31.8	Very low	137 Å²	137	153.6 Å²	153.6	84%	0.84	81%	0.808	S	S	*	*			trans	-60	126.4	166	24.6	0	0	0	0	110.4
503	S	26.9	Very low	32.1	Very low	112 Å²	112	153.3 Å²	153.3	78%	0.783	80%	0.802	S	S	*	*			trans	-144.3	123.9	159	66.3	0	0	0	0	112.3
504	T	27.7	Very low	32.2	Very low	135 Å²	135	154.8 Å²	154.8	83%	0.828	80%	0.801	S	S	*	*			trans	-45.1	128.2	178	-35.6	0	0	0	0	114.4	K506	T504-K506 PolarHBondContact O-N 3.03Å
505	I	28.1	Very low	32.4	Very low	159 Å²	159	153.2 Å²	153.2	82%	0.815	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.3	117.3	167.4	-64.1	170.1	0	0	0	108.2
506	K	30	Very low	33.1	Very low	198 Å²	198	152.6 Å²	152.6	86%	0.861	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-84.4	128.3	168.7	-86.3	-175.6	176.2	-179.3	0	109.5	T504	T504-K506 PolarHBondContact O-N 3.03Å
507	N	31.2	Very low	33	Very low	154 Å²	154	154.3 Å²	154.3	82%	0.824	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-55.2	139.6	172.5	-62.8	-36.4	0	0	0	111.7
508	H	30.9	Very low	33.1	Very low	190 Å²	190	153.3 Å²	153.3	88%	0.88	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-70.2	123.9	172.8	-147.1	-80.9	0	0	0	109.3
509	E	32	Very low	33.4	Very low	177 Å²	177	150 Å²	150	83%	0.827	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-75.1	135.1	179.8	-153.7	168.3	-177.4	0	0	109.8
510	F	30.3	Very low	34	Very low	205 Å²	205	148.4 Å²	148.4	90%	0.899	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-66.6	130.4	179.1	-127.1	-102.4	0	0	0	109.4	D512	F510-D512 PolarHBondContact O-N 3.26Å
511	I	35.5	Very low	34.1	Very low	142 Å²	142	149 Å²	149	73%	0.728	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-69	124.3	174.3	-68.5	179.8	0	0	0	109
512	D	37.7	Very low	34.4	Very low	108 Å²	108	144.1 Å²	144.1	58%	0.578	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-72	139.3	-174.6	-164	14.4	0	0	0	112.9	F510 Q514 M515	F510-D512 PolarHBondContact O-N 3.26Å; D512-Q514 PolarHBondContact O-N 3.47Å; D512-Q514 VanDerWaalsContact O-N 3.13Å; D512-M515 PolarHBondContact O-N 3.17Å
513	E	40.5	Very low	34.4	Very low	170 Å²	170	141.7 Å²	141.7	79%	0.794	71%	0.713	S	S	*	*	H	α-helix	trans	-61	-24.3	-171.1	-130.3	172.5	164	0	0	112.6	F516 E517	E513-F516 PolarHBondContact O-N 3.07Å; E513-E517 PolarHBondContact O-N 3.02Å
514	Q	36.5	Very low	34.7	Very low	143 Å²	143	140.9 Å²	140.9	67%	0.668	71%	0.707	S	S	*	*	H	α-helix	trans	-70.7	-31.1	179.4	-78.1	-172.8	-13.8	0	0	114	D512 F516 Q518	D512-Q514 PolarHBondContact O-N 3.47Å; D512-Q514 VanDerWaalsContact O-N 3.13Å; Q514-F516 VanDerWaalsContact C-N 3.27Å; Q514-F516 PolarHBondContact O-N 3.44Å; Q514-Q518 PolarHBondContact O-N 3.2Å
515	M	38.1	Very low	34.9	Very low	123 Å²	123	142.5 Å²	142.5	61%	0.606	71%	0.708	S	S	*	*	H	α-helix	trans	-74.2	-23.7	-179.7	-144.6	-162.1	-61.1	0	0	111.6	D512 N519	D512-M515 PolarHBondContact O-N 3.17Å; M515-N519 PolarHBondContact O-N 3.37Å; M515-N519 PolarHBondContact O-ND2 3.48Å
516	F	42.8	Very low	35.3	Very low	147 Å²	147	142.4 Å²	142.4	65%	0.645	70%	0.704	S	S	*	*	H	α-helix	trans	-76.8	-39.4	175.9	-175.4	-99.6	0	0	0	112.4	E513 Q514 Q518 N519 C520	E513-F516 PolarHBondContact O-N 3.07Å; Q514-F516 VanDerWaalsContact C-N 3.27Å; Q514-F516 PolarHBondContact O-N 3.44Å; F516-Q518 VanDerWaalsContact C-N 3.34Å; F516-Q518 PolarHBondContact O-N 3.42Å; F516-N519 PolarHBondContact O-N 2.88Å; F516-C520 PolarHBondContact O-N 2.55Å
517	E	39.5	Very low	35.2	Very low	140 Å²	140	139.6 Å²	139.6	65%	0.654	70%	0.698	S	S	*	*	H	α-helix	trans	-64.6	-38.3	175.8	-78.8	-168.8	145	0	0	112.2	E513 C520 M521	E513-E517 PolarHBondContact O-N 3.02Å; E517-C520 PolarHBondContact O-N 2.89Å; E517-M521 PolarHBondContact O-N 3.42Å; E517-M521 VanDerWaalsContact O-N 3.14Å
518	Q	35.6	Very low	35	Very low	143 Å²	143	143.7 Å²	143.7	67%	0.668	70%	0.704	S	S	*	*	H	α-helix	trans	-67.8	-38.7	179.1	-165.1	154.9	-10.5	0	0	112.2	Q514 F516 M521 E522	Q514-Q518 PolarHBondContact O-N 3.2Å; F516-Q518 VanDerWaalsContact C-N 3.34Å; F516-Q518 PolarHBondContact O-N 3.42Å; Q518-M521 PolarHBondContact O-N 3.46Å; Q518-E522 PolarHBondContact O-N 2.77Å
519	N	36.3	Very low	35.1	Very low	92 Å²	92	140.2 Å²	140.2	49%	0.492	70%	0.698	S	S	.	*	H	α-helix	trans	-70.1	-29.1	174.4	-74.5	-26	0	0	0	113.2	M515 F516 S523	M515-N519 PolarHBondContact O-N 3.37Å; M515-N519 PolarHBondContact O-ND2 3.48Å; F516-N519 PolarHBondContact O-N 2.88Å; N519-S523 PolarHBondContact O-N 2.91Å; N519-S523 PolarHBondContact O-OG 3.16Å; N519-S523 VanDerWaalsContact O-OG 3.13Å
520	C	38.7	Very low	34.9	Very low	68 Å²	68	137.4 Å²	137.4	46%	0.459	70%	0.698	S	S	.	*	H	α-helix	trans	-70.9	-36.5	174.1	-85.6	0	0	0	0	112.9	F516 E517 S524	F516-C520 PolarHBondContact O-N 2.55Å; E517-C520 PolarHBondContact O-N 2.89Å; C520-S524 PolarHBondContact O-N 2.99Å
521	M	36.8	Very low	34.9	Very low	147 Å²	147	134.4 Å²	134.4	72%	0.724	70%	0.697	S	S	*	*	H	α-helix	trans	-67.7	-40.1	176	-80.9	-160.8	173.8	0	0	112	E517 Q518 S523 S524	E517-M521 PolarHBondContact O-N 3.42Å; E517-M521 VanDerWaalsContact O-N 3.14Å; Q518-M521 PolarHBondContact O-N 3.46Å; M521-S523 VanDerWaalsContact C-N 3.34Å; M521-S523 PolarHBondContact O-N 3.03Å; M521-S524 PolarHBondContact O-N 2.89Å; M521-S524 PolarHBondContact O-OG 3.32Å
522	E	33.1	Very low	34.6	Very low	136 Å²	136	139.5 Å²	139.5	64%	0.636	71%	0.707	S	S	*	*	H	α-helix	trans	-68.1	-33.8	-178	-148.2	162.6	-159.5	0	0	112.3	Q518 S524	Q518-E522 PolarHBondContact O-N 2.77Å; E522-S524 VanDerWaalsContact C-N 3.33Å; E522-S524 PolarHBondContact O-N 3.19Å
523	S	34.1	Very low	34.2	Very low	87 Å²	87	139.8 Å²	139.8	61%	0.608	72%	0.717	S	S	*	*	H	α-helix	trans	-72.3	-21.3	175.5	-62.7	0	0	0	0	114.1	N519 M521	N519-S523 PolarHBondContact O-N 2.91Å; N519-S523 PolarHBondContact O-OG 3.16Å; N519-S523 VanDerWaalsContact O-OG 3.13Å; M521-S523 VanDerWaalsContact C-N 3.34Å; M521-S523 PolarHBondContact O-N 3.03Å
524	S	33.5	Very low	34.1	Very low	94 Å²	94	138 Å²	138	66%	0.657	72%	0.72	S	S	*	*	H	α-helix	trans	-80	-14.9	-178.2	72.4	0	0	0	0	114.1	C520 M521 E522	C520-S524 PolarHBondContact O-N 2.99Å; M521-S524 PolarHBondContact O-N 2.89Å; M521-S524 PolarHBondContact O-OG 3.32Å; E522-S524 VanDerWaalsContact C-N 3.33Å; E522-S524 PolarHBondContact O-N 3.19Å
525	M	32.5	Very low	33.7	Very low	170 Å²	170	136.4 Å²	136.4	84%	0.837	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-2.8	-178.9	-68	-139.8	74.3	0	0	114.5
526	Q	35.1	Very low	33.2	Very low	156 Å²	156	138.4 Å²	138.4	73%	0.729	74%	0.737	S	S	*	*	S	Bend	trans	-114.8	14.2	-165	-130.5	154.5	7	0	0	116.3
527	N	28.7	Very low	32.5	Very low	140 Å²	140	136.5 Å²	136.5	75%	0.749	74%	0.742	S	S	*	*			trans	-134.3	91	176.9	-78.6	-41.2	0	0	0	113
528	Y	27.6	Very low	32	Very low	239 Å²	239	134.5 Å²	134.5	94%	0.937	74%	0.744	S	S	*	*			trans	-136	110.8	153.4	-94.9	-82.4	0	0	0	108.8
529	P	31.9	Very low	31.6	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	75%	0.75	S	S	*	*			trans	-86.8	123.8	163.2	4	14.1	0	0	0	109.9
530	S	28.4	Very low	31.1	Very low	117 Å²	117	138.1 Å²	138.1	82%	0.818	77%	0.767	S	S	*	*			trans	-61.5	125.7	166	52.5	0	0	0	0	111.4
531	T	29.9	Very low	30.6	Very low	143 Å²	143	138.6 Å²	138.6	88%	0.877	78%	0.784	S	S	*	*			trans	-95.9	115.9	164.7	29.2	0	0	0	0	109.4
532	R	28.4	Very low	30.2	Very low	249 Å²	249	139.4 Å²	139.4	94%	0.94	79%	0.79	S	S	*	*			trans	-91.3	137.1	163.8	-100.9	-177.9	178.2	172.4	-0.5	108.5
533	S	29.3	Very low	30	Very low	113 Å²	113	138.1 Å²	138.1	79%	0.79	79%	0.791	S	S	*	*			trans	-108.7	152.3	164.6	-47.2	0	0	0	0	109.3
534	P	39	Very low	29.8	Very low	132 Å²	132	139.5 Å²	139.5	86%	0.857	80%	0.796	S	S	*	*			trans	-84.6	160.6	-172.5	34.6	-32.7	0	0	0	113.5
535	S	28.3	Very low	29.6	Very low	110 Å²	110	141 Å²	141	77%	0.769	80%	0.801	S	S	*	*			trans	-81.7	157.4	-167.2	51.1	0	0	0	0	116.9
536	L	27.9	Very low	29.5	Very low	165 Å²	165	138.8 Å²	138.8	86%	0.864	80%	0.801	S	S	*	*			trans	-161.7	122.8	139.5	-106.8	140.2	0	0	0	112.4
537	S	27.5	Very low	29.1	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	81%	0.806	S	S	*	*			trans	52.3	136.6	157.4	57.1	0	0	0	0	119.6
538	S	28.9	Very low	29.1	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	81%	0.811	S	S	*	*			cis	-174.7	150.5	22.1	45.9	0	0	0	0	111.8
539	H	26.6	Very low	29.2	Very low	171 Å²	171	136.1 Å²	136.1	79%	0.792	81%	0.809	S	S	*	*			trans	69	118.4	153.1	-69.7	-69.5	0	0	0	124.3
540	T	27.2	Very low	29.1	Very low	140 Å²	140	141 Å²	141	86%	0.859	81%	0.812	S	S	*	*			trans	71.7	119.9	135.7	57.1	0	0	0	0	123.6
541	G	26.9	Very low	29	Very low	78 Å²	78	140.6 Å²	140.6	80%	0.804	81%	0.809	S	S	*	*			trans	142.1	109.4	144	0	0	0	0	0	118.6
542	L	28.3	Very low	29.1	Very low	164 Å²	164	143.1 Å²	143.1	86%	0.859	81%	0.808	S	S	*	*			trans	-14.2	153	153.9	-93.1	62.3	0	0	0	118.4
543	T	29.6	Very low	29.1	Very low	108 Å²	108	141.1 Å²	141.1	66%	0.663	81%	0.806	S	S	*	*			cis	-172.7	155.5	18.3	27.6	0	0	0	0	112.2
544	T	29.7	Very low	29	Very low	117 Å²	117	141.5 Å²	141.5	72%	0.718	80%	0.803	S	S	*	*			trans	66.7	111.7	146.6	51.7	0	0	0	0	121.5
545	T	30.4	Very low	28.3	Very low	124 Å²	124	141.3 Å²	141.3	76%	0.761	80%	0.8	S	S	*	*				62.6	130.8	76.1	65.7	0	0	0	0	114.6
546	C	29.4	Very low	28.1	Very low	124 Å²	124	145 Å²	145	84%	0.838	81%	0.805	S	S	*	*				-166.6	158.9	53.7	-70.4	0	0	0	0	114.1
547	C	27.1	Very low	28.2	Very low	123 Å²	123	144.6 Å²	144.6	83%	0.831	80%	0.802	S	S	*	*			trans	-86.4	164.2	169.2	-67.9	0	0	0	0	114.2
548	S	28.9	Very low	28.6	Very low	121 Å²	121	145.2 Å²	145.2	85%	0.846	80%	0.804	S	S	*	*			trans	166	109.7	132.4	-70.1	0	0	0	0	110.5
549	R	29.9	Very low	28.5	Very low	236 Å²	236	147.7 Å²	147.7	89%	0.891	81%	0.809	S	S	*	*				59.4	113.5	79	-126.1	-172.6	-160.4	-155.7	4.8	117.3
550	R	30	Very low	28.5	Very low	221 Å²	221	144.3 Å²	144.3	83%	0.834	81%	0.805	S	S	*	*				117.5	119.9	120.2	-163.3	165.4	-168.5	-161.1	5.3	120.3
551	S	26.4	Very low	28.4	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	80%	0.803	S	S	*	*			trans	85	137.8	134.7	-164.2	0	0	0	0	123.9
552	K	31.8	Very low	28.3	Very low	196 Å²	196	149 Å²	149	85%	0.852	81%	0.806	S	S	*	*			trans	-71.2	152.5	179.4	-63.5	168.4	170.7	175.8	0	114.7
553	K	26.9	Very low	28.7	Very low	207 Å²	207	146.2 Å²	146.2	90%	0.9	80%	0.798	S	S	*	*				-172.3	153.4	118.4	-111	178.8	179.5	-179.4	0	113.7
554	T	28.3	Very low	28.6	Very low	120 Å²	120	145.1 Å²	145.1	74%	0.736	80%	0.799	S	S	*	*			trans	-64.1	156.1	-178	41	0	0	0	0	117.7
555	T	23.8	Very low	28.3	Very low	128 Å²	128	145.1 Å²	145.1	79%	0.785	80%	0.799	S	S	*	*			trans	-178.7	134.2	134.1	38.6	0	0	0	0	115.6
556	H	23.7	Very low	28.1	Very low	189 Å²	189	149.9 Å²	149.9	88%	0.875	80%	0.803	S	S	*	*			trans	55.2	137.1	136.9	-71.1	-91.5	0	0	0	126.1
557	L	30.7	Very low	27.9	Very low	155 Å²	155	150.8 Å²	150.8	81%	0.812	80%	0.799	S	S	*	*			trans	-73.9	163	169.8	-101.9	136.1	0	0	0	113.5
558	P	35.5	Very low	27.7	Very low	120 Å²	120	156.1 Å²	156.1	78%	0.779	80%	0.802	S	S	*	*				-156.7	161	82.3	38.8	-16.8	0	0	0	120.3
559	N	27.3	Very low	27.5	Very low	151 Å²	151	155.3 Å²	155.3	81%	0.807	80%	0.796	S	S	*	*			trans	34.4	137.5	146.1	-84.3	-3	0	0	0	124.8
560	S	26.7	Very low	27.3	Very low	101 Å²	101	151.5 Å²	151.5	71%	0.706	79%	0.79	S	S	*	*				175.4	133.6	100.6	61.9	0	0	0	0	116.3
561	N	25.1	Very low	27.1	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	78%	0.783	S	S	*	*			trans	74.2	105.9	135.9	-60.5	-9.2	0	0	0	125.2
562	L	25.4	Very low	27.1	Very low	164 Å²	164	149.4 Å²	149.4	86%	0.859	78%	0.778	S	S	*	*				9.7	168.9	124.8	-108.8	74.3	0	0	0	121.5
563	P	36.2	Very low	26.8	Very low	106 Å²	106	146.9 Å²	146.9	69%	0.688	77%	0.773	S	S	*	*			cis	-147	178.3	-2.1	34.7	-11.6	0	0	0	119.7
564	A	26.5	Very low	26.8	Very low	85 Å²	85	141.2 Å²	141.2	70%	0.702	76%	0.759	S	S	*	*			trans	76.6	139.8	138.9	0	0	0	0	0	119.8
565	T	24.5	Very low	26.6	Very low	116 Å²	116	142.1 Å²	142.1	71%	0.712	77%	0.765	S	S	*	*			cis	-172.3	142.3	22.8	10.7	0	0	0	0	112.6
566	R	25.4	Very low	26.8	Very low	225 Å²	225	143.7 Å²	143.7	85%	0.849	77%	0.767	S	S	*	*			trans	55.3	144.9	138.7	-69.2	179	-171.4	-169.6	3.6	120
567	L	25.2	Very low	26.8	Very low	142 Å²	142	143.2 Å²	143.2	74%	0.743	77%	0.765	S	S	*	*			cis	-174.2	125.5	40.9	-150.6	74	0	0	0	105.8
568	R	24.1	Very low	26.6	Very low	235 Å²	235	143.6 Å²	143.6	89%	0.887	77%	0.766	S	S	*	*				105.5	140.2	77.6	-165.2	-176.8	-164.7	-171.9	5	114.9
569	S	25	Very low	26	Very low	105 Å²	105	146.2 Å²	146.2	73%	0.734	77%	0.768	S	S	*	*			trans	99.5	105.9	163.7	-157.4	0	0	0	0	115.5
570	M	25.7	Very low	25.9	Very low	156 Å²	156	142.9 Å²	142.9	77%	0.768	77%	0.769	S	S	*	*				53.8	130	67.5	-56.5	-98.1	85.3	0	0	110.6
571	Q	26	Very low	25.7	Very low	143 Å²	143	142.4 Å²	142.4	67%	0.668	77%	0.766	S	S	*	*			cis	-176.3	126	36.4	-147.6	163.1	-38.1	0	0	106.9
572	E	25.3	Very low	25.7	Very low	142 Å²	142	144.5 Å²	144.5	66%	0.664	77%	0.771	S	S	*	*				108	131.9	93.8	-95.5	-174.1	159.1	0	0	115.5
573	L	26.2	Very low	25.8	Very low	142 Å²	142	145.2 Å²	145.2	74%	0.743	77%	0.77	S	S	*	*			trans	62.5	148	133.7	-66.5	156.3	0	0	0	119.8
574	S	25.6	Very low	25.5	Very low	88 Å²	88	145.4 Å²	145.4	62%	0.615	77%	0.771	S	S	*	*			cis	-175.7	148.1	-7.7	42.6	0	0	0	0	109
575	T	24.9	Very low	25.3	Very low	140 Å²	140	145.9 Å²	145.9	86%	0.859	77%	0.769	S	S	*	*			trans	-49.7	141.2	156.2	24.2	0	0	0	0	114.1
576	I	27	Very low	25.3	Very low	160 Å²	160	147.8 Å²	147.8	82%	0.821	77%	0.774	S	S	*	*			trans	-132.1	132.9	158.4	-69.6	-177.9	0	0	0	109.9
577	H	24.4	Very low	25.2	Very low	180 Å²	180	142.1 Å²	142.1	83%	0.833	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-92.4	161.1	170.4	-119.7	71.4	0	0	0	110.7
578	I	26.6	Very low	25.2	Very low	162 Å²	162	141.7 Å²	141.7	83%	0.831	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-55	139.4	-167	-65.5	163.8	0	0	0	115.4
579	Q	23.7	Very low	25.2	Very low	176 Å²	176	136.5 Å²	136.5	82%	0.822	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-86.7	133.6	171.7	-177.3	166.7	2.8	0	0	111.2
580	G	24.2	Very low	25.2	Very low	81 Å²	81	142.7 Å²	142.7	84%	0.835	78%	0.775	S	S	*	*			trans	-128.3	129.1	160.9	0	0	0	0	0	108.8
581	S	23.6	Very low	25.3	Very low	91 Å²	91	141.1 Å²	141.1	64%	0.636	78%	0.779	S	S	*	*			trans	-130.1	130.2	174.7	57.7	0	0	0	0	109.2
582	E	24.8	Very low	25.4	Very low	195 Å²	195	139.2 Å²	139.2	91%	0.911	78%	0.782	S	S	*	*				178	140.7	111.2	-92.9	-173.5	160.8	0	0	111.4
583	Q	26.2	Very low	25.4	Very low	179 Å²	179	140.5 Å²	140.5	84%	0.836	79%	0.792	S	S	*	*			trans	-85.8	176.6	173.2	-121.6	178.7	-3.3	0	0	109.5
584	P	30.7	Very low	25.4	Very low	111 Å²	111	141 Å²	141	72%	0.721	80%	0.795	S	S	*	*			cis	-146.1	149	46.6	38.5	-15.6	0	0	0	117.4
585	S	21.5	Very low	25.5	Very low	95 Å²	95	145.3 Å²	145.3	66%	0.664	81%	0.811	S	S	*	*				92.2	118.7	110.5	66.4	0	0	0	0	116.6
586	L	25.6	Very low	25.5	Very low	156 Å²	156	148.1 Å²	148.1	82%	0.817	81%	0.811	S	S	*	*				-175.5	110.9	128.3	-96.1	155.4	0	0	0	111.2
587	T	23.5	Very low	25.5	Very low	106 Å²	106	144.4 Å²	144.4	65%	0.65	81%	0.805	S	S	*	*			trans	57.7	116.4	133.3	56.7	0	0	0	0	122.2
588	T	23.7	Very low	25.7	Very low	133 Å²	133	142.9 Å²	142.9	82%	0.816	80%	0.802	S	S	*	*			trans	62.8	116.8	131.1	52.2	0	0	0	0	119.4
589	S	25	Very low	25.7	Very low	125 Å²	125	143 Å²	143	87%	0.874	81%	0.805	S	S	*	*				-166	148.3	92.6	-156.5	0	0	0	0	112
590	R	24.5	Very low	25.8	Very low	236 Å²	236	137.9 Å²	137.9	89%	0.891	80%	0.799	S	S	*	*			trans	-77.9	142.3	-175.6	-69.4	165.4	133	167.6	-5.4	110.9
591	S	28.8	Very low	25.9	Very low	122 Å²	122	142.2 Å²	142.2	85%	0.853	80%	0.802	S	S	*	*			trans	-156.4	121.9	135.5	-3.9	0	0	0	0	110.4
592	S	26.7	Very low	26.1	Very low	103 Å²	103	148.9 Å²	148.9	72%	0.72	81%	0.813	S	S	*	*			trans	-64.1	149	173.3	47.1	0	0	0	0	113.6
593	L	27.1	Very low	26.3	Very low	169 Å²	169	145.7 Å²	145.7	89%	0.885	81%	0.81	S	S	*	*				-171.8	127.5	109.8	-101.5	161	0	0	0	112.1
594	N	26.1	Very low	26.3	Very low	152 Å²	152	143.4 Å²	143.4	81%	0.813	80%	0.803	S	S	*	*			trans	-66.8	145.4	167.5	-77.1	-53.2	0	0	0	110.9
595	L	27	Very low	26.1	Very low	180 Å²	180	144.2 Å²	144.2	94%	0.942	81%	0.81	S	S	*	*				-154.6	132.8	126.4	-146.1	74.6	0	0	0	111
596	K	25.6	Very low	26.4	Very low	199 Å²	199	148.4 Å²	148.4	87%	0.865	82%	0.816	S	S	*	*			trans	-104.7	137.1	179.6	-179.5	-176.4	-175	-179.3	0	107.1
597	A	27	Very low	26.3	Very low	82 Å²	82	147.9 Å²	147.9	68%	0.678	82%	0.82	S	S	*	*			trans	168.2	136.6	133.3	0	0	0	0	0	112.8
598	D	27.3	Very low	26.4	Very low	147 Å²	147	147.4 Å²	147.4	79%	0.786	82%	0.821	S	S	*	*			trans	72.7	108.5	144.6	-65.6	-9	0	0	0	123.2
599	D	27	Very low	26.5	Very low	165 Å²	165	149.5 Å²	149.5	88%	0.882	82%	0.821	S	S	*	*				37.8	126	117.1	-79.3	-17.1	0	0	0	120.7
600	G	26	Very low	26.6	Very low	68 Å²	68	151.1 Å²	151.1	70%	0.701	82%	0.818	S	S	*	*			trans	136.9	118.8	146.1	0	0	0	0	0	116.2
601	L	27	Very low	26.6	Very low	173 Å²	173	146.2 Å²	146.2	91%	0.906	82%	0.815	S	S	*	*			trans	65.7	118.2	149.3	-101.2	64.2	0	0	0	120
602	R	27.5	Very low	26.5	Very low	230 Å²	230	146.8 Å²	146.8	87%	0.868	81%	0.814	S	S	*	*			trans	-67.5	148.7	157.7	-82.8	-178.5	164.8	176.9	-2.4	110.9
603	P	28.6	Very low	26.5	Very low	129 Å²	129	146.5 Å²	146.5	84%	0.838	82%	0.817	S	S	*	*				-135.3	157.8	102.7	23	-4.2	0	0	0	113.8
604	N	26.4	Very low	26.4	Very low	130 Å²	130	146.2 Å²	146.2	70%	0.695	82%	0.815	S	S	*	*			trans	-97.9	139	-176.6	-158.6	8	0	0	0	109.4
605	C	25.4	Very low	26.4	Very low	128 Å²	128	146.3 Å²	146.3	87%	0.865	81%	0.814	S	S	*	*			trans	-143.7	119.4	155.6	-147.3	0	0	0	0	108.6
606	K	27.8	Very low	26.3	Very low	184 Å²	184	143 Å²	143	80%	0.8	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-93.6	135.2	175.9	-79.8	-177.4	172.7	-177.4	0	109.7
607	T	25.4	Very low	26.5	Very low	145 Å²	145	141 Å²	141	89%	0.89	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.4	154.5	158.7	-13.2	0	0	0	0	110.7
608	S	24.4	Very low	26.6	Very low	95 Å²	95	142.8 Å²	142.8	66%	0.664	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80.6	152.8	-169.2	-166.7	0	0	0	0	114.5
609	Q	25.9	Very low	26.8	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	81%	0.81	S	S	*	*			trans	171.8	97.9	144.5	-95.4	168.1	14.3	0	0	108.1
610	I	27.1	Very low	27	Very low	158 Å²	158	140 Å²	140	81%	0.81	80%	0.804	S	S	*	*				57.2	106	93.7	-55.8	174.4	0	0	0	113.1
611	T	24.5	Very low	27.3	Very low	134 Å²	134	142.9 Å²	142.9	82%	0.822	81%	0.81	S	S	*	*			trans	-131	135.1	165.3	-45.3	0	0	0	0	108.7
612	T	27	Very low	27.4	Very low	134 Å²	134	139.5 Å²	139.5	82%	0.822	81%	0.808	S	S	*	*			trans	-63.8	140.7	-177.8	16.7	0	0	0	0	113.2
613	A	26	Very low	27.5	Very low	96 Å²	96	137 Å²	137	79%	0.793	81%	0.81	S	S	*	*			trans	-88.8	136.4	177.9	0	0	0	0	0	111.8
614	I	26.6	Very low	27.6	Very low	164 Å²	164	137 Å²	137	84%	0.841	81%	0.808	S	S	*	*			trans	-110.8	121.3	163.1	-65.6	174.8	0	0	0	107.3
615	I	24.5	Very low	28	Very low	153 Å²	153	137 Å²	137	79%	0.785	82%	0.815	S	S	*	*			trans	-83.8	126.9	176.9	-63.4	169.2	0	0	0	108.2
616	S	25.1	Very low	28.3	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	82%	0.818	S	S	*	*			trans	-121.5	133.6	166.2	50.4	0	0	0	0	109.2
617	I	30.9	Very low	28.3	Very low	159 Å²	159	135.3 Å²	135.3	82%	0.815	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-94	131.7	-177.6	-59.3	169.3	0	0	0	108.3
618	P	28.7	Very low	28.6	Very low	119 Å²	119	138 Å²	138	77%	0.773	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-90.9	144.4	178.2	31.4	-27.3	0	0	0	113.5
619	T	30.9	Very low	28.9	Very low	138 Å²	138	139.1 Å²	139.1	85%	0.847	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-80.8	152	171.8	8.7	0	0	0	0	112.2
620	P	31.8	Very low	29.1	Very low	114 Å²	114	142.3 Å²	142.3	74%	0.74	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-87.8	161	-171.9	34.8	-33.6	0	0	0	114.1
621	P	32.2	Very low	29.5	Very low	129 Å²	129	140.3 Å²	140.3	84%	0.838	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-86.9	150	-177.3	32.9	-29.8	0	0	0	113.8
622	A	28.2	Very low	30.1	Very low	103 Å²	103	139.6 Å²	139.6	85%	0.851	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-80.1	142.8	-179.7	0	0	0	0	0	113
623	L	30.7	Very low	30.7	Very low	177 Å²	177	139.4 Å²	139.4	93%	0.927	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-85.5	133.4	177.2	-73.9	154.8	0	0	0	111.2
624	T	30.1	Very low	31	Very low	129 Å²	129	139.8 Å²	139.8	79%	0.791	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-91.8	142.7	165.1	46.3	0	0	0	0	110.5
625	P	35.4	Very low	31.4	Very low	130 Å²	130	137.6 Å²	137.6	84%	0.844	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-95.6	127.6	170.7	33	-25.3	0	0	0	111.6
626	E	30.4	Very low	32.4	Very low	198 Å²	198	136.5 Å²	136.5	93%	0.925	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-91.3	143.8	161.2	-69.5	-163.2	156.7	0	0	110
627	G	29.6	Very low	32.6	Very low	79 Å²	79	134.8 Å²	134.8	81%	0.814	83%	0.834	S	S	*	*			trans	-167.7	103.4	172.2	0	0	0	0	0	111
628	E	31	Very low	33.3	Very low	200 Å²	200	133 Å²	133	94%	0.935	83%	0.833	S	S	*	*			trans	-66.3	142.7	177.8	-71.6	176	118.5	0	0	113.6
629	S	30.2	Very low	33.5	Very low	120 Å²	120	134.4 Å²	134.4	84%	0.839	83%	0.834	S	S	*	*			trans	-160.8	119.1	140.8	43.2	0	0	0	0	111.1
630	R	31.2	Very low	33.6	Very low	245 Å²	245	135 Å²	135	93%	0.925	84%	0.837	S	S	*	*			trans	-81	157.4	174.3	-87.5	178.2	170.9	177	-2.2	112.2
631	P	33.7	Very low	33.6	Very low	115 Å²	115	136.9 Å²	136.9	75%	0.747	84%	0.841	S	S	*	*			trans	-113.4	165.2	140	18.8	0.8	0	0	0	112.7
632	P	38.6	Very low	33.7	Very low	119 Å²	119	138.7 Å²	138.7	77%	0.773	84%	0.843	S	S	*	*			trans	-87.6	171.9	-161.6	36.8	-35.6	0	0	0	114.4
633	P	40	Very low	34.1	Very low	131 Å²	131	139.4 Å²	139.4	85%	0.851	84%	0.838	S	S	*	*			trans	-91.8	151.6	-167.9	36	-31.4	0	0	0	113.4
634	A	30.8	Very low	34.2	Very low	104 Å²	104	136.7 Å²	136.7	86%	0.86	83%	0.834	S	S	*	*			trans	-125.6	143.9	162.3	0	0	0	0	0	110.2
635	S	34.8	Very low	34.3	Very low	117 Å²	117	138.2 Å²	138.2	82%	0.818	84%	0.836	S	S	*	*			trans	-94.5	-168.3	-162.3	63.3	0	0	0	0	112.9
636	P	46.4	Very low	34.2	Very low	130 Å²	130	136.6 Å²	136.6	84%	0.844	83%	0.833	S	S	*	*				-119.7	165.9	-122.2	27.6	-4.1	0	0	0	116.9
637	G	30.1	Very low	34.3	Very low	74 Å²	74	132 Å²	132	76%	0.763	82%	0.823	S	S	*	*			trans	123.4	164.6	153.3	0	0	0	0	0	116.4
638	P	45.1	Very low	34.3	Very low	121 Å²	121	135.9 Å²	135.9	79%	0.786	83%	0.825	S	S	*	*			cis	-130.3	157.3	-40.4	36.6	-21.2	0	0	0	114.3
639	N	32.4	Very low	34.2	Very low	150 Å²	150	132.8 Å²	132.8	80%	0.802	82%	0.819	S	S	*	*			trans	24.1	122.1	150.2	-64.9	-12.4	0	0	0	121.3
640	T	33.1	Very low	34.2	Very low	149 Å²	149	132.8 Å²	132.8	91%	0.914	81%	0.814	S	S	*	*			trans	-148	120	134.3	17.1	0	0	0	0	110.2
641	N	31.8	Very low	34	Very low	154 Å²	154	130.5 Å²	130.5	82%	0.824	81%	0.811	S	S	*	*			trans	-81	142.4	170	-78.4	-33.6	0	0	0	109.8
642	I	34.5	Very low	33.8	Very low	168 Å²	168	131.1 Å²	131.1	86%	0.862	81%	0.813	S	S	*	*			trans	-174.8	144	142.6	-90.3	149.7	0	0	0	107.8
643	P	37	Very low	33.3	Very low	118 Å²	118	130.7 Å²	130.7	77%	0.766	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-92	142.5	-151.2	34.2	-29	0	0	0	114.1
644	S	31.2	Very low	33.2	Very low	119 Å²	119	129.1 Å²	129.1	83%	0.832	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-86.9	124.1	177.5	57.1	0	0	0	0	112.4
645	I	32.8	Very low	33.4	Very low	162 Å²	162	136 Å²	136	83%	0.831	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-64.6	127.5	168.4	-67.9	166.6	0	0	0	109.4
646	A	32.8	Very low	33.3	Very low	95 Å²	95	137 Å²	137	79%	0.785	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-75.3	122.2	174.4	0	0	0	0	0	110.8
647	S	32.6	Very low	32.6	Very low	102 Å²	102	137.3 Å²	137.3	71%	0.713	83%	0.831	S	S	*	*			trans	-124.9	109.6	163.9	61.4	0	0	0	0	109.5	V649	S647-V649 PolarHBondContact O-N 3.48Å
648	N	29.7	Very low	32.7	Very low	161 Å²	161	140.8 Å²	140.8	86%	0.861	84%	0.835	S	S	*	*			trans	-61.8	124.1	173.3	-72	-44.9	0	0	0	110.8
649	V	30.4	Very low	32	Very low	134 Å²	134	142 Å²	142	81%	0.812	84%	0.838	S	S	*	*			trans	-110.6	110	164.1	177.5	0	0	0	0	108.1	S647	S647-V649 PolarHBondContact O-N 3.48Å
650	V	28.9	Very low	32	Very low	121 Å²	121	141.5 Å²	141.5	73%	0.733	84%	0.84	S	S	*	*			trans	-77.1	120.2	174	175	0	0	0	0	108.7	V652	V650-V652 HydrophobicContact CG1-CG2 4.1Å
651	K	27.4	Very low	31.9	Very low	196 Å²	196	141 Å²	141	85%	0.852	84%	0.835	S	S	*	*			trans	-83.2	109.1	165.3	-101.7	179.5	174.3	177.1	0	108.5
652	V	29.5	Very low	31.9	Very low	129 Å²	129	140.1 Å²	140.1	78%	0.782	84%	0.836	S	S	*	*			trans	-86.5	114.2	166.3	-179.5	0	0	0	0	107.6	V650	V650-V652 HydrophobicContact CG1-CG2 4.1Å
653	S	28	Very low	31.7	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	83%	0.834	S	S	*	*			trans	-92.3	123.6	164.6	-66	0	0	0	0	107.7
654	A	37.8	Very low	31.3	Very low	98 Å²	98	139.6 Å²	139.6	81%	0.81	84%	0.84	S	S	*	*			trans	-75.5	131.7	175	0	0	0	0	0	109.9
655	L	34.4	Very low	31.3	Very low	248 Å²	248	141.5 Å²	141.5	100%	1.298	84%	0.841	S	S	*	*			trans	-76.5	0	155.8	-89.6	159.9	0	0	0	109.6

Retrieved 655 of 655 residues in 167.9 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).