A0A060D3F5_MAIZE Loading...

MYB transcription factor

AlphaFold DB (K7TU66), UniProt , Accession A0A060D3F5, Species MAIZE (Zea mays, Maize), Gene MYB4, Length 352 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.9	Very low	54.9	Low	226 Å²	226	131.2 Å²	131.2	100%	1.113	77%	0.765	S	S	*	*				0	89.2	0	-55.7	176.1	-166.8	0	0	104.9
2	E	43.4	Very low	54.8	Low	167 Å²	167	128 Å²	128	78%	0.78	77%	0.765	S	S	*	*				81.5	107.9	86.9	-86.4	174.5	124.6	0	0	109.7
3	T	56.8	Low	54.2	Low	125 Å²	125	124.7 Å²	124.7	77%	0.767	77%	0.774	S	S	*	*				60.8	134.8	96.1	59.2	0	0	0	0	112.9
4	A	59.2	Low	53.6	Low	76 Å²	76	121.9 Å²	121.9	63%	0.628	78%	0.781	S	S	*	*			cis	-171.3	-166.1	-3.2	0	0	0	0	0	108
5	L	61.1	Low	53.1	Low	145 Å²	145	119.1 Å²	119.1	76%	0.759	79%	0.785	S	S	*	*			trans	38.9	136	139.6	-62	163.4	0	0	0	118.4
6	Q	57.3	Low	53	Low	135 Å²	135	123.5 Å²	123.5	63%	0.631	79%	0.794	S	S	*	*			cis	-179.3	178.3	21.6	-135.2	168.5	-34.8	0	0	112.9
7	Q	56.6	Low	53.4	Low	152 Å²	152	129.7 Å²	129.7	71%	0.71	80%	0.798	S	S	*	*			trans	70.8	146.7	146.6	-73.4	159.5	44.4	0	0	117.6
8	S	58.3	Low	53.6	Low	98 Å²	98	129.9 Å²	129.9	69%	0.685	80%	0.802	S	S	*	*			cis	-173.3	142	-14.4	48.4	0	0	0	0	111.8
9	A	54.1	Low	53.7	Low	102 Å²	102	128.5 Å²	128.5	84%	0.843	80%	0.804	S	S	*	*			trans	61.7	162.4	148.4	0	0	0	0	0	118
10	A	54.7	Low	53.6	Low	79 Å²	79	124.4 Å²	124.4	65%	0.653	79%	0.788	S	S	*	*			cis	-156.8	160.7	0.5	0	0	0	0	0	110.9
11	T	54.1	Low	53.6	Low	138 Å²	138	122.4 Å²	122.4	85%	0.847	78%	0.783	S	S	*	*			trans	62.1	132.8	138.8	-52.7	0	0	0	0	119.8
12	A	54.5	Low	53.9	Low	93 Å²	93	115.4 Å²	115.4	77%	0.769	76%	0.762	S	S	*	*			cis	-170.9	168.1	-13.5	0	0	0	0	0	110.2
13	G	46.8	Very low	54.6	Low	85 Å²	85	112.1 Å²	112.1	88%	0.876	75%	0.753	S	S	*	*			trans	102.3	136.2	148.6	0	0	0	0	0	117.3
14	G	46	Very low	54.9	Low	85 Å²	85	110.8 Å²	110.8	88%	0.876	75%	0.745	S	S	*	*			trans	116.5	73.3	167.9	0	0	0	0	0	115.1
15	G	45.8	Very low	55.5	Low	81 Å²	81	112.4 Å²	112.4	84%	0.835	75%	0.747	S	S	*	*			trans	-83.9	136.7	169	0	0	0	0	0	112
16	M	51.5	Low	56.1	Low	189 Å²	189	113.3 Å²	113.3	93%	0.931	75%	0.745	S	S	*	*			trans	-137.4	129.3	162.6	-158.3	73	91.7	0	0	108.9
17	R	59.6	Low	57.1	Low	229 Å²	229	112.8 Å²	112.8	86%	0.864	74%	0.74	S	S	*	*			trans	-83.1	148.9	-174	-61	169	78.9	-149.9	8.3	110.5	A19	R17-A19 PolarHBondContact O-N 3.02Å
18	P	56.8	Low	58.1	Low	133 Å²	133	108 Å²	108	86%	0.864	73%	0.727	S	S	*	*			trans	-73.7	97.2	-179.2	29.5	-34.8	0	0	0	112.1	G20	P18-G20 VanDerWaalsContact C-N 3.34Å; P18-G20 PolarHBondContact O-N 3.21Å
19	A	55.6	Low	59.3	Low	103 Å²	103	111.6 Å²	111.6	85%	0.851	73%	0.725	S	S	*	*			trans	-88.1	64.2	173.1	0	0	0	0	0	111.4	R17	R17-A19 PolarHBondContact O-N 3.02Å
20	G	51.7	Low	60.7	Low	47 Å²	47	112.8 Å²	112.8	49%	0.485	71%	0.713	S	S	.	*			trans	-119	-32.2	-172.1	0	0	0	0	0	117.2	P18	P18-G20 VanDerWaalsContact C-N 3.34Å; P18-G20 PolarHBondContact O-N 3.21Å
21	A	52.9	Low	62	Low	82 Å²	82	113.5 Å²	113.5	68%	0.678	70%	0.703	S	S	*	*	H	α-helix	trans	-86.8	-33.1	-166	0	0	0	0	0	115.3	T23	A21-T23 PolarHBondContact O-N 3.06Å
22	A	55.6	Low	63.5	Low	80 Å²	80	112 Å²	112	66%	0.661	69%	0.689	S	S	*	*	H	α-helix	trans	-73.9	-25.3	-172.6	0	0	0	0	0	113.7
23	T	58	Low	65	Low	98 Å²	98	111.9 Å²	111.9	60%	0.601	67%	0.673	S	S	*	*	H	α-helix	trans	-73.7	-34.3	-177.4	-26.3	0	0	0	0	111.7	A21 V25 K26 K27	A21-T23 PolarHBondContact O-N 3.06Å; T23-V25 PolarHBondContact O-N 3.32Å; T23-K26 PolarHBondContact O-N 3.3Å; T23-K27 WeakPolarHBondContact O-CB 3.18Å; T23-K27 PolarHBondContact O-N 3.43Å
24	T	63.6	Low	66.7	Low	97 Å²	97	112.5 Å²	112.5	60%	0.595	66%	0.656	S	S	*	*	H	α-helix	trans	-62.8	-43	-178	-45.4	0	0	0	0	112.5	K27 A28	T24-K27 PolarHBondContact O-N 3.35Å; T24-A28 WeakPolarHBondContact O-CB 3.23Å; T24-A28 PolarHBondContact O-N 3.22Å
25	V	70.7	Confident	68.4	Low	110 Å²	110	114.8 Å²	114.8	67%	0.667	64%	0.644	S	S	*	*	H	α-helix	trans	-68.5	-37.9	-179.4	-176.7	0	0	0	0	111.6	T23 R29	T23-V25 PolarHBondContact O-N 3.32Å; V25-R29 PolarHBondContact O-N 3.43Å; V25-R29 VanDerWaalsContact O-N 3.14Å
26	K	73.4	Confident	70.1	Confident	164 Å²	164	116.5 Å²	116.5	71%	0.713	63%	0.63	S	S	*	*	H	α-helix	trans	-67.7	-40.5	174.9	-72.2	-169.2	175.7	-173.3	0	111.9	T23 R29 Q30	T23-K26 PolarHBondContact O-N 3.3Å; K26-R29 PolarHBondContact O-N 3.31Å; K26-Q30 PolarHBondContact O-N 3.43Å
27	K	78.9	Confident	71.7	Confident	123 Å²	123	113.8 Å²	113.8	54%	0.535	62%	0.615	S	S	.	*	H	α-helix	trans	-62	-49.4	176.2	-175.3	178.3	166.4	-176.8	0	111.4	T23 T24 R29 Q30 E31	T23-K27 WeakPolarHBondContact O-CB 3.18Å; T23-K27 PolarHBondContact O-N 3.43Å; T24-K27 PolarHBondContact O-N 3.35Å; K27-R29 VanDerWaalsContact C-N 3.3Å; K27-R29 PolarHBondContact O-N 3.33Å; K27-Q30 PolarHBondContact O-N 3.22Å; K27-Q30 VanDerWaalsContact O-N 3.09Å; K27-E31 WeakPolarHBondContact CE-OE1 3.26Å; K27-E31 HydrophobicContact CG-CG 4.43Å; K27-E31 IonicContact NZ-OE1 3.37Å; K27-E31 PolarHBondContact NZ-OE1 3.36Å; K27-E31 WeakPolarHBondContact O-CG 3.49Å; K27-E31 PolarHBondContact O-N 3.44Å
28	A	78	Confident	72.6	Confident	53 Å²	53	112 Å²	112	44%	0.438	61%	0.608	S	S	.	*	H	α-helix	trans	-59.5	-38.1	178.2	0	0	0	0	0	112.9	T24 L32	T24-A28 WeakPolarHBondContact O-CB 3.23Å; T24-A28 PolarHBondContact O-N 3.22Å; A28-L32 WeakPolarHBondContact O-CB 3.48Å; A28-L32 PolarHBondContact O-N 3.45Å; A28-L32 VanDerWaalsContact O-N 3.12Å
29	R	84.2	Confident	73.5	Confident	173 Å²	173	112.8 Å²	112.8	65%	0.653	60%	0.6	S	S	*	*	H	α-helix	trans	-66.2	-41.2	174.4	-178.5	174.3	172.6	157.8	2.5	112.5	V25 K26 K27 L32 E33	V25-R29 PolarHBondContact O-N 3.43Å; V25-R29 VanDerWaalsContact O-N 3.14Å; K26-R29 PolarHBondContact O-N 3.31Å; K27-R29 VanDerWaalsContact C-N 3.3Å; K27-R29 PolarHBondContact O-N 3.33Å; R29-L32 PolarHBondContact O-N 2.79Å; R29-E33 IonicContact CZ-OE1 3.83Å; R29-E33 IonicContact NE-OE1 3.91Å; R29-E33 PolarHBondContact NE-OE1 3.49Å; R29-E33 VanDerWaalsContact NE-OE1 3.15Å; R29-E33 IonicContact NH2-OE1 2.8Å; R29-E33 PolarHBondContact NH2-OE1 3.1Å; R29-E33 PolarHBondContact O-N 3.39Å
30	Q	82.5	Confident	74.5	Confident	126 Å²	126	114.4 Å²	114.4	59%	0.589	59%	0.594	S	S	*	*	H	α-helix	trans	-70.6	-34.4	179.3	-169.7	174.8	12.1	0	0	112.3	K26 K27 L34	K26-Q30 PolarHBondContact O-N 3.43Å; K27-Q30 PolarHBondContact O-N 3.22Å; K27-Q30 VanDerWaalsContact O-N 3.09Å; Q30-L34 HydrophobicContact CG-CD1 4.47Å; Q30-L34 WeakPolarHBondContact O-CB 3.42Å; Q30-L34 WeakPolarHBondContact O-CG 3.47Å; Q30-L34 PolarHBondContact O-N 3.47Å
31	E	82.8	Confident	75.5	Confident	95 Å²	95	121.7 Å²	121.7	44%	0.444	61%	0.607	S	S	.	*	H	α-helix	trans	-64.6	-40.6	172.3	-74	172.4	149.8	0	0	111.2	K27 L34 E35	K27-E31 WeakPolarHBondContact CE-OE1 3.26Å; K27-E31 HydrophobicContact CG-CG 4.43Å; K27-E31 IonicContact NZ-OE1 3.37Å; K27-E31 PolarHBondContact NZ-OE1 3.36Å; K27-E31 WeakPolarHBondContact O-CG 3.49Å; K27-E31 PolarHBondContact O-N 3.44Å; E31-L34 PolarHBondContact O-N 3.41Å; E31-E35 PolarHBondContact O-N 3.18Å
32	L	84.1	Confident	76.1	Confident	106 Å²	106	123.8 Å²	123.8	56%	0.555	60%	0.601	S	S	*	*	H	α-helix	trans	-70.8	-37.5	177.5	-162.8	148.4	0	0	0	113	A28 R29 L34 E35 Q36	A28-L32 WeakPolarHBondContact O-CB 3.48Å; A28-L32 PolarHBondContact O-N 3.45Å; A28-L32 VanDerWaalsContact O-N 3.12Å; R29-L32 PolarHBondContact O-N 2.79Å; L32-L34 VanDerWaalsContact C-N 3.34Å; L32-E35 PolarHBondContact O-N 2.82Å; L32-Q36 WeakPolarHBondContact O-CB 3.49Å; L32-Q36 PolarHBondContact O-N 3.03Å; L32-Q36 VanDerWaalsContact O-N 3.07Å
33	E	85.8	Confident	76.2	Confident	90 Å²	90	124.4 Å²	124.4	42%	0.421	60%	0.598	S	S	.	*	H	α-helix	trans	-62.9	-39.4	170.2	-80.5	167.3	-175.1	0	0	111.1	R29 Q36 E37	R29-E33 IonicContact CZ-OE1 3.83Å; R29-E33 IonicContact NE-OE1 3.91Å; R29-E33 PolarHBondContact NE-OE1 3.49Å; R29-E33 VanDerWaalsContact NE-OE1 3.15Å; R29-E33 IonicContact NH2-OE1 2.8Å; R29-E33 PolarHBondContact NH2-OE1 3.1Å; R29-E33 PolarHBondContact O-N 3.39Å; E33-Q36 PolarHBondContact O-N 3.11Å; E33-E37 WeakPolarHBondContact O-CG 3.32Å; E33-E37 PolarHBondContact O-N 3.06Å
34	L	83.4	Confident	75.9	Confident	98 Å²	98	127.5 Å²	127.5	51%	0.513	61%	0.606	S	S	.	*	H	α-helix	trans	-69	-36.2	175.8	-80.3	167.2	0	0	0	114	Q30 E31 L32 R38	Q30-L34 HydrophobicContact CG-CD1 4.47Å; Q30-L34 WeakPolarHBondContact O-CB 3.42Å; Q30-L34 WeakPolarHBondContact O-CG 3.47Å; Q30-L34 PolarHBondContact O-N 3.47Å; E31-L34 PolarHBondContact O-N 3.41Å; L32-L34 VanDerWaalsContact C-N 3.34Å; L34-R38 VanDerWaalsContact O-CB 3.26Å; L34-R38 WeakPolarHBondContact O-CB 3.4Å; L34-R38 PolarHBondContact O-N 3.46Å
35	E	81.3	Confident	75.2	Confident	134 Å²	134	125.9 Å²	125.9	63%	0.626	60%	0.603	S	S	*	*	H	α-helix	trans	-65.2	-42.3	172.3	-76.7	-173.7	145	0	0	111.1	E31 L32 R38 E39	E31-E35 PolarHBondContact O-N 3.18Å; L32-E35 PolarHBondContact O-N 2.82Å; E35-R38 WeakPolarHBondContact O-CB 3.49Å; E35-R38 PolarHBondContact O-N 3.27Å; E35-R38 VanDerWaalsContact O-N 3.14Å; E35-E39 PolarHBondContact O-N 2.83Å
36	Q	82.5	Confident	74.2	Confident	117 Å²	117	124.3 Å²	124.3	55%	0.547	60%	0.601	S	S	.	*	H	α-helix	trans	-66.3	-39.6	178.4	-156	168.3	64.7	0	0	112.1	L32 E33 R38 L40	L32-Q36 WeakPolarHBondContact O-CB 3.49Å; L32-Q36 PolarHBondContact O-N 3.03Å; L32-Q36 VanDerWaalsContact O-N 3.07Å; E33-Q36 PolarHBondContact O-N 3.11Å; Q36-R38 VanDerWaalsContact C-N 3.34Å; Q36-L40 WeakPolarHBondContact O-CB 3.46Å; Q36-L40 WeakPolarHBondContact O-CG 3.05Å; Q36-L40 PolarHBondContact O-N 3.05Å
37	E	83.4	Confident	73	Confident	131 Å²	131	119.9 Å²	119.9	61%	0.612	60%	0.595	S	S	*	*	H	α-helix	trans	-65	-35.2	170.4	-75.6	-168.4	156.6	0	0	112.7	E33 L40 R41	E33-E37 WeakPolarHBondContact O-CG 3.32Å; E33-E37 PolarHBondContact O-N 3.06Å; E37-L40 PolarHBondContact O-N 3.12Å; E37-R41 WeakPolarHBondContact O-CB 3.33Å; E37-R41 PolarHBondContact O-N 3.02Å
38	R	79.4	Confident	71.5	Confident	191 Å²	191	117.1 Å²	117.1	72%	0.721	60%	0.595	S	S	*	*	H	α-helix	trans	-68.3	-40.3	177.6	177.7	178.5	165.1	173.6	-5.5	111.9	L34 E35 Q36 F42	L34-R38 VanDerWaalsContact O-CB 3.26Å; L34-R38 WeakPolarHBondContact O-CB 3.4Å; L34-R38 PolarHBondContact O-N 3.46Å; E35-R38 WeakPolarHBondContact O-CB 3.49Å; E35-R38 PolarHBondContact O-N 3.27Å; E35-R38 VanDerWaalsContact O-N 3.14Å; Q36-R38 VanDerWaalsContact C-N 3.34Å; R38-F42 PolarHBondContact O-N 3.19Å
39	E	75.7	Confident	70	Confident	150 Å²	150	118 Å²	118	70%	0.701	60%	0.602	S	S	*	*	H	α-helix	trans	-64.3	-46.8	171.8	-71.3	-167.6	138.7	0	0	111.5	E35 R41 F42	E35-E39 PolarHBondContact O-N 2.83Å; E39-R41 VanDerWaalsContact C-N 3.34Å; E39-R41 PolarHBondContact O-N 3.29Å; E39-F42 CarbonylContact O-C 3.59Å; E39-F42 PolarHBondContact O-N 3.37Å
40	L	75.6	Confident	68.1	Low	138 Å²	138	116.2 Å²	116.2	72%	0.723	61%	0.606	S	S	*	*	H	α-helix	trans	-65.1	-32.3	179.4	-77.4	166.4	0	0	0	113.7	Q36 E37	Q36-L40 WeakPolarHBondContact O-CB 3.46Å; Q36-L40 WeakPolarHBondContact O-CG 3.05Å; Q36-L40 PolarHBondContact O-N 3.05Å; E37-L40 PolarHBondContact O-N 3.12Å
41	R	74.6	Confident	66.4	Low	199 Å²	199	116 Å²	116	75%	0.751	61%	0.605	S	S	*	*	H	α-helix	trans	-78.6	-24.3	178.1	-177.7	176	-92	-153.8	-3.3	113	E37 E39 P43	E37-R41 WeakPolarHBondContact O-CB 3.33Å; E37-R41 PolarHBondContact O-N 3.02Å; E39-R41 VanDerWaalsContact C-N 3.34Å; E39-R41 PolarHBondContact O-N 3.29Å; R41-P43 VanDerWaalsContact C-CD 3.44Å
42	F	65.5	Low	64.4	Low	126 Å²	126	114.3 Å²	114.3	55%	0.553	61%	0.613	S	S	*	*			trans	-128.8	55.9	-177.4	-63.9	-78.7	0	0	0	113.8	R38 E39 Q44 A45	R38-F42 PolarHBondContact O-N 3.19Å; E39-F42 CarbonylContact O-C 3.59Å; E39-F42 PolarHBondContact O-N 3.37Å; F42-Q44 PolarHBondContact O-N 3.43Å; F42-A45 HydrophobicContact CB-CB 4.11Å; F42-A45 WeakPolarHBondContact O-CB 3.18Å; F42-A45 PolarHBondContact O-N 2.83Å
43	P	56.9	Low	62.5	Low	94 Å²	94	112 Å²	112	61%	0.61	62%	0.615	S	S	*	*	H	α-helix	trans	-59.8	-24.2	177.9	26.3	-35.4	0	0	0	112.7	R41 A47	R41-P43 VanDerWaalsContact C-CD 3.44Å; P43-A47 PolarHBondContact O-N 3.21Å
44	Q	52.6	Low	60.9	Low	162 Å²	162	113 Å²	113	76%	0.757	62%	0.622	S	S	*	*	H	α-helix	trans	-77.3	-17.4	179.1	-152.8	164.9	44	0	0	113.8	F42 A48	F42-Q44 PolarHBondContact O-N 3.43Å; Q44-A48 WeakPolarHBondContact O-CB 3.28Å; Q44-A48 PolarHBondContact O-N 3.4Å; Q44-A48 VanDerWaalsContact O-N 3.09Å
45	A	48.8	Very low	59.4	Low	64 Å²	64	114.4 Å²	114.4	53%	0.529	63%	0.63	S	S	.	*	H	α-helix	trans	-73.4	-36.3	175.3	0	0	0	0	0	111.9	F42 A49	F42-A45 HydrophobicContact CB-CB 4.11Å; F42-A45 WeakPolarHBondContact O-CB 3.18Å; F42-A45 PolarHBondContact O-N 2.83Å; A45-A49 PolarHBondContact O-N 3.2Å
46	A	48.2	Very low	58.3	Low	76 Å²	76	114.2 Å²	114.2	63%	0.628	63%	0.629	S	S	*	*	H	α-helix	trans	-68.9	-40.5	172.1	0	0	0	0	0	111.6	A48 A49	A46-A48 VanDerWaalsContact C-N 3.33Å; A46-A48 PolarHBondContact O-N 2.91Å; A46-A49 WeakPolarHBondContact O-CB 3.26Å; A46-A49 PolarHBondContact O-N 3.36Å; A46-A49 VanDerWaalsContact O-N 3.09Å
47	A	47.9	Very low	57.7	Low	72 Å²	72	117.2 Å²	117.2	60%	0.595	64%	0.643	S	S	*	*	H	α-helix	trans	-66	-31.7	176.9	0	0	0	0	0	113.5	P43 A49	P43-A47 PolarHBondContact O-N 3.21Å; A47-A49 PolarHBondContact O-N 3.44Å
48	A	48.9	Very low	57.7	Low	65 Å²	65	113.7 Å²	113.7	54%	0.537	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.5	-11.2	173.5	0	0	0	0	0	113.8	Q44 A46 Q51	Q44-A48 WeakPolarHBondContact O-CB 3.28Å; Q44-A48 PolarHBondContact O-N 3.4Å; Q44-A48 VanDerWaalsContact O-N 3.09Å; A46-A48 VanDerWaalsContact C-N 3.33Å; A46-A48 PolarHBondContact O-N 2.91Å; A48-Q51 PolarHBondContact O-NE2 2.96Å
49	A	45.7	Very low	58	Low	70 Å²	70	108.9 Å²	108.9	58%	0.579	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-0	177	0	0	0	0	0	113.5	A45 A46 A47 Q51	A45-A49 PolarHBondContact O-N 3.2Å; A46-A49 WeakPolarHBondContact O-CB 3.26Å; A46-A49 PolarHBondContact O-N 3.36Å; A46-A49 VanDerWaalsContact O-N 3.09Å; A47-A49 PolarHBondContact O-N 3.44Å; A49-Q51 PolarHBondContact O-N 3.23Å
50	D	45	Very low	58.4	Low	137 Å²	137	110.5 Å²	110.5	73%	0.733	61%	0.61	S	S	*	*			trans	-73.7	56.3	167.2	-169.1	29.2	0	0	0	112.1	G52	D50-G52 VanDerWaalsContact C-N 3.34Å
51	Q	47.1	Very low	59.2	Low	121 Å²	121	106.1 Å²	106.1	57%	0.565	60%	0.598	S	S	*	*			trans	-100.8	12.5	162.1	-66.1	179.1	61.3	0	0	110.3	A48 A49	A48-Q51 PolarHBondContact O-NE2 2.96Å; A49-Q51 PolarHBondContact O-N 3.23Å
52	G	40.1	Very low	60.1	Low	60 Å²	60	102 Å²	102	62%	0.619	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	5.9	-173.3	0	0	0	0	0	116	D50	D50-G52 VanDerWaalsContact C-N 3.34Å
53	G	44.5	Very low	61.6	Low	57 Å²	57	98.1 Å²	98.1	59%	0.588	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-5.8	176.2	0	0	0	0	0	115.4
54	L	51.6	Low	63.4	Low	111 Å²	111	96.3 Å²	96.3	58%	0.581	57%	0.566	S	S	*	*			trans	-101.1	13.3	-175.6	-68.7	177	0	0	0	114.3	E56 R88	L54-E56 PolarHBondContact O-N 3.36Å; L54-R88 HydrophobicContact CD1-CG 4.08Å
55	D	52	Low	65.5	Low	128 Å²	128	93.6 Å²	93.6	68%	0.684	56%	0.56	S	S	*	*			trans	-80.7	32	163	-70.6	-47.5	0	0	0	112	E57	D55-E57 PolarHBondContact O-N 3.05Å
56	E	57.5	Low	67.8	Low	129 Å²	129	96 Å²	96	60%	0.603	57%	0.565	S	S	*	*	S	Bend	trans	-63.8	77.5	158.5	-84.5	-153.4	163.7	0	0	109.8	L54 L58 K93	L54-E56 PolarHBondContact O-N 3.36Å; E56-L58 PolarHBondContact O-N 3.32Å; E56-K93 WeakPolarHBondContact OE2-CE 3.26Å; E56-K93 IonicContact OE2-NZ 3.39Å; E56-K93 PolarHBondContact OE2-NZ 3.31Å
57	E	71.3	Confident	70.2	Confident	180 Å²	180	93.6 Å²	93.6	84%	0.841	54%	0.54	S	S	*	.			trans	33.9	72.9	169.7	-158.8	166.4	-154.2	0	0	114.6	D55 R59	D55-E57 PolarHBondContact O-N 3.05Å; E57-R59 PolarHBondContact O-N 3.18Å
58	L	82.4	Confident	72.5	Confident	57 Å²	57	91 Å²	91	30%	0.298	52%	0.516	S	S	.	.			trans	-47.8	110.8	177.7	-75.4	170.1	0	0	0	111.9	E56 R60 T95	E56-L58 PolarHBondContact O-N 3.32Å; L58-R60 PolarHBondContact O-N 2.97Å; L58-R60 VanDerWaalsContact O-N 3.17Å; L58-T95 HydrophobicContact CD1-CG2 3.82Å; L58-T95 HydrophobicContact CD2-CG2 4.41Å
59	R	85.4	Confident	74.9	Confident	91 Å²	91	92 Å²	92	34%	0.343	51%	0.512	S	S	.	.			trans	-63.1	118.2	-168.5	-156.3	176.3	87.1	84.1	-8.8	111.5	E57 P62 E67 K93 R94	E57-R59 PolarHBondContact O-N 3.18Å; R59-P62 PolarHBondContact NH2-O 2.79Å; R59-E67 IonicContact CZ-OE1 2.73Å; R59-E67 IonicContact CZ-OE2 2.66Å; R59-E67 IonicContact NE-OE1 2.74Å; R59-E67 PolarHBondContact NE-OE1 3.31Å; R59-E67 IonicContact NE-OE2 3.53Å; R59-E67 VanDerWaalsContact NH2-CD 3.31Å; R59-E67 IonicContact NH2-OE1 3.99Å; R59-E67 PolarHBondContact NH2-OE1 3.14Å; R59-E67 IonicContact NH2-OE2 3.98Å; R59-E67 PolarHBondContact NH2-OE2 3.19Å; R59-K93 HydrophobicContact CB-CB 4.49Å; R59-K93 WeakPolarHBondContact CB-O 3.44Å; R59-K93 PolarHBondContact N-O 3.37Å; R59-R94 VanDerWaalsContact O-CD 3.24Å; R59-R94 WeakPolarHBondContact O-CD 3.2Å; R59-R94 PolarHBondContact O-NE 3.09Å; R59-R94 PolarHBondContact O-NH1 3.3Å
60	R	85.3	Confident	77.3	Confident	183 Å²	183	91.6 Å²	91.6	69%	0.691	50%	0.503	S	S	*	.			trans	-97.2	155	170.7	-55.2	-53.7	-176.9	163.9	1.7	109.9	L58	L58-R60 PolarHBondContact O-N 2.97Å; L58-R60 VanDerWaalsContact O-N 3.17Å
61	G	91	Very high	79.8	Confident	46 Å²	46	85.1 Å²	85.1	47%	0.474	47%	0.468	S	S	.	.	S	Bend	trans	106.3	-174.3	-178	0	0	0	0	0	114.5	R94	G61-R94 PolarHBondContact O-NH1 2.8Å; G61-R94 PolarHBondContact O-NH2 2.85Å
62	P	94	Very high	82.2	Confident	113 Å²	113	82.1 Å²	82.1	73%	0.734	46%	0.455	S	S	*	.	S	Bend	trans	-55.5	147.7	-174.8	-24.5	34.2	0	0	0	112.7	R59 R94	R59-P62 PolarHBondContact NH2-O 2.79Å; P62-R94 PolarHBondContact O-NH2 3.16Å
63	W	96.4	Very high	84.9	Confident	44 Å²	44	83.7 Å²	83.7	17%	0.167	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-73.2	134.5	172.4	-78.8	76.9	0	0	0	110.5	E67 L71 L92 R94 S98 C99 R102	W63-E67 WeakPolarHBondContact CA-OE2 3.45Å; W63-E67 HydrophobicContact CE3-CB 3.61Å; W63-E67 HydrophobicContact CZ3-CB 3.9Å; W63-L71 HydrophobicContact CH2-CD2 3.74Å; W63-L71 HydrophobicContact CZ3-CB 4.43Å; W63-L71 HydrophobicContact CZ3-CD2 3.75Å; W63-L92 HydrophobicContact CH2-CD2 3.65Å; W63-L92 HydrophobicContact CZ3-CD2 3.56Å; W63-R94 HydrophobicContact CH2-CB 4.25Å; W63-R94 HydrophobicContact CH2-CG 3.98Å; W63-R94 HydrophobicContact CZ2-CB 4.34Å; W63-R94 HydrophobicContact CZ2-CG 4.09Å; W63-R94 HydrophobicContact CZ3-CG 4.47Å; W63-S98 WeakPolarHBondContact CZ2-OG 3.47Å; W63-S98 PolarHBondContact NE1-OG 3.27Å; W63-C99 HydrophobicContact CH2-CB 4.38Å; W63-R102 HydrophobicContact CD2-CB 4.04Å; W63-R102 HydrophobicContact CD2-CG 3.54Å; W63-R102 HydrophobicContact CE3-CB 4.46Å; W63-R102 HydrophobicContact CE3-CG 3.81Å; W63-R102 HydrophobicContact CG-CG 3.91Å; W63-R102 HydrophobicContact CH2-CB 4.14Å; W63-R102 HydrophobicContact CH2-CG 4.32Å; W63-R102 HydrophobicContact CZ2-CB 3.65Å; W63-R102 HydrophobicContact CZ2-CG 4.07Å; W63-R102 HydrophobicContact CZ3-CG 4.19Å
64	T	96.5	Very high	87.5	Confident	57 Å²	57	83.1 Å²	83.1	35%	0.35	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-85.7	158.7	170.1	52	0	0	0	0	110.5	D66 E67 D68	T64-D66 PolarHBondContact O-N 3.27Å; T64-E67 PolarHBondContact N-OE2 3.34Å; T64-E67 PolarHBondContact O-N 3.48Å; T64-E67 VanDerWaalsContact OG1-CG 3.29Å; T64-E67 WeakPolarHBondContact OG1-CG 3.38Å; T64-E67 PolarHBondContact OG1-N 3.17Å; T64-E67 PolarHBondContact OG1-OE2 3.21Å; T64-D68 PolarHBondContact O-N 2.66Å
65	V	96.7	Very high	89.7	Confident	104 Å²	104	78.3 Å²	78.3	63%	0.63	41%	0.405	S	S	*	.	H	α-helix	trans	-59.8	-37	175.3	-177.9	0	0	0	0	110.6	D68 L69	V65-D68 PolarHBondContact O-N 3.19Å; V65-L69 HydrophobicContact CG1-CD1 4.09Å; V65-L69 HydrophobicContact CG1-CG 4.29Å; V65-L69 WeakPolarHBondContact O-CB 3.45Å; V65-L69 VanDerWaalsContact O-CG 3.31Å; V65-L69 WeakPolarHBondContact O-CG 3.43Å; V65-L69 PolarHBondContact O-N 3.1Å
66	D	97.1	Very high	91.8	Very high	116 Å²	116	76 Å²	76	62%	0.62	40%	0.404	S	S	*	.	H	α-helix	trans	-63.4	-45.9	177.3	-44.8	-59.8	0	0	0	112	T64 D68 L69 T70	T64-D66 PolarHBondContact O-N 3.27Å; D66-D68 VanDerWaalsContact C-N 3.29Å; D66-D68 PolarHBondContact O-N 3.38Å; D66-L69 PolarHBondContact O-N 2.87Å; D66-T70 PolarHBondContact O-N 3.33Å; D66-T70 PolarHBondContact O-OG1 3.39Å
67	E	97.2	Very high	93.6	Very high	24 Å²	24	76 Å²	76	11%	0.112	41%	0.408	C	S	.	.	H	α-helix	trans	-61.7	-38.2	175.4	-73.3	172.7	142.2	0	0	111.9	R59 W63 T64 L71 R94	R59-E67 IonicContact CZ-OE1 2.73Å; R59-E67 IonicContact CZ-OE2 2.66Å; R59-E67 IonicContact NE-OE1 2.74Å; R59-E67 PolarHBondContact NE-OE1 3.31Å; R59-E67 IonicContact NE-OE2 3.53Å; R59-E67 VanDerWaalsContact NH2-CD 3.31Å; R59-E67 IonicContact NH2-OE1 3.99Å; R59-E67 PolarHBondContact NH2-OE1 3.14Å; R59-E67 IonicContact NH2-OE2 3.98Å; R59-E67 PolarHBondContact NH2-OE2 3.19Å; W63-E67 WeakPolarHBondContact CA-OE2 3.45Å; W63-E67 HydrophobicContact CE3-CB 3.61Å; W63-E67 HydrophobicContact CZ3-CB 3.9Å; T64-E67 PolarHBondContact N-OE2 3.34Å; T64-E67 PolarHBondContact O-N 3.48Å; T64-E67 VanDerWaalsContact OG1-CG 3.29Å; T64-E67 WeakPolarHBondContact OG1-CG 3.38Å; T64-E67 PolarHBondContact OG1-N 3.17Å; T64-E67 PolarHBondContact OG1-OE2 3.21Å; E67-L71 VanDerWaalsContact O-CB 3.3Å; E67-L71 WeakPolarHBondContact O-CB 3.48Å; E67-L71 PolarHBondContact O-N 3.36Å; E67-R94 IonicContact OE1-CZ 3.11Å; E67-R94 IonicContact OE1-NE 3.09Å; E67-R94 PolarHBondContact OE1-NE 3.41Å; E67-R94 IonicContact OE1-NH2 2.89Å; E67-R94 PolarHBondContact OE1-NH2 3.32Å; E67-R94 IonicContact OE2-CZ 3.34Å; E67-R94 IonicContact OE2-NE 3.91Å; E67-R94 IonicContact OE2-NH2 3.75Å; E67-R94 PolarHBondContact OE2-NH2 3.16Å
68	D	97.8	Very high	94.8	Very high	17 Å²	17	73.2 Å²	73.2	9%	0.091	40%	0.395	C	S	.	.	H	α-helix	trans	-66.3	-43.8	176.2	-70.6	-29.8	0	0	0	111.4	T64 V65 D66 L71 I72 R102 L107	T64-D68 PolarHBondContact O-N 2.66Å; V65-D68 PolarHBondContact O-N 3.19Å; D66-D68 VanDerWaalsContact C-N 3.29Å; D66-D68 PolarHBondContact O-N 3.38Å; D68-L71 PolarHBondContact O-N 3Å; D68-I72 WeakPolarHBondContact O-CB 3.46Å; D68-I72 WeakPolarHBondContact O-CD1 3.48Å; D68-I72 WeakPolarHBondContact O-CG1 3.23Å; D68-I72 PolarHBondContact O-N 2.88Å; D68-R102 IonicContact OD1-CZ 3.95Å; D68-R102 IonicContact OD1-NE 2.68Å; D68-R102 PolarHBondContact OD1-NE 3.18Å; D68-R102 IonicContact OD1-NH2 3.97Å; D68-R102 PolarHBondContact OD1-NH2 3.13Å; D68-R102 IonicContact OD2-CZ 3.11Å; D68-R102 IonicContact OD2-NE 3.56Å; D68-R102 IonicContact OD2-NH2 3.66Å; D68-R102 PolarHBondContact OD2-NH2 2.95Å; D68-L107 HydrophobicContact CB-CD1 3.82Å; D68-L107 HydrophobicContact CB-CD2 3.83Å; D68-L107 HydrophobicContact CB-CG 4.49Å
69	L	97.7	Very high	95.5	Very high	86 Å²	86	72.2 Å²	72.2	45%	0.45	40%	0.398	S	S	.	.	H	α-helix	trans	-64	-44.5	177.1	-72.7	173.2	0	0	0	111.8	V65 D66 L71 I72 N73	V65-L69 HydrophobicContact CG1-CD1 4.09Å; V65-L69 HydrophobicContact CG1-CG 4.29Å; V65-L69 WeakPolarHBondContact O-CB 3.45Å; V65-L69 VanDerWaalsContact O-CG 3.31Å; V65-L69 WeakPolarHBondContact O-CG 3.43Å; V65-L69 PolarHBondContact O-N 3.1Å; D66-L69 PolarHBondContact O-N 2.87Å; L69-L71 VanDerWaalsContact C-N 3.29Å; L69-L71 PolarHBondContact O-N 2.97Å; L69-I72 PolarHBondContact O-N 3.17Å; L69-N73 WeakPolarHBondContact O-CB 3.38Å; L69-N73 PolarHBondContact O-N 3.19Å; L69-N73 PolarHBondContact O-OD1 3.09Å
70	T	97.3	Very high	95.9	Very high	63 Å²	63	72.6 Å²	72.6	39%	0.387	40%	0.403	S	S	.	.	H	α-helix	trans	-61.3	-39.7	174.9	-51	0	0	0	0	111.4	D66 Y74 A90 L92	D66-T70 PolarHBondContact O-N 3.33Å; D66-T70 PolarHBondContact O-OG1 3.39Å; T70-Y74 WeakPolarHBondContact O-CB 2.79Å; T70-Y74 PolarHBondContact O-N 2.87Å; T70-Y74 VanDerWaalsContact O-N 3.09Å; T70-A90 HydrophobicContact CG2-CB 4.45Å; T70-A90 VanDerWaalsContact CG2-O 3.28Å; T70-A90 WeakPolarHBondContact CG2-O 3.5Å; T70-L92 HydrophobicContact CG2-CD1 3.46Å; T70-L92 VanDerWaalsContact CG2-CD1 3.46Å
71	L	97.5	Very high	96.3	Very high	0 Å²	0	65 Å²	65	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-66.5	-42.5	176	-179.4	55.7	0	0	0	112.5	W63 E67 D68 L69 I75 L86 L92 C99 R102 L107	W63-L71 HydrophobicContact CH2-CD2 3.74Å; W63-L71 HydrophobicContact CZ3-CB 4.43Å; W63-L71 HydrophobicContact CZ3-CD2 3.75Å; E67-L71 VanDerWaalsContact O-CB 3.3Å; E67-L71 WeakPolarHBondContact O-CB 3.48Å; E67-L71 PolarHBondContact O-N 3.36Å; D68-L71 PolarHBondContact O-N 3Å; L69-L71 VanDerWaalsContact C-N 3.29Å; L69-L71 PolarHBondContact O-N 2.97Å; L71-I75 HydrophobicContact CD1-CD1 3.65Å; L71-I75 HydrophobicContact CD1-CG1 4.32Å; L71-I75 HydrophobicContact CG-CD1 4.06Å; L71-I75 WeakPolarHBondContact O-CD1 3.48Å; L71-I75 VanDerWaalsContact O-CG1 3.28Å; L71-I75 WeakPolarHBondContact O-CG1 3.29Å; L71-I75 PolarHBondContact O-N 3.37Å; L71-L86 HydrophobicContact CD1-CD2 3.6Å; L71-L92 HydrophobicContact CB-CD2 4.22Å; L71-C99 HydrophobicContact CD1-CB 4.02Å; L71-C99 HydrophobicContact CD2-CB 4.25Å; L71-R102 HydrophobicContact CD2-CB 4.18Å; L71-R102 HydrophobicContact CD2-CG 4.21Å; L71-L107 HydrophobicContact CB-CD1 4.27Å; L71-L107 HydrophobicContact CD2-CD1 3.79Å; L71-L107 HydrophobicContact CG-CD1 4.14Å
72	I	97.5	Very high	96.6	Very high	58 Å²	58	73.6 Å²	73.6	30%	0.297	40%	0.4	S	S	.	.	H	α-helix	trans	-63.1	-52.1	177	-71.3	158.6	0	0	0	110.6	D68 L69 Y74 I75 A76 W103 L107	D68-I72 WeakPolarHBondContact O-CB 3.46Å; D68-I72 WeakPolarHBondContact O-CD1 3.48Å; D68-I72 WeakPolarHBondContact O-CG1 3.23Å; D68-I72 PolarHBondContact O-N 2.88Å; L69-I72 PolarHBondContact O-N 3.17Å; I72-Y74 PolarHBondContact O-N 3.08Å; I72-I75 PolarHBondContact O-N 3.23Å; I72-A76 PolarHBondContact O-N 3.42Å; I72-W103 HydrophobicContact CG1-CZ3 4.06Å; I72-L107 HydrophobicContact CD1-CB 4.38Å; I72-L107 HydrophobicContact CD1-CD1 4.32Å; I72-L107 HydrophobicContact CD1-CD2 4.38Å; I72-L107 HydrophobicContact CG1-CB 4.13Å; I72-L107 HydrophobicContact CG1-CD1 4.06Å
73	N	97.2	Very high	96.7	Very high	93 Å²	93	70.1 Å²	70.1	50%	0.497	37%	0.373	S	S	.	.	H	α-helix	trans	-61	-47.1	-176.9	-66.7	-8.1	0	0	0	111	L69 I75 A76 D77	L69-N73 WeakPolarHBondContact O-CB 3.38Å; L69-N73 PolarHBondContact O-N 3.19Å; L69-N73 PolarHBondContact O-OD1 3.09Å; N73-I75 VanDerWaalsContact C-N 3.29Å; N73-I75 PolarHBondContact O-N 3.25Å; N73-A76 WeakPolarHBondContact O-CB 3.49Å; N73-A76 PolarHBondContact O-N 3.45Å; N73-A76 VanDerWaalsContact O-N 3.12Å; N73-D77 PolarHBondContact O-N 3.38Å
74	Y	97.5	Very high	96.6	Very high	45 Å²	45	73.1 Å²	73.1	18%	0.176	39%	0.392	C	S	.	.	H	α-helix	trans	-59	-40.3	178.3	-172.7	-81.5	0	0	0	112.4	T70 I72 D77 H78 L86 A89 A90	T70-Y74 WeakPolarHBondContact O-CB 2.79Å; T70-Y74 PolarHBondContact O-N 2.87Å; T70-Y74 VanDerWaalsContact O-N 3.09Å; I72-Y74 PolarHBondContact O-N 3.08Å; Y74-D77 PolarHBondContact O-N 2.9Å; Y74-H78 HydrophobicContact CD1-CB 4.21Å; Y74-H78 AromaticContact CD1-ND1 3.99Å; Y74-H78 AromaticContact CD2-CE1 3.87Å; Y74-H78 AromaticContact CD2-ND1 3.67Å; Y74-H78 HydrophobicContact CE1-CB 3.73Å; Y74-H78 AromaticContact CE1-CG 3.84Å; Y74-H78 AromaticContact CE1-ND1 3.92Å; Y74-H78 AromaticContact CE2-CE1 3.64Å; Y74-H78 AromaticContact CE2-ND1 3.58Å; Y74-H78 AromaticContact CG-ND1 3.87Å; Y74-H78 AromaticContact CZ-CG 3.66Å; Y74-H78 AromaticContact CZ-ND1 3.69Å; Y74-H78 WeakPolarHBondContact O-CB 3.28Å; Y74-H78 PolarHBondContact O-N 2.84Å; Y74-H78 PolarHBondContact O-ND1 3.45Å; Y74-L86 HydrophobicContact CD1-CB 4.47Å; Y74-L86 HydrophobicContact CD1-CD1 3.83Å; Y74-L86 HydrophobicContact CD1-CD2 4.46Å; Y74-L86 HydrophobicContact CD1-CG 3.55Å; Y74-L86 HydrophobicContact CE1-CB 4.03Å; Y74-L86 HydrophobicContact CE1-CD1 3.98Å; Y74-L86 HydrophobicContact CE1-CG 3.6Å; Y74-A89 HydrophobicContact CE2-CB 3.69Å; Y74-A89 VanDerWaalsContact OH-CB 3.27Å; Y74-A89 WeakPolarHBondContact OH-CB 3.31Å; Y74-A90 HydrophobicContact CD1-CB 4.43Å; Y74-A90 HydrophobicContact CD2-CB 3.6Å; Y74-A90 HydrophobicContact CE2-CB 4.28Å; Y74-A90 HydrophobicContact CG-CB 3.69Å
75	I	97.5	Very high	96.6	Very high	11 Å²	11	72.6 Å²	72.6	6%	0.056	39%	0.394	C	S	.	.	H	α-helix	trans	-71	-34.1	178	-69.6	169	0	0	0	111.8	L71 I72 N73 D77 G79 E80 W83 L86 W103	L71-I75 HydrophobicContact CD1-CD1 3.65Å; L71-I75 HydrophobicContact CD1-CG1 4.32Å; L71-I75 HydrophobicContact CG-CD1 4.06Å; L71-I75 WeakPolarHBondContact O-CD1 3.48Å; L71-I75 VanDerWaalsContact O-CG1 3.28Å; L71-I75 WeakPolarHBondContact O-CG1 3.29Å; L71-I75 PolarHBondContact O-N 3.37Å; I72-I75 PolarHBondContact O-N 3.23Å; N73-I75 VanDerWaalsContact C-N 3.29Å; N73-I75 PolarHBondContact O-N 3.25Å; I75-D77 VanDerWaalsContact C-N 3.32Å; I75-G79 WeakPolarHBondContact O-CA 3.25Å; I75-G79 PolarHBondContact O-N 3.46Å; I75-E80 HydrophobicContact CG2-CB 4.18Å; I75-W83 HydrophobicContact CD1-CH2 4.22Å; I75-W83 HydrophobicContact CD1-CZ3 3.9Å; I75-L86 HydrophobicContact CD1-CD1 4.3Å; I75-L86 HydrophobicContact CG1-CD1 3.73Å; I75-W103 HydrophobicContact CB-CH2 4.26Å; I75-W103 HydrophobicContact CB-CZ3 4.36Å; I75-W103 HydrophobicContact CD1-CB 4.37Å; I75-W103 HydrophobicContact CD1-CD2 3.48Å; I75-W103 VanDerWaalsContact CD1-CD2 3.48Å; I75-W103 HydrophobicContact CD1-CE3 3.44Å; I75-W103 VanDerWaalsContact CD1-CE3 3.44Å; I75-W103 HydrophobicContact CD1-CG 3.9Å; I75-W103 HydrophobicContact CD1-CH2 4.39Å; I75-W103 HydrophobicContact CD1-CZ2 4.42Å; I75-W103 HydrophobicContact CD1-CZ3 3.93Å; I75-W103 HydrophobicContact CG2-CH2 3.71Å; I75-W103 HydrophobicContact CG2-CZ2 3.57Å; I75-W103 HydrophobicContact CG2-CZ3 4.25Å
76	A	96.6	Very high	96.5	Very high	80 Å²	80	67.9 Å²	67.9	66%	0.661	37%	0.365	S	S	*	.	H	α-helix	trans	-62.8	-40.9	174	0	0	0	0	0	111.6	I72 N73	I72-A76 PolarHBondContact O-N 3.42Å; N73-A76 WeakPolarHBondContact O-CB 3.49Å; N73-A76 PolarHBondContact O-N 3.45Å; N73-A76 VanDerWaalsContact O-N 3.12Å
77	D	96.5	Very high	96.5	Very high	129 Å²	129	62.5 Å²	62.5	69%	0.69	34%	0.337	S	S	*	.	H	α-helix	trans	-80.4	-36.1	-177.6	-62.3	-25.6	0	0	0	113.5	N73 Y74 I75	N73-D77 PolarHBondContact O-N 3.38Å; Y74-D77 PolarHBondContact O-N 2.9Å; I75-D77 VanDerWaalsContact C-N 3.32Å
78	H	96.3	Very high	96.3	Very high	121 Å²	121	67.5 Å²	67.5	56%	0.56	35%	0.354	S	S	*	.	H	α-helix	trans	-117.1	-7.1	-169.7	-56.2	82.6	0	0	0	115	Y74	Y74-H78 HydrophobicContact CD1-CB 4.21Å; Y74-H78 AromaticContact CD1-ND1 3.99Å; Y74-H78 AromaticContact CD2-CE1 3.87Å; Y74-H78 AromaticContact CD2-ND1 3.67Å; Y74-H78 HydrophobicContact CE1-CB 3.73Å; Y74-H78 AromaticContact CE1-CG 3.84Å; Y74-H78 AromaticContact CE1-ND1 3.92Å; Y74-H78 AromaticContact CE2-CE1 3.64Å; Y74-H78 AromaticContact CE2-ND1 3.58Å; Y74-H78 AromaticContact CG-ND1 3.87Å; Y74-H78 AromaticContact CZ-CG 3.66Å; Y74-H78 AromaticContact CZ-ND1 3.69Å; Y74-H78 WeakPolarHBondContact O-CB 3.28Å; Y74-H78 PolarHBondContact O-N 2.84Å; Y74-H78 PolarHBondContact O-ND1 3.45Å
79	G	95.7	Very high	96.1	Very high	36 Å²	36	69.9 Å²	69.9	37%	0.371	38%	0.376	S	S	.	.			trans	81.4	169.9	-174.4	0	0	0	0	0	114.9	I75	I75-G79 WeakPolarHBondContact O-CA 3.25Å; I75-G79 PolarHBondContact O-N 3.46Å
80	E	95.1	Very high	96	Very high	98 Å²	98	66.5 Å²	66.5	46%	0.458	36%	0.361	S	S	.	.	S	Bend	trans	-85	140.9	177.6	65.7	179.2	-163.6	0	0	112.4	I75 W83 W103 R108	I75-E80 HydrophobicContact CG2-CB 4.18Å; E80-W83 HydrophobicContact CB-CH2 4.1Å; E80-W83 HydrophobicContact CB-CZ2 4.23Å; E80-W103 PolarHBondContact OE2-NE1 3.39Å; E80-R108 IonicContact OE1-CZ 3.17Å; E80-R108 IonicContact OE1-NH2 3.7Å; E80-R108 PolarHBondContact OE1-NH2 3.2Å; E80-R108 IonicContact OE2-NE 3.15Å; E80-R108 PolarHBondContact OE2-NE 3.23Å; E80-R108 IonicContact OE2-NH2 2.61Å
81	G	94.4	Very high	95.8	Very high	24 Å²	24	66.5 Å²	66.5	25%	0.247	37%	0.373	C	S	.	.			trans	133.1	-172.1	177.3	0	0	0	0	0	114.1	W83	G81-W83 PolarHBondContact O-N 3.38Å
82	R	95.4	Very high	95.6	Very high	226 Å²	226	67.3 Å²	67.3	85%	0.853	38%	0.377	S	S	*	.			trans	38.8	44.1	-179.7	-53.9	-173	-160.8	124.7	3.5	113.8	N84 A85 L86	R82-N84 PolarHBondContact O-N 3.44Å; R82-A85 HydrophobicContact CB-CB 4.28Å; R82-A85 WeakPolarHBondContact O-CA 3.36Å; R82-A85 WeakPolarHBondContact O-CB 3.44Å; R82-A85 PolarHBondContact O-N 3.43Å; R82-L86 PolarHBondContact O-N 3.43Å
83	W	97	Very high	95.5	Very high	41 Å²	41	69.6 Å²	69.6	16%	0.155	39%	0.385	C	S	.	.	H	α-helix	trans	-52	-30.7	-159.2	-60.3	98.8	0	0	0	116.6	I75 E80 G81 L86 A87 G96 C99 R100 W103	I75-W83 HydrophobicContact CD1-CH2 4.22Å; I75-W83 HydrophobicContact CD1-CZ3 3.9Å; E80-W83 HydrophobicContact CB-CH2 4.1Å; E80-W83 HydrophobicContact CB-CZ2 4.23Å; G81-W83 PolarHBondContact O-N 3.38Å; W83-L86 HydrophobicContact CE3-CD1 4.15Å; W83-L86 HydrophobicContact CE3-CD2 4.31Å; W83-L86 HydrophobicContact CZ3-CD1 4.16Å; W83-A87 WeakPolarHBondContact O-CB 3.27Å; W83-A87 PolarHBondContact O-N 2.85Å; W83-G96 WeakPolarHBondContact CB-O 3.34Å; W83-G96 WeakPolarHBondContact O-CA 3.1Å; W83-C99 HydrophobicContact CE3-CB 4.25Å; W83-R100 HydrophobicContact CB-CB 4.37Å; W83-R100 HydrophobicContact CD2-CB 3.55Å; W83-R100 HydrophobicContact CD2-CG 4Å; W83-R100 HydrophobicContact CE3-CB 3.97Å; W83-R100 HydrophobicContact CG-CB 3.71Å; W83-R100 HydrophobicContact CG-CG 4.23Å; W83-R100 HydrophobicContact CZ2-CB 4.41Å; W83-R100 HydrophobicContact CZ2-CG 4.12Å; W83-W103 HydrophobicContact CH2-CB 3.91Å; W83-W103 AromaticContact CH2-CD1 3.5Å; W83-W103 AromaticContact CH2-CG 3.81Å; W83-W103 HydrophobicContact CH2-CG 3.81Å; W83-W103 HydrophobicContact CZ3-CB 4.02Å; W83-W103 HydrophobicContact CZ3-CG 4.28Å
84	N	95.3	Very high	95.4	Very high	107 Å²	107	65.7 Å²	65.7	57%	0.572	36%	0.363	S	S	*	.	H	α-helix	trans	-72.5	-38.9	175.8	-65.2	-14.7	0	0	0	112.5	R82 R88 G96	R82-N84 PolarHBondContact O-N 3.44Å; N84-R88 PolarHBondContact O-N 3.19Å; N84-G96 WeakPolarHBondContact OD1-CA 3.37Å
85	A	94.9	Very high	95.3	Very high	46 Å²	46	65.6 Å²	65.6	38%	0.38	37%	0.368	S	S	.	.	H	α-helix	trans	-70.3	-43	173.6	0	0	0	0	0	110.7	R82 A87 R88 A89	R82-A85 HydrophobicContact CB-CB 4.28Å; R82-A85 WeakPolarHBondContact O-CA 3.36Å; R82-A85 WeakPolarHBondContact O-CB 3.44Å; R82-A85 PolarHBondContact O-N 3.43Å; A85-A87 PolarHBondContact O-N 3.5Å; A85-R88 PolarHBondContact O-N 3.48Å; A85-A89 WeakPolarHBondContact O-CB 3.44Å; A85-A89 PolarHBondContact O-N 3.35Å
86	L	96.1	Very high	95.2	Very high	5 Å²	5	65.2 Å²	65.2	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-53.3	-50	174.1	176.9	150.9	0	0	0	111.8	L71 Y74 I75 R82 W83 R88 A89 A90 C99	L71-L86 HydrophobicContact CD1-CD2 3.6Å; Y74-L86 HydrophobicContact CD1-CB 4.47Å; Y74-L86 HydrophobicContact CD1-CD1 3.83Å; Y74-L86 HydrophobicContact CD1-CD2 4.46Å; Y74-L86 HydrophobicContact CD1-CG 3.55Å; Y74-L86 HydrophobicContact CE1-CB 4.03Å; Y74-L86 HydrophobicContact CE1-CD1 3.98Å; Y74-L86 HydrophobicContact CE1-CG 3.6Å; I75-L86 HydrophobicContact CD1-CD1 4.3Å; I75-L86 HydrophobicContact CG1-CD1 3.73Å; R82-L86 PolarHBondContact O-N 3.43Å; W83-L86 HydrophobicContact CE3-CD1 4.15Å; W83-L86 HydrophobicContact CE3-CD2 4.31Å; W83-L86 HydrophobicContact CZ3-CD1 4.16Å; L86-R88 VanDerWaalsContact C-N 3.32Å; L86-R88 PolarHBondContact O-N 3.44Å; L86-A89 PolarHBondContact O-N 3.11Å; L86-A90 WeakPolarHBondContact O-CB 3.35Å; L86-A90 PolarHBondContact O-N 3.44Å; L86-C99 HydrophobicContact CD2-CB 4.2Å
87	A	95.5	Very high	95.2	Very high	3 Å²	3	69.9 Å²	69.9	3%	0.025	37%	0.372	C	S	.	.	H	α-helix	trans	-60.3	-41.5	-178.9	0	0	0	0	0	112.6	W83 A85 G91 L92 R94	W83-A87 WeakPolarHBondContact O-CB 3.27Å; W83-A87 PolarHBondContact O-N 2.85Å; A85-A87 PolarHBondContact O-N 3.5Å; A87-G91 PolarHBondContact O-N 3.26Å; A87-L92 PolarHBondContact O-N 3.47Å; A87-R94 WeakPolarHBondContact CB-O 3.17Å
88	R	94	Very high	95.2	Very high	129 Å²	129	65 Å²	65	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-68.5	-47.5	176.8	-67.4	-170.9	-66.5	-146.5	9.8	112.3	L54 N84 A85 L86 A90 G91	L54-R88 HydrophobicContact CD1-CG 4.08Å; N84-R88 PolarHBondContact O-N 3.19Å; A85-R88 PolarHBondContact O-N 3.48Å; L86-R88 VanDerWaalsContact C-N 3.32Å; L86-R88 PolarHBondContact O-N 3.44Å; R88-A90 VanDerWaalsContact C-N 3.33Å; R88-A90 PolarHBondContact O-N 3.44Å; R88-G91 PolarHBondContact O-N 3.19Å; R88-G91 VanDerWaalsContact O-N 3.1Å
89	A	94.4	Very high	95.2	Very high	67 Å²	67	59.2 Å²	59.2	55%	0.554	32%	0.321	S	S	*	.	H	α-helix	trans	-68.9	-30.6	-177.3	0	0	0	0	0	113	Y74 A85 L86 G91	Y74-A89 HydrophobicContact CE2-CB 3.69Å; Y74-A89 VanDerWaalsContact OH-CB 3.27Å; Y74-A89 WeakPolarHBondContact OH-CB 3.31Å; A85-A89 WeakPolarHBondContact O-CB 3.44Å; A85-A89 PolarHBondContact O-N 3.35Å; L86-A89 PolarHBondContact O-N 3.11Å; A89-G91 VanDerWaalsContact C-N 3.25Å; A89-G91 PolarHBondContact O-N 2.97Å
90	A	94.3	Very high	95.3	Very high	15 Å²	15	64.1 Å²	64.1	12%	0.124	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-3.2	172.9	0	0	0	0	0	113.7	T70 Y74 L86 R88 L92	T70-A90 HydrophobicContact CG2-CB 4.45Å; T70-A90 VanDerWaalsContact CG2-O 3.28Å; T70-A90 WeakPolarHBondContact CG2-O 3.5Å; Y74-A90 HydrophobicContact CD1-CB 4.43Å; Y74-A90 HydrophobicContact CD2-CB 3.6Å; Y74-A90 HydrophobicContact CE2-CB 4.28Å; Y74-A90 HydrophobicContact CG-CB 3.69Å; L86-A90 WeakPolarHBondContact O-CB 3.35Å; L86-A90 PolarHBondContact O-N 3.44Å; R88-A90 VanDerWaalsContact C-N 3.33Å; R88-A90 PolarHBondContact O-N 3.44Å; A90-L92 HydrophobicContact CB-CD1 3.64Å; A90-L92 PolarHBondContact O-N 3.15Å
91	G	93.5	Very high	95.4	Very high	62 Å²	62	64.6 Å²	64.6	64%	0.639	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	15.2	-177.2	0	0	0	0	0	114.9	A87 R88 A89 K93	A87-G91 PolarHBondContact O-N 3.26Å; R88-G91 PolarHBondContact O-N 3.19Å; R88-G91 VanDerWaalsContact O-N 3.1Å; A89-G91 VanDerWaalsContact C-N 3.25Å; A89-G91 PolarHBondContact O-N 2.97Å; G91-K93 PolarHBondContact O-N 2.99Å
92	L	94	Very high	95.6	Very high	18 Å²	18	65.8 Å²	65.8	9%	0.094	33%	0.33	C	S	.	.			trans	-75.3	126.2	179.5	-92.5	75.6	0	0	0	110.8	W63 T70 L71 A87 A90 R94	W63-L92 HydrophobicContact CH2-CD2 3.65Å; W63-L92 HydrophobicContact CZ3-CD2 3.56Å; T70-L92 HydrophobicContact CG2-CD1 3.46Å; T70-L92 VanDerWaalsContact CG2-CD1 3.46Å; L71-L92 HydrophobicContact CB-CD2 4.22Å; A87-L92 PolarHBondContact O-N 3.47Å; A90-L92 HydrophobicContact CB-CD1 3.64Å; A90-L92 PolarHBondContact O-N 3.15Å; L92-R94 HydrophobicContact CB-CB 4.3Å; L92-R94 HydrophobicContact CD2-CB 4.49Å; L92-R94 HydrophobicContact CD2-CG 4.41Å; L92-R94 PolarHBondContact O-N 3.14Å
93	K	94.1	Very high	95.7	Very high	105 Å²	105	56.1 Å²	56.1	46%	0.457	29%	0.294	S	S	.	.	S	Bend	trans	-72.9	45.1	167.7	-61.4	-162.8	170.4	-158.7	0	112.5	E56 R59 G91	E56-K93 WeakPolarHBondContact OE2-CE 3.26Å; E56-K93 IonicContact OE2-NZ 3.39Å; E56-K93 PolarHBondContact OE2-NZ 3.31Å; R59-K93 HydrophobicContact CB-CB 4.49Å; R59-K93 WeakPolarHBondContact CB-O 3.44Å; R59-K93 PolarHBondContact N-O 3.37Å; G91-K93 PolarHBondContact O-N 2.99Å
94	R	94.7	Very high	95.6	Very high	11 Å²	11	57 Å²	57	4%	0.042	30%	0.301	C	S	.	.	S	Bend	trans	-134.3	148.7	-176.1	-63.1	-61.6	-164.6	143.8	16.1	110.4	R59 G61 P62 W63 E67 A87 L92	R59-R94 VanDerWaalsContact O-CD 3.24Å; R59-R94 WeakPolarHBondContact O-CD 3.2Å; R59-R94 PolarHBondContact O-NE 3.09Å; R59-R94 PolarHBondContact O-NH1 3.3Å; G61-R94 PolarHBondContact O-NH1 2.8Å; G61-R94 PolarHBondContact O-NH2 2.85Å; P62-R94 PolarHBondContact O-NH2 3.16Å; W63-R94 HydrophobicContact CH2-CB 4.25Å; W63-R94 HydrophobicContact CH2-CG 3.98Å; W63-R94 HydrophobicContact CZ2-CB 4.34Å; W63-R94 HydrophobicContact CZ2-CG 4.09Å; W63-R94 HydrophobicContact CZ3-CG 4.47Å; E67-R94 IonicContact OE1-CZ 3.11Å; E67-R94 IonicContact OE1-NE 3.09Å; E67-R94 PolarHBondContact OE1-NE 3.41Å; E67-R94 IonicContact OE1-NH2 2.89Å; E67-R94 PolarHBondContact OE1-NH2 3.32Å; E67-R94 IonicContact OE2-CZ 3.34Å; E67-R94 IonicContact OE2-NE 3.91Å; E67-R94 IonicContact OE2-NH2 3.75Å; E67-R94 PolarHBondContact OE2-NH2 3.16Å; A87-R94 WeakPolarHBondContact CB-O 3.17Å; L92-R94 HydrophobicContact CB-CB 4.3Å; L92-R94 HydrophobicContact CD2-CB 4.49Å; L92-R94 HydrophobicContact CD2-CG 4.41Å; L92-R94 PolarHBondContact O-N 3.14Å
95	T	95.4	Very high	95.7	Very high	44 Å²	44	52.9 Å²	52.9	27%	0.27	28%	0.279	S	S	.	.			trans	-71.1	148.2	173.1	63.4	0	0	0	0	111.3	L58 K97 S98 C99	L58-T95 HydrophobicContact CD1-CG2 3.82Å; L58-T95 HydrophobicContact CD2-CG2 4.41Å; T95-K97 PolarHBondContact O-N 2.87Å; T95-K97 VanDerWaalsContact O-N 3.17Å; T95-S98 WeakPolarHBondContact O-CA 3.46Å; T95-S98 WeakPolarHBondContact O-CB 3.37Å; T95-S98 PolarHBondContact O-N 2.84Å; T95-S98 PolarHBondContact OG1-N 3.15Å; T95-C99 PolarHBondContact O-N 3.38Å; T95-C99 VanDerWaalsContact O-N 3.09Å; T95-C99 PolarHBondContact O-SG 3.05Å
96	G	96.1	Very high	95.8	Very high	3 Å²	3	55.8 Å²	55.8	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-33.2	176.1	0	0	0	0	0	113.8	W83 N84 S98 C99 R100	W83-G96 WeakPolarHBondContact CB-O 3.34Å; W83-G96 WeakPolarHBondContact O-CA 3.1Å; N84-G96 WeakPolarHBondContact OD1-CA 3.37Å; G96-S98 VanDerWaalsContact C-N 3.3Å; G96-S98 PolarHBondContact O-N 3.09Å; G96-C99 PolarHBondContact O-N 2.89Å; G96-R100 PolarHBondContact O-N 2.72Å
97	K	95.8	Very high	95.8	Very high	178 Å²	178	56.7 Å²	56.7	77%	0.774	29%	0.286	S	S	*	.	H	α-helix	trans	-59	-39.4	170.8	-175.2	176.2	-179.1	176.6	0	112.3	T95 L101	T95-K97 PolarHBondContact O-N 2.87Å; T95-K97 VanDerWaalsContact O-N 3.17Å; K97-L101 WeakPolarHBondContact O-CB 3.43Å; K97-L101 PolarHBondContact O-N 3.14Å; K97-L101 VanDerWaalsContact O-N 3.13Å
98	S	96.3	Very high	95.8	Very high	26 Å²	26	60.3 Å²	60.3	18%	0.182	30%	0.299	C	S	.	.	H	α-helix	trans	-66.2	-47.5	174.9	-163.7	0	0	0	0	110.7	W63 T95 G96 R100 L101 R102	W63-S98 WeakPolarHBondContact CZ2-OG 3.47Å; W63-S98 PolarHBondContact NE1-OG 3.27Å; T95-S98 WeakPolarHBondContact O-CA 3.46Å; T95-S98 WeakPolarHBondContact O-CB 3.37Å; T95-S98 PolarHBondContact O-N 2.84Å; T95-S98 PolarHBondContact OG1-N 3.15Å; G96-S98 VanDerWaalsContact C-N 3.3Å; G96-S98 PolarHBondContact O-N 3.09Å; S98-R100 PolarHBondContact O-N 3.05Å; S98-L101 PolarHBondContact O-N 3.32Å; S98-R102 WeakPolarHBondContact O-CB 3.49Å; S98-R102 PolarHBondContact O-N 3.42Å
99	C	97.4	Very high	95.8	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-47	179	-54.2	0	0	0	0	111.7	W63 L71 W83 L86 T95 G96 L101 R102 W103	W63-C99 HydrophobicContact CH2-CB 4.38Å; L71-C99 HydrophobicContact CD1-CB 4.02Å; L71-C99 HydrophobicContact CD2-CB 4.25Å; W83-C99 HydrophobicContact CE3-CB 4.25Å; L86-C99 HydrophobicContact CD2-CB 4.2Å; T95-C99 PolarHBondContact O-N 3.38Å; T95-C99 VanDerWaalsContact O-N 3.09Å; T95-C99 PolarHBondContact O-SG 3.05Å; G96-C99 PolarHBondContact O-N 2.89Å; C99-L101 VanDerWaalsContact C-N 3.35Å; C99-L101 PolarHBondContact O-N 2.83Å; C99-R102 PolarHBondContact O-N 3.27Å; C99-W103 WeakPolarHBondContact O-CB 3.26Å; C99-W103 PolarHBondContact O-N 3.29Å
100	R	97.7	Very high	95.8	Very high	138 Å²	138	60.5 Å²	60.5	52%	0.521	31%	0.307	S	S	.	.	H	α-helix	trans	-56.4	-47.6	174.4	-176.4	178.5	177.4	-174	-0.5	112	W83 G96 S98 L104	W83-R100 HydrophobicContact CB-CB 4.37Å; W83-R100 HydrophobicContact CD2-CB 3.55Å; W83-R100 HydrophobicContact CD2-CG 4Å; W83-R100 HydrophobicContact CE3-CB 3.97Å; W83-R100 HydrophobicContact CG-CB 3.71Å; W83-R100 HydrophobicContact CG-CG 4.23Å; W83-R100 HydrophobicContact CZ2-CB 4.41Å; W83-R100 HydrophobicContact CZ2-CG 4.12Å; G96-R100 PolarHBondContact O-N 2.72Å; S98-R100 PolarHBondContact O-N 3.05Å; R100-L104 HydrophobicContact CG-CD1 3.72Å; R100-L104 HydrophobicContact CG-CG 4.36Å; R100-L104 WeakPolarHBondContact O-CB 3.36Å; R100-L104 WeakPolarHBondContact O-CG 3.42Å; R100-L104 PolarHBondContact O-N 3.24Å
101	L	96.8	Very high	95.9	Very high	109 Å²	109	60.4 Å²	60.4	57%	0.571	31%	0.305	S	S	*	.	H	α-helix	trans	-65.1	-41.7	-178.2	-171.3	75	0	0	0	111	K97 S98 C99 N105	K97-L101 WeakPolarHBondContact O-CB 3.43Å; K97-L101 PolarHBondContact O-N 3.14Å; K97-L101 VanDerWaalsContact O-N 3.13Å; S98-L101 PolarHBondContact O-N 3.32Å; C99-L101 VanDerWaalsContact C-N 3.35Å; C99-L101 PolarHBondContact O-N 2.83Å; L101-N105 WeakPolarHBondContact CD1-ND2 3.39Å; L101-N105 WeakPolarHBondContact O-CB 3.3Å; L101-N105 PolarHBondContact O-N 3.15Å; L101-N105 PolarHBondContact O-ND2 2.99Å
102	R	97.8	Very high	95.9	Very high	49 Å²	49	61.6 Å²	61.6	19%	0.185	29%	0.293	C	S	.	.	H	α-helix	trans	-65.8	-44.8	178.7	-175.4	59.4	171.8	172.7	-5.6	112	W63 D68 L71 S98 C99 Y106 L107	W63-R102 HydrophobicContact CD2-CB 4.04Å; W63-R102 HydrophobicContact CD2-CG 3.54Å; W63-R102 HydrophobicContact CE3-CB 4.46Å; W63-R102 HydrophobicContact CE3-CG 3.81Å; W63-R102 HydrophobicContact CG-CG 3.91Å; W63-R102 HydrophobicContact CH2-CB 4.14Å; W63-R102 HydrophobicContact CH2-CG 4.32Å; W63-R102 HydrophobicContact CZ2-CB 3.65Å; W63-R102 HydrophobicContact CZ2-CG 4.07Å; W63-R102 HydrophobicContact CZ3-CG 4.19Å; D68-R102 IonicContact OD1-CZ 3.95Å; D68-R102 IonicContact OD1-NE 2.68Å; D68-R102 PolarHBondContact OD1-NE 3.18Å; D68-R102 IonicContact OD1-NH2 3.97Å; D68-R102 PolarHBondContact OD1-NH2 3.13Å; D68-R102 IonicContact OD2-CZ 3.11Å; D68-R102 IonicContact OD2-NE 3.56Å; D68-R102 IonicContact OD2-NH2 3.66Å; D68-R102 PolarHBondContact OD2-NH2 2.95Å; L71-R102 HydrophobicContact CD2-CB 4.18Å; L71-R102 HydrophobicContact CD2-CG 4.21Å; S98-R102 WeakPolarHBondContact O-CB 3.49Å; S98-R102 PolarHBondContact O-N 3.42Å; C99-R102 PolarHBondContact O-N 3.27Å; R102-Y106 VanDerWaalsContact NH1-CG 3.3Å; R102-Y106 WeakPolarHBondContact O-CB 3.45Å; R102-Y106 PolarHBondContact O-N 2.75Å; R102-Y106 VanDerWaalsContact O-N 3.1Å; R102-L107 HydrophobicContact CG-CD1 3.85Å; R102-L107 HydrophobicContact CG-CG 4Å; R102-L107 PolarHBondContact O-N 3.23Å; R102-L107 VanDerWaalsContact O-N 3.13Å
103	W	97.9	Very high	95.8	Very high	22 Å²	22	68.5 Å²	68.5	8%	0.083	32%	0.318	C	S	.	.	I	π-helix	trans	-58.6	-61.7	175.2	-177.5	-110.2	0	0	0	111.3	I72 I75 E80 W83 C99 N105 Y106 L107 R108	I72-W103 HydrophobicContact CG1-CZ3 4.06Å; I75-W103 HydrophobicContact CB-CH2 4.26Å; I75-W103 HydrophobicContact CB-CZ3 4.36Å; I75-W103 HydrophobicContact CD1-CB 4.37Å; I75-W103 HydrophobicContact CD1-CD2 3.48Å; I75-W103 VanDerWaalsContact CD1-CD2 3.48Å; I75-W103 HydrophobicContact CD1-CE3 3.44Å; I75-W103 VanDerWaalsContact CD1-CE3 3.44Å; I75-W103 HydrophobicContact CD1-CG 3.9Å; I75-W103 HydrophobicContact CD1-CH2 4.39Å; I75-W103 HydrophobicContact CD1-CZ2 4.42Å; I75-W103 HydrophobicContact CD1-CZ3 3.93Å; I75-W103 HydrophobicContact CG2-CH2 3.71Å; I75-W103 HydrophobicContact CG2-CZ2 3.57Å; I75-W103 HydrophobicContact CG2-CZ3 4.25Å; E80-W103 PolarHBondContact OE2-NE1 3.39Å; W83-W103 HydrophobicContact CH2-CB 3.91Å; W83-W103 AromaticContact CH2-CD1 3.5Å; W83-W103 AromaticContact CH2-CG 3.81Å; W83-W103 HydrophobicContact CH2-CG 3.81Å; W83-W103 HydrophobicContact CZ3-CB 4.02Å; W83-W103 HydrophobicContact CZ3-CG 4.28Å; C99-W103 WeakPolarHBondContact O-CB 3.26Å; C99-W103 PolarHBondContact O-N 3.29Å; W103-N105 VanDerWaalsContact C-N 3.31Å; W103-N105 PolarHBondContact O-N 2.62Å; W103-Y106 PolarHBondContact O-N 2.88Å; W103-L107 HydrophobicContact CE3-CB 3.71Å; W103-L107 HydrophobicContact CZ3-CB 4.09Å; W103-L107 PolarHBondContact O-N 3.42Å; W103-L107 VanDerWaalsContact O-N 3.13Å; W103-R108 HydrophobicContact CD2-CB 4.36Å; W103-R108 HydrophobicContact CZ2-CB 4.4Å; W103-R108 HydrophobicContact CZ2-CG 4.02Å; W103-R108 WeakPolarHBondContact O-CB 3.38Å; W103-R108 PolarHBondContact O-N 3.43Å
104	L	96.5	Very high	95.7	Very high	60 Å²	60	66.2 Å²	66.2	31%	0.314	32%	0.324	S	S	.	.	I	π-helix	trans	-67.5	-23.2	-170.8	-64.8	177.2	0	0	0	115	R100	R100-L104 HydrophobicContact CG-CD1 3.72Å; R100-L104 HydrophobicContact CG-CG 4.36Å; R100-L104 WeakPolarHBondContact O-CB 3.36Å; R100-L104 WeakPolarHBondContact O-CG 3.42Å; R100-L104 PolarHBondContact O-N 3.24Å
105	N	96.6	Very high	95.6	Very high	20 Å²	20	71.5 Å²	71.5	11%	0.107	35%	0.353	C	S	.	.	I	π-helix	trans	-103.8	-14.9	-178.9	-66.6	-93.7	0	0	0	114	L101 W103 N148	L101-N105 WeakPolarHBondContact CD1-ND2 3.39Å; L101-N105 WeakPolarHBondContact O-CB 3.3Å; L101-N105 PolarHBondContact O-N 3.15Å; L101-N105 PolarHBondContact O-ND2 2.99Å; W103-N105 VanDerWaalsContact C-N 3.31Å; W103-N105 PolarHBondContact O-N 2.62Å; N105-N148 WeakPolarHBondContact OD1-CB 3.31Å
106	Y	96	Very high	95.6	Very high	107 Å²	107	70.7 Å²	70.7	42%	0.42	35%	0.345	S	S	.	.	I	π-helix	trans	-137.5	-66.3	-174.7	-57.3	-83.6	0	0	0	111.3	R102 W103 R108 R113	R102-Y106 VanDerWaalsContact NH1-CG 3.3Å; R102-Y106 WeakPolarHBondContact O-CB 3.45Å; R102-Y106 PolarHBondContact O-N 2.75Å; R102-Y106 VanDerWaalsContact O-N 3.1Å; W103-Y106 PolarHBondContact O-N 2.88Å; Y106-R108 PolarHBondContact O-N 3.08Å; Y106-R113 PolarHBondContact O-NH1 3.33Å; Y106-R113 PolarHBondContact O-NH2 3.24Å
107	L	96.8	Very high	95.5	Very high	25 Å²	25	73.8 Å²	73.8	13%	0.131	36%	0.364	C	S	.	.	I	π-helix	trans	-75.7	-21.7	-162.9	-51.8	-178.5	0	0	0	115.1	D68 L71 I72 R102 W103	D68-L107 HydrophobicContact CB-CD1 3.82Å; D68-L107 HydrophobicContact CB-CD2 3.83Å; D68-L107 HydrophobicContact CB-CG 4.49Å; L71-L107 HydrophobicContact CB-CD1 4.27Å; L71-L107 HydrophobicContact CD2-CD1 3.79Å; L71-L107 HydrophobicContact CG-CD1 4.14Å; I72-L107 HydrophobicContact CD1-CB 4.38Å; I72-L107 HydrophobicContact CD1-CD1 4.32Å; I72-L107 HydrophobicContact CD1-CD2 4.38Å; I72-L107 HydrophobicContact CG1-CB 4.13Å; I72-L107 HydrophobicContact CG1-CD1 4.06Å; R102-L107 HydrophobicContact CG-CD1 3.85Å; R102-L107 HydrophobicContact CG-CG 4Å; R102-L107 PolarHBondContact O-N 3.23Å; R102-L107 VanDerWaalsContact O-N 3.13Å; W103-L107 HydrophobicContact CE3-CB 3.71Å; W103-L107 HydrophobicContact CZ3-CB 4.09Å; W103-L107 PolarHBondContact O-N 3.42Å; W103-L107 VanDerWaalsContact O-N 3.13Å
108	R	95.5	Very high	95.4	Very high	78 Å²	78	66.2 Å²	66.2	29%	0.294	33%	0.334	S	S	.	.	S	Bend	trans	-62.3	132.3	-179.1	-155.9	-177.8	-164.4	-133.3	10	110.4	E80 W103 Y106 D110 V111	E80-R108 IonicContact OE1-CZ 3.17Å; E80-R108 IonicContact OE1-NH2 3.7Å; E80-R108 PolarHBondContact OE1-NH2 3.2Å; E80-R108 IonicContact OE2-NE 3.15Å; E80-R108 PolarHBondContact OE2-NE 3.23Å; E80-R108 IonicContact OE2-NH2 2.61Å; W103-R108 HydrophobicContact CD2-CB 4.36Å; W103-R108 HydrophobicContact CZ2-CB 4.4Å; W103-R108 HydrophobicContact CZ2-CG 4.02Å; W103-R108 WeakPolarHBondContact O-CB 3.38Å; W103-R108 PolarHBondContact O-N 3.43Å; Y106-R108 PolarHBondContact O-N 3.08Å; R108-D110 VanDerWaalsContact CB-OD1 3.29Å; R108-D110 WeakPolarHBondContact CB-OD1 3.25Å; R108-D110 WeakPolarHBondContact CD-OD1 3.38Å; R108-D110 WeakPolarHBondContact CG-OD1 3.44Å; R108-D110 IonicContact CZ-OD2 2.93Å; R108-D110 IonicContact NH1-OD1 3.13Å; R108-D110 IonicContact NH1-OD2 3.69Å; R108-D110 PolarHBondContact NH1-OD2 3.42Å; R108-D110 PolarHBondContact O-N 2.82Å; R108-V111 HydrophobicContact CB-CG2 4.22Å; R108-V111 PolarHBondContact O-N 3.14Å; R108-V111 VanDerWaalsContact O-N 3.15Å
109	P	95.1	Very high	95.3	Very high	123 Å²	123	69.4 Å²	69.4	80%	0.799	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.1	-169	26.9	-36.6	0	0	0	115
110	D	94	Very high	95.2	Very high	77 Å²	77	70.1 Å²	70.1	41%	0.412	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-16.8	174.1	62.2	-20.8	0	0	0	113.3	R108 K112 G144	R108-D110 VanDerWaalsContact CB-OD1 3.29Å; R108-D110 WeakPolarHBondContact CB-OD1 3.25Å; R108-D110 WeakPolarHBondContact CD-OD1 3.38Å; R108-D110 WeakPolarHBondContact CG-OD1 3.44Å; R108-D110 IonicContact CZ-OD2 2.93Å; R108-D110 IonicContact NH1-OD1 3.13Å; R108-D110 IonicContact NH1-OD2 3.69Å; R108-D110 PolarHBondContact NH1-OD2 3.42Å; R108-D110 PolarHBondContact O-N 2.82Å; D110-K112 PolarHBondContact O-N 3.11Å; D110-G144 WeakPolarHBondContact O-CA 3.49Å
111	V	95.3	Very high	95.1	Very high	14 Å²	14	65.2 Å²	65.2	9%	0.085	34%	0.336	C	S	.	.	S	Bend	trans	-77.2	110.9	-179.4	-178.7	0	0	0	0	110.3	R108 R113 T146	R108-V111 HydrophobicContact CB-CG2 4.22Å; R108-V111 PolarHBondContact O-N 3.14Å; R108-V111 VanDerWaalsContact O-N 3.15Å; V111-R113 PolarHBondContact O-NH1 3.04Å; V111-T146 HydrophobicContact CG1-CG2 3.97Å; V111-T146 HydrophobicContact CG2-CG2 3.91Å
112	K	94.7	Very high	95	Very high	86 Å²	86	61.6 Å²	61.6	37%	0.374	32%	0.317	S	S	.	.			trans	-58.1	157.8	176.3	-73.8	169.5	170.9	165.4	0	111.9	D110 E120 P143 G144	D110-K112 PolarHBondContact O-N 3.11Å; K112-E120 IonicContact NZ-OE1 3.49Å; K112-E120 PolarHBondContact NZ-OE1 3.44Å; K112-P143 WeakPolarHBondContact CE-O 3.25Å; K112-P143 PolarHBondContact NZ-O 2.79Å; K112-G144 WeakPolarHBondContact CB-O 3.46Å; K112-G144 PolarHBondContact N-O 3.05Å
113	R	92	Very high	94.9	Very high	164 Å²	164	62.2 Å²	62.2	62%	0.619	32%	0.323	S	S	*	.			trans	-121.8	148.4	173.8	-60.3	-61.9	-165.3	-96.1	-7	109.6	Y106 V111	Y106-R113 PolarHBondContact O-NH1 3.33Å; Y106-R113 PolarHBondContact O-NH2 3.24Å; V111-R113 PolarHBondContact O-NH1 3.04Å
114	G	92.1	Very high	94.8	Very high	57 Å²	57	61.1 Å²	61.1	59%	0.588	32%	0.319	S	S	*	.	S	Bend	trans	97.6	173.9	-177.7	0	0	0	0	0	113.4	R145	G114-R145 PolarHBondContact O-NH1 3.34Å
115	D	92.8	Very high	94.7	Very high	122 Å²	122	58.3 Å²	58.3	65%	0.652	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-64.5	162.7	-176.7	-65.6	-70.2	0	0	0	113.3	R145 R157	D115-R145 PolarHBondContact O-NH2 3.44Å; D115-R157 IonicContact OD1-NH2 3.37Å
116	F	94.3	Very high	94.6	Very high	26 Å²	26	58.6 Å²	58.6	11%	0.114	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-71.4	130.5	177.3	-74.1	-82.3	0	0	0	111.1	E120 Q121 I124 R145 E149 I150 Y153	F116-E120 WeakPolarHBondContact CA-OE2 3.39Å; F116-E120 HydrophobicContact CB-CB 4.34Å; F116-E120 HydrophobicContact CD1-CB 3.94Å; F116-Q121 HydrophobicContact CB-CG 3.71Å; F116-Q121 PolarHBondContact O-NE2 3.12Å; F116-I124 HydrophobicContact CD1-CD1 3.66Å; F116-I124 HydrophobicContact CE1-CD1 3.54Å; F116-I124 HydrophobicContact CG-CD1 4.2Å; F116-I124 HydrophobicContact CZ-CD1 4.02Å; F116-R145 HydrophobicContact CD1-CG 4.35Å; F116-R145 HydrophobicContact CE1-CB 4.19Å; F116-R145 HydrophobicContact CE1-CG 3.81Å; F116-E149 HydrophobicContact CE2-CB 4.16Å; F116-E149 HydrophobicContact CZ-CB 3.66Å; F116-I150 HydrophobicContact CE1-CG1 4.26Å; F116-I150 HydrophobicContact CZ-CG1 4.19Å; F116-Y153 AromaticContact CD2-CD2 3.74Å; F116-Y153 HydrophobicContact CD2-CD2 3.74Å; F116-Y153 HydrophobicContact CD2-CG 4.06Å; F116-Y153 HydrophobicContact CE2-CD2 4.27Å; F116-Y153 HydrophobicContact CE2-CG 4.16Å; F116-Y153 HydrophobicContact CG-CD2 4.39Å
117	T	94.3	Very high	94.6	Very high	69 Å²	69	53.9 Å²	53.9	42%	0.423	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-65.7	161.1	173.9	74	0	0	0	0	111	D119 E120 Q121	T117-D119 PolarHBondContact O-N 3.08Å; T117-E120 PolarHBondContact N-OE2 3.49Å; T117-E120 PolarHBondContact O-N 3.17Å; T117-E120 VanDerWaalsContact O-N 3.11Å; T117-E120 WeakPolarHBondContact OG1-CG 3.49Å; T117-E120 PolarHBondContact OG1-N 2.86Å; T117-Q121 VanDerWaalsContact O-CG 3.31Å; T117-Q121 WeakPolarHBondContact O-CG 3.39Å; T117-Q121 PolarHBondContact O-N 3.24Å
118	A	93.3	Very high	94.5	Very high	18 Å²	18	53.8 Å²	53.8	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-58.2	-37.2	178	0	0	0	0	0	112.4	Q121 L122 R189 A190	A118-Q121 PolarHBondContact O-N 2.77Å; A118-L122 WeakPolarHBondContact O-CG 3.26Å; A118-L122 PolarHBondContact O-N 3.33Å; A118-R189 HydrophobicContact CB-CB 4.1Å; A118-A190 HydrophobicContact CB-CB 3.82Å
119	D	94.4	Very high	94.3	Very high	93 Å²	93	51.1 Å²	51.1	50%	0.497	28%	0.28	S	S	.	.	H	α-helix	trans	-62.6	-47.2	172	-56.9	-72.1	0	0	0	112.8	T117 Q121 L122 L123 A190	T117-D119 PolarHBondContact O-N 3.08Å; D119-Q121 VanDerWaalsContact C-N 3.3Å; D119-Q121 PolarHBondContact O-N 2.76Å; D119-L122 PolarHBondContact O-N 3.25Å; D119-L123 WeakPolarHBondContact O-CB 3.42Å; D119-L123 PolarHBondContact O-N 3.36Å; D119-A190 WeakPolarHBondContact OD1-CB 3.43Å
120	E	96.1	Very high	94.2	Very high	15 Å²	15	50.1 Å²	50.1	7%	0.07	26%	0.26	C	S	.	.	H	α-helix	trans	-62.5	-39.7	177.5	-69.6	175.1	148.8	0	0	110.6	K112 F116 T117 L123 I124 L142 R145	K112-E120 IonicContact NZ-OE1 3.49Å; K112-E120 PolarHBondContact NZ-OE1 3.44Å; F116-E120 WeakPolarHBondContact CA-OE2 3.39Å; F116-E120 HydrophobicContact CB-CB 4.34Å; F116-E120 HydrophobicContact CD1-CB 3.94Å; T117-E120 PolarHBondContact N-OE2 3.49Å; T117-E120 PolarHBondContact O-N 3.17Å; T117-E120 VanDerWaalsContact O-N 3.11Å; T117-E120 WeakPolarHBondContact OG1-CG 3.49Å; T117-E120 PolarHBondContact OG1-N 2.86Å; E120-L123 PolarHBondContact O-N 2.97Å; E120-I124 WeakPolarHBondContact O-CD1 3.38Å; E120-I124 WeakPolarHBondContact O-CG1 3.19Å; E120-I124 PolarHBondContact O-N 3.37Å; E120-L142 HydrophobicContact CB-CD2 3.88Å; E120-L142 HydrophobicContact CG-CD2 3.93Å; E120-R145 IonicContact OE1-CZ 2.66Å; E120-R145 IonicContact OE1-NE 3.4Å; E120-R145 PolarHBondContact OE1-NE 3.15Å; E120-R145 VanDerWaalsContact OE1-NE 3.09Å; E120-R145 IonicContact OE1-NH2 3.51Å; E120-R145 IonicContact OE2-CZ 3.54Å; E120-R145 IonicContact OE2-NE 2.76Å; E120-R145 PolarHBondContact OE2-NE 3.4Å; E120-R145 VanDerWaalsContact OE2-NE 3.11Å; E120-R145 IonicContact OE2-NH2 3.28Å; E120-R145 PolarHBondContact OE2-NH2 3.07Å
121	Q	95.5	Very high	94.2	Very high	36 Å²	36	48.7 Å²	48.7	17%	0.168	25%	0.25	C	C	.	.	H	α-helix	trans	-62.3	-48.9	175.8	-68.8	-179.1	48.6	0	0	111.7	F116 T117 A118 D119 L123 I124 L125 Y153 L186	F116-Q121 HydrophobicContact CB-CG 3.71Å; F116-Q121 PolarHBondContact O-NE2 3.12Å; T117-Q121 VanDerWaalsContact O-CG 3.31Å; T117-Q121 WeakPolarHBondContact O-CG 3.39Å; T117-Q121 PolarHBondContact O-N 3.24Å; A118-Q121 PolarHBondContact O-N 2.77Å; D119-Q121 VanDerWaalsContact C-N 3.3Å; D119-Q121 PolarHBondContact O-N 2.76Å; Q121-L123 VanDerWaalsContact C-N 3.32Å; Q121-L123 PolarHBondContact O-N 2.8Å; Q121-I124 PolarHBondContact O-N 3.15Å; Q121-L125 WeakPolarHBondContact O-CG 3.37Å; Q121-L125 PolarHBondContact O-N 2.99Å; Q121-L125 VanDerWaalsContact O-N 3.08Å; Q121-Y153 HydrophobicContact CG-CE2 3.74Å; Q121-Y153 WeakPolarHBondContact CG-OH 3.26Å; Q121-Y153 PolarHBondContact OE1-OH 2.99Å; Q121-L186 HydrophobicContact CB-CD1 3.92Å; Q121-L186 HydrophobicContact CB-CD2 4.27Å
122	L	94.6	Very high	94.2	Very high	33 Å²	33	49.3 Å²	49.3	17%	0.173	26%	0.258	C	S	.	.	H	α-helix	trans	-55.2	-47.9	175.2	-76.4	166.5	0	0	0	112.1	A118 D119 I124 L125 D126 M183 L186 A187 A190	A118-L122 WeakPolarHBondContact O-CG 3.26Å; A118-L122 PolarHBondContact O-N 3.33Å; D119-L122 PolarHBondContact O-N 3.25Å; L122-I124 VanDerWaalsContact C-N 3.32Å; L122-I124 PolarHBondContact O-N 3.35Å; L122-L125 PolarHBondContact O-N 3.38Å; L122-D126 PolarHBondContact O-N 3.12Å; L122-M183 HydrophobicContact CD2-CB 4.08Å; L122-M183 HydrophobicContact CD2-CG 4.34Å; L122-M183 WeakPolarHBondContact CD2-O 3.27Å; L122-L186 HydrophobicContact CD1-CB 4.31Å; L122-L186 HydrophobicContact CD2-CB 3.63Å; L122-L186 HydrophobicContact CD2-CD1 4.35Å; L122-L186 HydrophobicContact CG-CB 3.73Å; L122-L186 HydrophobicContact CG-CD1 4.48Å; L122-A187 HydrophobicContact CD1-CB 4.11Å; L122-A190 HydrophobicContact CD1-CB 4.33Å
123	L	95.6	Very high	94.3	Very high	61 Å²	61	50.2 Å²	50.2	32%	0.319	27%	0.267	S	S	.	.	H	α-helix	trans	-65.7	-35.5	-178.5	-172.3	60.6	0	0	0	111.6	D119 E120 Q121 L127 H141 L142	D119-L123 WeakPolarHBondContact O-CB 3.42Å; D119-L123 PolarHBondContact O-N 3.36Å; E120-L123 PolarHBondContact O-N 2.97Å; Q121-L123 VanDerWaalsContact C-N 3.32Å; Q121-L123 PolarHBondContact O-N 2.8Å; L123-L127 HydrophobicContact CD1-CD1 3.79Å; L123-L127 HydrophobicContact CD1-CD2 4.41Å; L123-L127 HydrophobicContact CD1-CG 3.85Å; L123-L127 HydrophobicContact CD2-CD1 4.48Å; L123-L127 HydrophobicContact CG-CD1 3.75Å; L123-L127 HydrophobicContact CG-CG 4.21Å; L123-L127 VanDerWaalsContact O-CB 3.25Å; L123-L127 WeakPolarHBondContact O-CB 3.42Å; L123-L127 WeakPolarHBondContact O-CG 3.33Å; L123-L127 PolarHBondContact O-N 3.42Å; L123-H141 HydrophobicContact CD2-CB 4.47Å; L123-H141 WeakPolarHBondContact CD2-O 3.48Å; L123-L142 HydrophobicContact CB-CD2 4.28Å; L123-L142 HydrophobicContact CD2-CD2 3.83Å; L123-L142 HydrophobicContact CD2-CG 4.11Å; L123-L142 HydrophobicContact CG-CD2 4.31Å
124	I	96.3	Very high	94.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-45.6	171.7	-70	164.4	0	0	0	111.3	F116 E120 Q121 L122 H128 L142 I150 Y153	F116-I124 HydrophobicContact CD1-CD1 3.66Å; F116-I124 HydrophobicContact CE1-CD1 3.54Å; F116-I124 HydrophobicContact CG-CD1 4.2Å; F116-I124 HydrophobicContact CZ-CD1 4.02Å; E120-I124 WeakPolarHBondContact O-CD1 3.38Å; E120-I124 WeakPolarHBondContact O-CG1 3.19Å; E120-I124 PolarHBondContact O-N 3.37Å; Q121-I124 PolarHBondContact O-N 3.15Å; L122-I124 VanDerWaalsContact C-N 3.32Å; L122-I124 PolarHBondContact O-N 3.35Å; I124-H128 WeakPolarHBondContact O-CB 3.43Å; I124-H128 PolarHBondContact O-N 2.93Å; I124-L142 HydrophobicContact CD1-CD1 4.25Å; I124-L142 HydrophobicContact CG1-CD1 3.51Å; I124-I150 HydrophobicContact CD1-CG1 4.19Å; I124-I150 HydrophobicContact CD1-CG2 4.31Å; I124-I150 HydrophobicContact CG1-CG1 4.35Å; I124-I150 HydrophobicContact CG1-CG2 4.04Å; I124-I150 HydrophobicContact CG2-CG2 3.94Å; I124-Y153 HydrophobicContact CB-CE1 4.5Å; I124-Y153 HydrophobicContact CD1-CD1 4.1Å; I124-Y153 HydrophobicContact CD1-CE1 4.46Å; I124-Y153 HydrophobicContact CD1-CG 4.47Å; I124-Y153 HydrophobicContact CG2-CD1 3.9Å; I124-Y153 HydrophobicContact CG2-CE1 4.03Å
125	L	94.3	Very high	94.9	Very high	1 Å²	1	48 Å²	48	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-45.6	-178.4	-60.3	-174.3	0	0	0	111.6	Q121 L122 S129 Y153 W154 V158 M178 W182 M183 L186	Q121-L125 WeakPolarHBondContact O-CG 3.37Å; Q121-L125 PolarHBondContact O-N 2.99Å; Q121-L125 VanDerWaalsContact O-N 3.08Å; L122-L125 PolarHBondContact O-N 3.38Å; L125-S129 PolarHBondContact O-N 2.92Å; L125-Y153 HydrophobicContact CD2-CE1 4.37Å; L125-W154 HydrophobicContact CD2-CZ3 4.03Å; L125-V158 HydrophobicContact CD2-CG2 3.72Å; L125-M178 HydrophobicContact CB-CE 3.97Å; L125-M178 HydrophobicContact CD1-CE 4.02Å; L125-M178 HydrophobicContact CD2-CE 3.73Å; L125-M178 HydrophobicContact CG-CE 4.08Å; L125-W182 HydrophobicContact CD1-CD2 4.29Å; L125-M183 HydrophobicContact CB-CG 4.5Å; L125-M183 HydrophobicContact CB-SD 4.35Å; L125-M183 HydrophobicContact CD1-CG 3.94Å; L125-L186 HydrophobicContact CD1-CD1 3.96Å
126	D	93.7	Very high	95.1	Very high	26 Å²	26	46 Å²	46	14%	0.139	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-50.1	176.2	172.2	61.3	0	0	0	112	L122 H128 S129 R130 M183	L122-D126 PolarHBondContact O-N 3.12Å; D126-H128 VanDerWaalsContact C-N 3.34Å; D126-H128 PolarHBondContact O-N 3.17Å; D126-S129 WeakPolarHBondContact O-CB 3.18Å; D126-S129 PolarHBondContact O-N 3.23Å; D126-S129 VanDerWaalsContact O-N 3.15Å; D126-S129 PolarHBondContact O-OG 2.92Å; D126-R130 VanDerWaalsContact CG-NE 3.34Å; D126-R130 WeakPolarHBondContact O-CG 3.25Å; D126-R130 PolarHBondContact O-N 3.02Å; D126-R130 IonicContact OD1-CZ 2.99Å; D126-R130 VanDerWaalsContact OD1-CZ 3.22Å; D126-R130 IonicContact OD1-NE 3.5Å; D126-R130 PolarHBondContact OD1-NE 2.92Å; D126-R130 IonicContact OD1-NH2 3.61Å; D126-R130 PolarHBondContact OD1-NH2 3.3Å; D126-R130 IonicContact OD2-CZ 2.71Å; D126-R130 IonicContact OD2-NE 3.69Å; D126-R130 PolarHBondContact OD2-NE 3.03Å; D126-R130 VanDerWaalsContact OD2-NE 3.13Å; D126-R130 IonicContact OD2-NH2 3.35Å; D126-R130 PolarHBondContact OD2-NH2 2.94Å; D126-M183 HydrophobicContact CB-CE 4.42Å
127	L	96.1	Very high	95.2	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-68.5	-32.7	-179.3	-65.8	177.7	0	0	0	112.8	L123 R130 W131 I138 H141	L123-L127 HydrophobicContact CD1-CD1 3.79Å; L123-L127 HydrophobicContact CD1-CD2 4.41Å; L123-L127 HydrophobicContact CD1-CG 3.85Å; L123-L127 HydrophobicContact CD2-CD1 4.48Å; L123-L127 HydrophobicContact CG-CD1 3.75Å; L123-L127 HydrophobicContact CG-CG 4.21Å; L123-L127 VanDerWaalsContact O-CB 3.25Å; L123-L127 WeakPolarHBondContact O-CB 3.42Å; L123-L127 WeakPolarHBondContact O-CG 3.33Å; L123-L127 PolarHBondContact O-N 3.42Å; L127-R130 PolarHBondContact O-N 3.09Å; L127-W131 HydrophobicContact CB-CE3 4.42Å; L127-W131 HydrophobicContact CB-CZ3 4.43Å; L127-W131 HydrophobicContact CD1-CZ3 4.38Å; L127-W131 HydrophobicContact CD2-CE3 4.46Å; L127-W131 HydrophobicContact CD2-CH2 3.85Å; L127-W131 HydrophobicContact CD2-CZ2 4.44Å; L127-W131 HydrophobicContact CD2-CZ3 3.87Å; L127-W131 HydrophobicContact CG-CZ3 4.47Å; L127-W131 PolarHBondContact O-N 3.09Å; L127-I138 HydrophobicContact CB-CG1 4.11Å; L127-I138 HydrophobicContact CB-CG2 3.96Å; L127-I138 HydrophobicContact CD1-CG2 4.05Å; L127-H141 HydrophobicContact CD1-CB 3.49Å; L127-H141 VanDerWaalsContact CD1-CB 3.49Å
128	H	95.4	Very high	95.4	Very high	22 Å²	22	46.3 Å²	46.3	10%	0.102	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-40.3	171.2	-172.8	-79.6	0	0	0	111.3	I124 D126 R130 W131 G132 N133 W135 I138 W154	I124-H128 WeakPolarHBondContact O-CB 3.43Å; I124-H128 PolarHBondContact O-N 2.93Å; D126-H128 VanDerWaalsContact C-N 3.34Å; D126-H128 PolarHBondContact O-N 3.17Å; H128-R130 PolarHBondContact O-N 3.08Å; H128-W131 PolarHBondContact O-N 3.44Å; H128-G132 PolarHBondContact CD2-O 3.31Å; H128-G132 VanDerWaalsContact CD2-O 3.29Å; H128-G132 VanDerWaalsContact O-CA 3.26Å; H128-G132 WeakPolarHBondContact O-CA 3.49Å; H128-G132 PolarHBondContact O-N 2.92Å; H128-N133 PolarHBondContact NE2-OD1 2.93Å; H128-W135 AromaticContact CD2-CH2 3.49Å; H128-W135 VanDerWaalsContact CD2-CH2 3.49Å; H128-W135 WeakPolarHBondContact CD2-CH2 3.28Å; H128-W135 AromaticContact CD2-CZ3 3.63Å; H128-W135 AromaticContact NE2-CH2 3.69Å; H128-I138 HydrophobicContact CB-CD1 4.2Å; H128-W154 HydrophobicContact CB-CE3 4.27Å; H128-W154 HydrophobicContact CB-CH2 4.26Å; H128-W154 HydrophobicContact CB-CZ3 3.79Å; H128-W154 AromaticContact CD2-CE3 3.93Å; H128-W154 AromaticContact CD2-CZ3 3.96Å; H128-W154 AromaticContact CE1-CE2 3.72Å; H128-W154 AromaticContact CE1-CH2 3.37Å; H128-W154 WeakPolarHBondContact CE1-CH2 3.47Å; H128-W154 AromaticContact CE1-CZ2 3.17Å; H128-W154 WeakPolarHBondContact CE1-CZ2 3.11Å; H128-W154 AromaticContact CG-CE3 3.88Å; H128-W154 AromaticContact CG-CH2 3.54Å; H128-W154 AromaticContact CG-CZ3 3.45Å; H128-W154 VanDerWaalsContact CG-CZ3 3.45Å; H128-W154 AromaticContact ND1-CH2 3.1Å; H128-W154 WeakPolarHBondContact ND1-CH2 3.5Å; H128-W154 AromaticContact ND1-CZ2 3.46Å; H128-W154 WeakPolarHBondContact ND1-CZ2 3.4Å; H128-W154 AromaticContact ND1-CZ3 3.56Å; H128-W154 AromaticContact NE2-CE2 3.63Å; H128-W154 AromaticContact NE2-CH2 3.94Å; H128-W154 AromaticContact NE2-CZ2 3.58Å
129	S	91.6	Very high	95.6	Very high	22 Å²	22	46.4 Å²	46.4	15%	0.154	23%	0.233	C	C	.	.	H	α-helix	trans	-58	-36.8	176.3	81.3	0	0	0	0	113.2	L125 D126 W303	L125-S129 PolarHBondContact O-N 2.92Å; D126-S129 WeakPolarHBondContact O-CB 3.18Å; D126-S129 PolarHBondContact O-N 3.23Å; D126-S129 VanDerWaalsContact O-N 3.15Å; D126-S129 PolarHBondContact O-OG 2.92Å; S129-W303 VanDerWaalsContact OG-CG 3.27Å
130	R	92.2	Very high	95.7	Very high	102 Å²	102	45.9 Å²	45.9	39%	0.385	24%	0.242	S	C	.	.	H	α-helix	trans	-80.3	-35.4	-179.9	-61.1	172.4	-164.5	-149.3	4.6	112.8	D126 L127 H128 F300	D126-R130 VanDerWaalsContact CG-NE 3.34Å; D126-R130 WeakPolarHBondContact O-CG 3.25Å; D126-R130 PolarHBondContact O-N 3.02Å; D126-R130 IonicContact OD1-CZ 2.99Å; D126-R130 VanDerWaalsContact OD1-CZ 3.22Å; D126-R130 IonicContact OD1-NE 3.5Å; D126-R130 PolarHBondContact OD1-NE 2.92Å; D126-R130 IonicContact OD1-NH2 3.61Å; D126-R130 PolarHBondContact OD1-NH2 3.3Å; D126-R130 IonicContact OD2-CZ 2.71Å; D126-R130 IonicContact OD2-NE 3.69Å; D126-R130 PolarHBondContact OD2-NE 3.03Å; D126-R130 VanDerWaalsContact OD2-NE 3.13Å; D126-R130 IonicContact OD2-NH2 3.35Å; D126-R130 PolarHBondContact OD2-NH2 2.94Å; L127-R130 PolarHBondContact O-N 3.09Å; H128-R130 PolarHBondContact O-N 3.08Å; R130-F300 HydrophobicContact CG-CE2 4.32Å
131	W	94.4	Very high	95.8	Very high	48 Å²	48	49.7 Å²	49.7	18%	0.182	26%	0.259	C	S	.	.	H	α-helix	trans	-123.4	-4.6	-168.4	-61.7	-22.7	0	0	0	116.7	L127 H128 R134 K137 I138 H141	L127-W131 HydrophobicContact CB-CE3 4.42Å; L127-W131 HydrophobicContact CB-CZ3 4.43Å; L127-W131 HydrophobicContact CD1-CZ3 4.38Å; L127-W131 HydrophobicContact CD2-CE3 4.46Å; L127-W131 HydrophobicContact CD2-CH2 3.85Å; L127-W131 HydrophobicContact CD2-CZ2 4.44Å; L127-W131 HydrophobicContact CD2-CZ3 3.87Å; L127-W131 HydrophobicContact CG-CZ3 4.47Å; L127-W131 PolarHBondContact O-N 3.09Å; H128-W131 PolarHBondContact O-N 3.44Å; W131-R134 HydrophobicContact CB-CB 4.3Å; W131-R134 WeakPolarHBondContact O-CG 3.36Å; W131-R134 VanDerWaalsContact O-CZ 3.22Å; W131-R134 PolarHBondContact O-NE 3.17Å; W131-R134 VanDerWaalsContact O-NE 3.13Å; W131-K137 HydrophobicContact CD2-CD 3.69Å; W131-K137 HydrophobicContact CD2-CG 4.23Å; W131-K137 HydrophobicContact CE3-CB 4.18Å; W131-K137 HydrophobicContact CE3-CD 3.72Å; W131-K137 HydrophobicContact CE3-CG 3.72Å; W131-K137 HydrophobicContact CG-CD 4.2Å; W131-K137 HydrophobicContact CH2-CD 4.43Å; W131-K137 HydrophobicContact CH2-CG 4.36Å; W131-K137 HydrophobicContact CZ2-CD 4.39Å; W131-K137 HydrophobicContact CZ3-CB 4.5Å; W131-K137 HydrophobicContact CZ3-CD 4.1Å; W131-K137 HydrophobicContact CZ3-CG 3.79Å; W131-I138 HydrophobicContact CE3-CG1 4.04Å; W131-H141 AromaticContact CH2-CD2 3.65Å; W131-H141 AromaticContact CH2-NE2 3.36Å; W131-H141 WeakPolarHBondContact CH2-NE2 3.36Å; W131-H141 AromaticContact CZ3-CD2 3.69Å; W131-H141 AromaticContact CZ3-NE2 3.88Å
132	G	95	Very high	95.8	Very high	26 Å²	26	48.2 Å²	48.2	27%	0.268	25%	0.252	S	S	.	.	S	Bend	trans	55.4	-142.4	-173.2	0	0	0	0	0	112.2	H128 R134 I138	H128-G132 PolarHBondContact CD2-O 3.31Å; H128-G132 VanDerWaalsContact CD2-O 3.29Å; H128-G132 VanDerWaalsContact O-CA 3.26Å; H128-G132 WeakPolarHBondContact O-CA 3.49Å; H128-G132 PolarHBondContact O-N 2.92Å; G132-R134 PolarHBondContact O-N 3.23Å; G132-I138 WeakPolarHBondContact O-CD1 3.35Å
133	N	96.6	Very high	95.8	Very high	106 Å²	106	51.6 Å²	51.6	57%	0.567	28%	0.276	S	S	*	.	S	Bend	trans	-74.4	28.4	-172.5	-59.1	-24.4	0	0	0	114.9	H128 W135	H128-N133 PolarHBondContact NE2-OD1 2.93Å; N133-W135 HydrophobicContact CB-CZ2 3.71Å; N133-W135 VanDerWaalsContact O-CD1 3.25Å; N133-W135 PolarHBondContact O-N 2.94Å; N133-W135 PolarHBondContact O-NE1 3.03Å; N133-W135 VanDerWaalsContact OD1-CZ2 3.26Å; N133-W135 WeakPolarHBondContact OD1-CZ2 3.42Å
134	R	97.5	Very high	95.8	Very high	132 Å²	132	49.7 Å²	49.7	50%	0.498	27%	0.272	S	S	.	.			trans	-83.2	60.4	177.1	-68.4	-168.8	-75	-106.7	7.8	111.1	W131 G132 S136 K137 I138	W131-R134 HydrophobicContact CB-CB 4.3Å; W131-R134 WeakPolarHBondContact O-CG 3.36Å; W131-R134 VanDerWaalsContact O-CZ 3.22Å; W131-R134 PolarHBondContact O-NE 3.17Å; W131-R134 VanDerWaalsContact O-NE 3.13Å; G132-R134 PolarHBondContact O-N 3.23Å; R134-S136 PolarHBondContact O-N 3.13Å; R134-K137 HydrophobicContact CB-CB 4.13Å; R134-K137 WeakPolarHBondContact O-CA 3.45Å; R134-K137 WeakPolarHBondContact O-CB 3.3Å; R134-K137 PolarHBondContact O-N 2.67Å; R134-I138 PolarHBondContact O-N 2.62Å; R134-I138 VanDerWaalsContact O-N 3.09Å
135	W	98.1	Very high	95.9	Very high	42 Å²	42	50.6 Å²	50.6	16%	0.159	28%	0.275	C	S	.	.	H	α-helix	trans	-51.4	-47	-168.3	-51.9	116.2	0	0	0	114.5	H128 N133 K137 I138 A139 D147 I150 K151 W154	H128-W135 AromaticContact CD2-CH2 3.49Å; H128-W135 VanDerWaalsContact CD2-CH2 3.49Å; H128-W135 WeakPolarHBondContact CD2-CH2 3.28Å; H128-W135 AromaticContact CD2-CZ3 3.63Å; H128-W135 AromaticContact NE2-CH2 3.69Å; N133-W135 HydrophobicContact CB-CZ2 3.71Å; N133-W135 VanDerWaalsContact O-CD1 3.25Å; N133-W135 PolarHBondContact O-N 2.94Å; N133-W135 PolarHBondContact O-NE1 3.03Å; N133-W135 VanDerWaalsContact OD1-CZ2 3.26Å; N133-W135 WeakPolarHBondContact OD1-CZ2 3.42Å; W135-K137 PolarHBondContact O-N 3.11Å; W135-I138 HydrophobicContact CE3-CD1 4.14Å; W135-I138 HydrophobicContact CZ3-CD1 4.3Å; W135-I138 PolarHBondContact O-N 2.83Å; W135-I138 VanDerWaalsContact O-N 3.09Å; W135-A139 WeakPolarHBondContact O-CB 3.46Å; W135-A139 PolarHBondContact O-N 3.01Å; W135-D147 HydrophobicContact CB-CB 3.87Å; W135-I150 HydrophobicContact CE3-CG2 3.89Å; W135-I150 HydrophobicContact CZ3-CG2 4.18Å; W135-K151 HydrophobicContact CD2-CB 3.86Å; W135-K151 HydrophobicContact CD2-CG 4.36Å; W135-K151 HydrophobicContact CE3-CB 4.34Å; W135-K151 HydrophobicContact CG-CB 3.96Å; W135-K151 HydrophobicContact CG-CG 4.41Å; W135-W154 HydrophobicContact CH2-CB 3.7Å; W135-W154 AromaticContact CH2-CD1 3.71Å; W135-W154 HydrophobicContact CH2-CD2 4.02Å; W135-W154 AromaticContact CH2-CG 3.51Å; W135-W154 HydrophobicContact CH2-CG 3.51Å; W135-W154 HydrophobicContact CZ2-CG 4.4Å; W135-W154 HydrophobicContact CZ3-CB 4.01Å; W135-W154 HydrophobicContact CZ3-CG 4.17Å
136	S	97.2	Very high	96	Very high	81 Å²	81	51.2 Å²	51.2	57%	0.566	28%	0.279	S	S	*	.	H	α-helix	trans	-67.9	-24.2	-179.5	-32.3	0	0	0	0	112.7	R134 D147	R134-S136 PolarHBondContact O-N 3.13Å; S136-D147 PolarHBondContact OG-OD2 3.04Å
137	K	97.7	Very high	96.2	Very high	101 Å²	101	52.6 Å²	52.6	44%	0.439	29%	0.287	S	S	.	.	H	α-helix	trans	-75.8	-37.9	170.5	-165.4	-175.6	177.3	-174.7	0	111.6	W131 R134 W135 H141	W131-K137 HydrophobicContact CD2-CD 3.69Å; W131-K137 HydrophobicContact CD2-CG 4.23Å; W131-K137 HydrophobicContact CE3-CB 4.18Å; W131-K137 HydrophobicContact CE3-CD 3.72Å; W131-K137 HydrophobicContact CE3-CG 3.72Å; W131-K137 HydrophobicContact CG-CD 4.2Å; W131-K137 HydrophobicContact CH2-CD 4.43Å; W131-K137 HydrophobicContact CH2-CG 4.36Å; W131-K137 HydrophobicContact CZ2-CD 4.39Å; W131-K137 HydrophobicContact CZ3-CB 4.5Å; W131-K137 HydrophobicContact CZ3-CD 4.1Å; W131-K137 HydrophobicContact CZ3-CG 3.79Å; R134-K137 HydrophobicContact CB-CB 4.13Å; R134-K137 WeakPolarHBondContact O-CA 3.45Å; R134-K137 WeakPolarHBondContact O-CB 3.3Å; R134-K137 PolarHBondContact O-N 2.67Å; W135-K137 PolarHBondContact O-N 3.11Å; K137-H141 PolarHBondContact O-CD2 3.32Å
138	I	98	Very high	96.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.9	-42.9	174.6	-60.4	173.8	0	0	0	110.3	L127 H128 W131 G132 R134 W135 A140 H141 L142 I150	L127-I138 HydrophobicContact CB-CG1 4.11Å; L127-I138 HydrophobicContact CB-CG2 3.96Å; L127-I138 HydrophobicContact CD1-CG2 4.05Å; H128-I138 HydrophobicContact CB-CD1 4.2Å; W131-I138 HydrophobicContact CE3-CG1 4.04Å; G132-I138 WeakPolarHBondContact O-CD1 3.35Å; R134-I138 PolarHBondContact O-N 2.62Å; R134-I138 VanDerWaalsContact O-N 3.09Å; W135-I138 HydrophobicContact CE3-CD1 4.14Å; W135-I138 HydrophobicContact CZ3-CD1 4.3Å; W135-I138 PolarHBondContact O-N 2.83Å; W135-I138 VanDerWaalsContact O-N 3.09Å; I138-A140 PolarHBondContact O-N 3.45Å; I138-H141 PolarHBondContact O-N 3.37Å; I138-L142 HydrophobicContact CG2-CD1 3.98Å; I138-I150 HydrophobicContact CG2-CD1 4.3Å; I138-I150 HydrophobicContact CG2-CG2 4.05Å
139	A	97.3	Very high	96.3	Very high	19 Å²	19	55.5 Å²	55.5	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-58.2	-32.3	178.8	0	0	0	0	0	113.6	W135 H141 L142 D147 I150	W135-A139 WeakPolarHBondContact O-CB 3.46Å; W135-A139 PolarHBondContact O-N 3.01Å; A139-H141 PolarHBondContact O-N 2.86Å; A139-L142 PolarHBondContact O-N 2.86Å; A139-D147 HydrophobicContact CB-CB 4.02Å; A139-I150 HydrophobicContact CB-CD1 3.76Å
140	A	96.9	Very high	96.6	Very high	83 Å²	83	54.5 Å²	54.5	69%	0.686	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.8	176.3	0	0	0	0	0	114.2	I138	I138-A140 PolarHBondContact O-N 3.45Å
141	H	96.8	Very high	96.8	Very high	95 Å²	95	52.6 Å²	52.6	44%	0.44	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-3.6	178	-68.3	-94.4	0	0	0	113.8	L123 L127 W131 K137 I138 A139 P143	L123-H141 HydrophobicContact CD2-CB 4.47Å; L123-H141 WeakPolarHBondContact CD2-O 3.48Å; L127-H141 HydrophobicContact CD1-CB 3.49Å; L127-H141 VanDerWaalsContact CD1-CB 3.49Å; W131-H141 AromaticContact CH2-CD2 3.65Å; W131-H141 AromaticContact CH2-NE2 3.36Å; W131-H141 WeakPolarHBondContact CH2-NE2 3.36Å; W131-H141 AromaticContact CZ3-CD2 3.69Å; W131-H141 AromaticContact CZ3-NE2 3.88Å; K137-H141 PolarHBondContact O-CD2 3.32Å; I138-H141 PolarHBondContact O-N 3.37Å; A139-H141 PolarHBondContact O-N 2.86Å; H141-P143 WeakPolarHBondContact O-CD 3.1Å
142	L	96.5	Very high	96.9	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.021	30%	0.299	C	S	.	.	S	Bend	trans	-117.9	86.4	-176.5	-73.9	154	0	0	0	109.3	E120 L123 I124 I138 A139 G144 R145 I150	E120-L142 HydrophobicContact CB-CD2 3.88Å; E120-L142 HydrophobicContact CG-CD2 3.93Å; L123-L142 HydrophobicContact CB-CD2 4.28Å; L123-L142 HydrophobicContact CD2-CD2 3.83Å; L123-L142 HydrophobicContact CD2-CG 4.11Å; L123-L142 HydrophobicContact CG-CD2 4.31Å; I124-L142 HydrophobicContact CD1-CD1 4.25Å; I124-L142 HydrophobicContact CG1-CD1 3.51Å; I138-L142 HydrophobicContact CG2-CD1 3.98Å; A139-L142 PolarHBondContact O-N 2.86Å; L142-G144 PolarHBondContact O-N 2.86Å; L142-R145 HydrophobicContact CB-CB 3.87Å; L142-R145 HydrophobicContact CB-CG 4.21Å; L142-R145 PolarHBondContact O-N 2.94Å; L142-I150 HydrophobicContact CB-CD1 4.48Å; L142-I150 HydrophobicContact CD1-CD1 3.54Å; L142-I150 HydrophobicContact CD1-CG1 3.97Å
143	P	95.2	Very high	97	Very high	104 Å²	104	53 Å²	53	68%	0.675	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	124.6	-172.6	23.6	-33.4	0	0	0	111.2	K112 H141	K112-P143 WeakPolarHBondContact CE-O 3.25Å; K112-P143 PolarHBondContact NZ-O 2.79Å; H141-P143 WeakPolarHBondContact O-CD 3.1Å
144	G	95.4	Very high	97	Very high	22 Å²	22	48.7 Å²	48.7	23%	0.227	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	78	10.5	-177	0	0	0	0	0	115.6	D110 K112 L142	D110-G144 WeakPolarHBondContact O-CA 3.49Å; K112-G144 WeakPolarHBondContact CB-O 3.46Å; K112-G144 PolarHBondContact N-O 3.05Å; L142-G144 PolarHBondContact O-N 2.86Å
145	R	97.3	Very high	96.8	Very high	18 Å²	18	48 Å²	48	7%	0.068	26%	0.261	C	S	.	.			trans	-110.8	141.2	170.9	-59.9	-61.7	-171.3	167.8	3.7	111.1	G114 D115 F116 E120 L142 E149	G114-R145 PolarHBondContact O-NH1 3.34Å; D115-R145 PolarHBondContact O-NH2 3.44Å; F116-R145 HydrophobicContact CD1-CG 4.35Å; F116-R145 HydrophobicContact CE1-CB 4.19Å; F116-R145 HydrophobicContact CE1-CG 3.81Å; E120-R145 IonicContact OE1-CZ 2.66Å; E120-R145 IonicContact OE1-NE 3.4Å; E120-R145 PolarHBondContact OE1-NE 3.15Å; E120-R145 VanDerWaalsContact OE1-NE 3.09Å; E120-R145 IonicContact OE1-NH2 3.51Å; E120-R145 IonicContact OE2-CZ 3.54Å; E120-R145 IonicContact OE2-NE 2.76Å; E120-R145 PolarHBondContact OE2-NE 3.4Å; E120-R145 VanDerWaalsContact OE2-NE 3.11Å; E120-R145 IonicContact OE2-NH2 3.28Å; E120-R145 PolarHBondContact OE2-NH2 3.07Å; L142-R145 HydrophobicContact CB-CB 3.87Å; L142-R145 HydrophobicContact CB-CG 4.21Å; L142-R145 PolarHBondContact O-N 2.94Å; R145-E149 IonicContact NH1-OE1 2.74Å; R145-E149 PolarHBondContact NH1-OE1 3.16Å; R145-E149 VanDerWaalsContact NH1-OE1 3.11Å
146	T	97.3	Very high	96.5	Very high	15 Å²	15	49 Å²	49	9%	0.092	27%	0.272	C	S	.	.			trans	-95.5	154.1	-177	63.8	0	0	0	0	111.9	V111 N148 E149 I150	V111-T146 HydrophobicContact CG1-CG2 3.97Å; V111-T146 HydrophobicContact CG2-CG2 3.91Å; T146-N148 PolarHBondContact O-N 3.11Å; T146-E149 WeakPolarHBondContact CB-OE2 3.44Å; T146-E149 WeakPolarHBondContact CG2-OE2 3.46Å; T146-E149 PolarHBondContact N-OE2 3.06Å; T146-E149 PolarHBondContact O-N 2.81Å; T146-E149 VanDerWaalsContact O-N 3.17Å; T146-E149 VanDerWaalsContact OG1-CG 3.27Å; T146-E149 WeakPolarHBondContact OG1-CG 3.35Å; T146-E149 PolarHBondContact OG1-N 2.95Å; T146-E149 PolarHBondContact OG1-OE2 3.32Å; T146-I150 WeakPolarHBondContact O-CD1 3.49Å; T146-I150 WeakPolarHBondContact O-CG1 3.4Å; T146-I150 PolarHBondContact O-N 3.22Å; T146-I150 VanDerWaalsContact O-N 3.11Å
147	D	97.4	Very high	96.2	Very high	54 Å²	54	48.3 Å²	48.3	29%	0.289	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-27.9	175.8	73	-21.3	0	0	0	112.2	W135 S136 A139 K151	W135-D147 HydrophobicContact CB-CB 3.87Å; S136-D147 PolarHBondContact OG-OD2 3.04Å; A139-D147 HydrophobicContact CB-CB 4.02Å; D147-K151 WeakPolarHBondContact O-CB 3.21Å; D147-K151 PolarHBondContact O-N 3.47Å
148	N	97.1	Very high	95.9	Very high	52 Å²	52	43.5 Å²	43.5	28%	0.278	24%	0.236	S	C	.	.	H	α-helix	trans	-70	-42.8	173.7	-169.8	61.4	0	0	0	113.3	N105 T146 K151 N152	N105-N148 WeakPolarHBondContact OD1-CB 3.31Å; T146-N148 PolarHBondContact O-N 3.11Å; N148-K151 VanDerWaalsContact OD1-CE 3.25Å; N148-K151 WeakPolarHBondContact OD1-CE 3.35Å; N148-K151 PolarHBondContact OD1-NZ 3.07Å; N148-N152 VanDerWaalsContact O-CB 3.28Å; N148-N152 WeakPolarHBondContact O-CB 3.38Å; N148-N152 PolarHBondContact O-N 3.39Å
149	E	97.1	Very high	95.5	Very high	40 Å²	40	46.9 Å²	46.9	19%	0.187	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-46.5	173.9	-72.8	164.3	92.4	0	0	111.2	F116 R145 T146 N152 Y153	F116-E149 HydrophobicContact CE2-CB 4.16Å; F116-E149 HydrophobicContact CZ-CB 3.66Å; R145-E149 IonicContact NH1-OE1 2.74Å; R145-E149 PolarHBondContact NH1-OE1 3.16Å; R145-E149 VanDerWaalsContact NH1-OE1 3.11Å; T146-E149 WeakPolarHBondContact CB-OE2 3.44Å; T146-E149 WeakPolarHBondContact CG2-OE2 3.46Å; T146-E149 PolarHBondContact N-OE2 3.06Å; T146-E149 PolarHBondContact O-N 2.81Å; T146-E149 VanDerWaalsContact O-N 3.17Å; T146-E149 VanDerWaalsContact OG1-CG 3.27Å; T146-E149 WeakPolarHBondContact OG1-CG 3.35Å; T146-E149 PolarHBondContact OG1-N 2.95Å; T146-E149 PolarHBondContact OG1-OE2 3.32Å; E149-N152 CarbonylContact O-C 3.45Å; E149-N152 WeakPolarHBondContact O-CA 3.42Å; E149-N152 WeakPolarHBondContact O-CB 3.38Å; E149-N152 PolarHBondContact O-N 3.23Å; E149-Y153 PolarHBondContact O-N 3.32Å
150	I	97.6	Very high	95	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-46.9	-178.4	-63.2	157.9	0	0	0	110.7	F116 I124 W135 I138 A139 L142 T146 N152 Y153 W154	F116-I150 HydrophobicContact CE1-CG1 4.26Å; F116-I150 HydrophobicContact CZ-CG1 4.19Å; I124-I150 HydrophobicContact CD1-CG1 4.19Å; I124-I150 HydrophobicContact CD1-CG2 4.31Å; I124-I150 HydrophobicContact CG1-CG1 4.35Å; I124-I150 HydrophobicContact CG1-CG2 4.04Å; I124-I150 HydrophobicContact CG2-CG2 3.94Å; W135-I150 HydrophobicContact CE3-CG2 3.89Å; W135-I150 HydrophobicContact CZ3-CG2 4.18Å; I138-I150 HydrophobicContact CG2-CD1 4.3Å; I138-I150 HydrophobicContact CG2-CG2 4.05Å; A139-I150 HydrophobicContact CB-CD1 3.76Å; L142-I150 HydrophobicContact CB-CD1 4.48Å; L142-I150 HydrophobicContact CD1-CD1 3.54Å; L142-I150 HydrophobicContact CD1-CG1 3.97Å; T146-I150 WeakPolarHBondContact O-CD1 3.49Å; T146-I150 WeakPolarHBondContact O-CG1 3.4Å; T146-I150 PolarHBondContact O-N 3.22Å; T146-I150 VanDerWaalsContact O-N 3.11Å; I150-N152 PolarHBondContact O-N 2.82Å; I150-Y153 PolarHBondContact O-N 3.43Å; I150-W154 PolarHBondContact O-N 2.87Å
151	K	97.1	Very high	94.4	Very high	62 Å²	62	49.3 Å²	49.3	27%	0.27	24%	0.244	S	C	.	.	H	α-helix	trans	-58.7	-35.3	172.3	176.6	-172.5	71.2	-146.1	0	112.1	W135 D147 N148 R155	W135-K151 HydrophobicContact CD2-CB 3.86Å; W135-K151 HydrophobicContact CD2-CG 4.36Å; W135-K151 HydrophobicContact CE3-CB 4.34Å; W135-K151 HydrophobicContact CG-CB 3.96Å; W135-K151 HydrophobicContact CG-CG 4.41Å; D147-K151 WeakPolarHBondContact O-CB 3.21Å; D147-K151 PolarHBondContact O-N 3.47Å; N148-K151 VanDerWaalsContact OD1-CE 3.25Å; N148-K151 WeakPolarHBondContact OD1-CE 3.35Å; N148-K151 PolarHBondContact OD1-NZ 3.07Å; K151-R155 PolarHBondContact O-N 3.43Å
152	N	96.5	Very high	94	Very high	72 Å²	72	44.9 Å²	44.9	39%	0.385	22%	0.223	S	C	.	.	H	α-helix	trans	-70.9	-48.6	176.7	-167	57.4	0	0	0	111.6	N148 E149 I150 W154 R155 T156	N148-N152 VanDerWaalsContact O-CB 3.28Å; N148-N152 WeakPolarHBondContact O-CB 3.38Å; N148-N152 PolarHBondContact O-N 3.39Å; E149-N152 CarbonylContact O-C 3.45Å; E149-N152 WeakPolarHBondContact O-CA 3.42Å; E149-N152 WeakPolarHBondContact O-CB 3.38Å; E149-N152 PolarHBondContact O-N 3.23Å; I150-N152 PolarHBondContact O-N 2.82Å; N152-W154 VanDerWaalsContact C-N 3.3Å; N152-W154 PolarHBondContact O-N 3.24Å; N152-R155 PolarHBondContact O-N 3.41Å; N152-R155 VanDerWaalsContact O-N 3.07Å; N152-R155 PolarHBondContact OD1-NH1 2.98Å; N152-T156 WeakPolarHBondContact O-CG2 3.27Å; N152-T156 PolarHBondContact O-N 2.96Å; N152-T156 PolarHBondContact O-OG1 3.41Å
153	Y	96	Very high	93.6	Very high	12 Å²	12	52 Å²	52	5%	0.047	26%	0.255	C	S	.	.	H	α-helix	trans	-53.6	-46.5	174.3	171.2	-91.8	0	0	0	111.7	F116 Q121 I124 L125 E149 I150 R155 T156 R157 V158	F116-Y153 AromaticContact CD2-CD2 3.74Å; F116-Y153 HydrophobicContact CD2-CD2 3.74Å; F116-Y153 HydrophobicContact CD2-CG 4.06Å; F116-Y153 HydrophobicContact CE2-CD2 4.27Å; F116-Y153 HydrophobicContact CE2-CG 4.16Å; F116-Y153 HydrophobicContact CG-CD2 4.39Å; Q121-Y153 HydrophobicContact CG-CE2 3.74Å; Q121-Y153 WeakPolarHBondContact CG-OH 3.26Å; Q121-Y153 PolarHBondContact OE1-OH 2.99Å; I124-Y153 HydrophobicContact CB-CE1 4.5Å; I124-Y153 HydrophobicContact CD1-CD1 4.1Å; I124-Y153 HydrophobicContact CD1-CE1 4.46Å; I124-Y153 HydrophobicContact CD1-CG 4.47Å; I124-Y153 HydrophobicContact CG2-CD1 3.9Å; I124-Y153 HydrophobicContact CG2-CE1 4.03Å; L125-Y153 HydrophobicContact CD2-CE1 4.37Å; E149-Y153 PolarHBondContact O-N 3.32Å; I150-Y153 PolarHBondContact O-N 3.43Å; Y153-R155 VanDerWaalsContact C-N 3.34Å; Y153-R155 PolarHBondContact O-N 3.35Å; Y153-T156 PolarHBondContact O-N 2.92Å; Y153-R157 HydrophobicContact CD2-CB 4.21Å; Y153-R157 HydrophobicContact CD2-CG 3.66Å; Y153-R157 HydrophobicContact CE2-CB 4.02Å; Y153-R157 HydrophobicContact CE2-CG 3.69Å; Y153-R157 HydrophobicContact CG-CG 4.4Å; Y153-R157 WeakPolarHBondContact O-CA 3.49Å; Y153-R157 VanDerWaalsContact O-CB 3.3Å; Y153-R157 WeakPolarHBondContact O-CB 3.45Å; Y153-R157 PolarHBondContact O-N 3.45Å; Y153-V158 HydrophobicContact CD1-CG2 4.33Å; Y153-V158 HydrophobicContact CE1-CG2 3.85Å; Y153-V158 PolarHBondContact O-N 2.85Å
154	W	95.9	Very high	93.1	Very high	15 Å²	15	51.9 Å²	51.9	6%	0.057	25%	0.245	C	C	.	.	I	π-helix	trans	-56.9	-47.3	175.4	-172.5	-97.1	0	0	0	111.9	L125 H128 W135 I150 N152 V158 Q159 V169	L125-W154 HydrophobicContact CD2-CZ3 4.03Å; H128-W154 HydrophobicContact CB-CE3 4.27Å; H128-W154 HydrophobicContact CB-CH2 4.26Å; H128-W154 HydrophobicContact CB-CZ3 3.79Å; H128-W154 AromaticContact CD2-CE3 3.93Å; H128-W154 AromaticContact CD2-CZ3 3.96Å; H128-W154 AromaticContact CE1-CE2 3.72Å; H128-W154 AromaticContact CE1-CH2 3.37Å; H128-W154 WeakPolarHBondContact CE1-CH2 3.47Å; H128-W154 AromaticContact CE1-CZ2 3.17Å; H128-W154 WeakPolarHBondContact CE1-CZ2 3.11Å; H128-W154 AromaticContact CG-CE3 3.88Å; H128-W154 AromaticContact CG-CH2 3.54Å; H128-W154 AromaticContact CG-CZ3 3.45Å; H128-W154 VanDerWaalsContact CG-CZ3 3.45Å; H128-W154 AromaticContact ND1-CH2 3.1Å; H128-W154 WeakPolarHBondContact ND1-CH2 3.5Å; H128-W154 AromaticContact ND1-CZ2 3.46Å; H128-W154 WeakPolarHBondContact ND1-CZ2 3.4Å; H128-W154 AromaticContact ND1-CZ3 3.56Å; H128-W154 AromaticContact NE2-CE2 3.63Å; H128-W154 AromaticContact NE2-CH2 3.94Å; H128-W154 AromaticContact NE2-CZ2 3.58Å; W135-W154 HydrophobicContact CH2-CB 3.7Å; W135-W154 AromaticContact CH2-CD1 3.71Å; W135-W154 HydrophobicContact CH2-CD2 4.02Å; W135-W154 AromaticContact CH2-CG 3.51Å; W135-W154 HydrophobicContact CH2-CG 3.51Å; W135-W154 HydrophobicContact CZ2-CG 4.4Å; W135-W154 HydrophobicContact CZ3-CB 4.01Å; W135-W154 HydrophobicContact CZ3-CG 4.17Å; I150-W154 PolarHBondContact O-N 2.87Å; N152-W154 VanDerWaalsContact C-N 3.3Å; N152-W154 PolarHBondContact O-N 3.24Å; W154-V158 HydrophobicContact CD2-CB 3.96Å; W154-V158 HydrophobicContact CD2-CG1 4.18Å; W154-V158 HydrophobicContact CD2-CG2 4.18Å; W154-V158 HydrophobicContact CE3-CB 3.85Å; W154-V158 HydrophobicContact CE3-CG1 3.94Å; W154-V158 HydrophobicContact CE3-CG2 3.64Å; W154-V158 HydrophobicContact CG-CB 4.46Å; W154-V158 HydrophobicContact CH2-CG1 3.73Å; W154-V158 HydrophobicContact CZ2-CG1 4Å; W154-V158 HydrophobicContact CZ3-CB 4.15Å; W154-V158 HydrophobicContact CZ3-CG1 3.71Å; W154-V158 HydrophobicContact CZ3-CG2 4Å; W154-V158 WeakPolarHBondContact O-CB 3.43Å; W154-V158 PolarHBondContact O-N 2.95Å; W154-V158 VanDerWaalsContact O-N 3.15Å; W154-Q159 WeakPolarHBondContact O-CG 3.47Å; W154-Q159 PolarHBondContact O-N 3.14Å; W154-V169 HydrophobicContact CH2-CG1 4.26Å; W154-V169 HydrophobicContact CZ2-CG1 3.45Å; W154-V169 VanDerWaalsContact CZ2-CG1 3.45Å
155	R	93.8	Very high	92.6	Very high	116 Å²	116	52.6 Å²	52.6	44%	0.438	24%	0.243	S	C	.	.	I	π-helix	trans	-67.7	-43.6	-179.3	-162.8	-163	-52.4	107.1	0.3	113.3	K151 N152 Y153	K151-R155 PolarHBondContact O-N 3.43Å; N152-R155 PolarHBondContact O-N 3.41Å; N152-R155 VanDerWaalsContact O-N 3.07Å; N152-R155 PolarHBondContact OD1-NH1 2.98Å; Y153-R155 VanDerWaalsContact C-N 3.34Å; Y153-R155 PolarHBondContact O-N 3.35Å
156	T	91.5	Very high	92.1	Very high	64 Å²	64	58.7 Å²	58.7	39%	0.393	28%	0.277	S	S	.	.	I	π-helix	trans	-89.4	-31.4	-170.6	59.8	0	0	0	0	113.3	N152 Y153 K160	N152-T156 WeakPolarHBondContact O-CG2 3.27Å; N152-T156 PolarHBondContact O-N 2.96Å; N152-T156 PolarHBondContact O-OG1 3.41Å; Y153-T156 PolarHBondContact O-N 2.92Å; T156-K160 VanDerWaalsContact O-CB 3.25Å; T156-K160 WeakPolarHBondContact O-CB 3.38Å
157	R	91.1	Very high	91.6	Very high	67 Å²	67	59 Å²	59	25%	0.253	28%	0.28	S	S	.	.	I	π-helix	trans	-96.5	-73.4	174.2	-52.9	-68.7	-175.7	154.8	0.8	110	D115 Y153 Q159 K160 H161 D340	D115-R157 IonicContact OD1-NH2 3.37Å; Y153-R157 HydrophobicContact CD2-CB 4.21Å; Y153-R157 HydrophobicContact CD2-CG 3.66Å; Y153-R157 HydrophobicContact CE2-CB 4.02Å; Y153-R157 HydrophobicContact CE2-CG 3.69Å; Y153-R157 HydrophobicContact CG-CG 4.4Å; Y153-R157 WeakPolarHBondContact O-CA 3.49Å; Y153-R157 VanDerWaalsContact O-CB 3.3Å; Y153-R157 WeakPolarHBondContact O-CB 3.45Å; Y153-R157 PolarHBondContact O-N 3.45Å; R157-Q159 PolarHBondContact O-N 2.96Å; R157-K160 WeakPolarHBondContact O-CB 3.38Å; R157-K160 PolarHBondContact O-N 3.23Å; R157-K160 VanDerWaalsContact O-N 3.11Å; R157-H161 PolarHBondContact O-N 3.05Å; R157-H161 PolarHBondContact O-ND1 2.73Å; R157-D340 IonicContact CZ-OD2 3.57Å; R157-D340 IonicContact NH1-OD1 3.15Å; R157-D340 IonicContact NH1-OD2 2.74Å; R157-D340 PolarHBondContact NH1-OD2 2.94Å; R157-D340 IonicContact NH2-OD1 3.74Å; R157-D340 IonicContact NH2-OD2 3.42Å; R157-D340 PolarHBondContact NH2-OD2 3.28Å
158	V	91.6	Very high	91.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.289	C	S	.	.	I	π-helix	trans	-60.7	-51.2	-166.2	-170.7	0	0	0	0	113	L125 Y153 W154 K160 H161 A162 F174 W182	L125-V158 HydrophobicContact CD2-CG2 3.72Å; Y153-V158 HydrophobicContact CD1-CG2 4.33Å; Y153-V158 HydrophobicContact CE1-CG2 3.85Å; Y153-V158 PolarHBondContact O-N 2.85Å; W154-V158 HydrophobicContact CD2-CB 3.96Å; W154-V158 HydrophobicContact CD2-CG1 4.18Å; W154-V158 HydrophobicContact CD2-CG2 4.18Å; W154-V158 HydrophobicContact CE3-CB 3.85Å; W154-V158 HydrophobicContact CE3-CG1 3.94Å; W154-V158 HydrophobicContact CE3-CG2 3.64Å; W154-V158 HydrophobicContact CG-CB 4.46Å; W154-V158 HydrophobicContact CH2-CG1 3.73Å; W154-V158 HydrophobicContact CZ2-CG1 4Å; W154-V158 HydrophobicContact CZ3-CB 4.15Å; W154-V158 HydrophobicContact CZ3-CG1 3.71Å; W154-V158 HydrophobicContact CZ3-CG2 4Å; W154-V158 WeakPolarHBondContact O-CB 3.43Å; W154-V158 PolarHBondContact O-N 2.95Å; W154-V158 VanDerWaalsContact O-N 3.15Å; V158-K160 VanDerWaalsContact C-N 3.27Å; V158-K160 PolarHBondContact O-N 2.85Å; V158-H161 PolarHBondContact O-N 2.66Å; V158-A162 PolarHBondContact O-N 3.22Å; V158-A162 VanDerWaalsContact O-N 3.14Å; V158-F174 HydrophobicContact CG1-CE1 3.72Å; V158-F174 HydrophobicContact CG1-CZ 3.71Å; V158-W182 HydrophobicContact CB-CH2 4.22Å; V158-W182 HydrophobicContact CB-CZ3 4.39Å; V158-W182 HydrophobicContact CG1-CH2 4.41Å; V158-W182 HydrophobicContact CG1-CZ3 4.1Å; V158-W182 HydrophobicContact CG2-CH2 3.79Å; V158-W182 HydrophobicContact CG2-CZ3 4.27Å
159	Q	90.3	Very high	90.9	Very high	71 Å²	71	59.3 Å²	59.3	33%	0.332	28%	0.282	S	S	.	.	H	α-helix	trans	-67	-27	178.7	-61.9	-170.1	-42.7	0	0	113.2	W154 R157 K163 V169	W154-Q159 WeakPolarHBondContact O-CG 3.47Å; W154-Q159 PolarHBondContact O-N 3.14Å; R157-Q159 PolarHBondContact O-N 2.96Å; Q159-K163 WeakPolarHBondContact O-CG 3.45Å; Q159-K163 PolarHBondContact O-N 2.94Å; Q159-V169 HydrophobicContact CB-CG2 4.37Å; Q159-V169 HydrophobicContact CG-CG2 4.08Å
160	K	86	Confident	90.4	Very high	121 Å²	121	62.5 Å²	62.5	53%	0.526	30%	0.301	S	S	.	.	H	α-helix	trans	-69.2	-42.8	174.5	-172.9	-176.2	174.9	-172.9	0	110.8	T156 R157 V158 K163 Q164	T156-K160 VanDerWaalsContact O-CB 3.25Å; T156-K160 WeakPolarHBondContact O-CB 3.38Å; R157-K160 WeakPolarHBondContact O-CB 3.38Å; R157-K160 PolarHBondContact O-N 3.23Å; R157-K160 VanDerWaalsContact O-N 3.11Å; V158-K160 VanDerWaalsContact C-N 3.27Å; V158-K160 PolarHBondContact O-N 2.85Å; K160-K163 PolarHBondContact O-N 3.17Å; K160-Q164 WeakPolarHBondContact O-CG 3.37Å; K160-Q164 PolarHBondContact O-N 2.7Å; K160-Q164 PolarHBondContact O-OE1 3.46Å
161	H	84.4	Confident	90.1	Very high	32 Å²	32	64.1 Å²	64.1	15%	0.148	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-43	177	-71.5	75.1	0	0	0	111.7	R157 V158 K163 Q164 L165 F174 W182 L342	R157-H161 PolarHBondContact O-N 3.05Å; R157-H161 PolarHBondContact O-ND1 2.73Å; V158-H161 PolarHBondContact O-N 2.66Å; H161-K163 VanDerWaalsContact C-N 3.32Å; H161-K163 PolarHBondContact O-N 2.85Å; H161-Q164 PolarHBondContact O-N 2.77Å; H161-Q164 VanDerWaalsContact O-N 3.15Å; H161-L165 WeakPolarHBondContact O-CG 3.4Å; H161-L165 PolarHBondContact O-N 3.11Å; H161-F174 HydrophobicContact CB-CE2 4.37Å; H161-W182 HydrophobicContact CB-CZ3 4.3Å; H161-L342 WeakPolarHBondContact NE2-CD1 3.48Å
162	A	88.7	Confident	89.7	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.008	33%	0.329	C	S	.	.	H	α-helix	trans	-57.5	-44.7	175.1	0	0	0	0	0	112.4	V158 Q164 L165 N166 C167 V169 F174	V158-A162 PolarHBondContact O-N 3.22Å; V158-A162 VanDerWaalsContact O-N 3.14Å; A162-Q164 PolarHBondContact O-N 3.03Å; A162-L165 CarbonylContact O-C 3.53Å; A162-L165 PolarHBondContact O-N 2.89Å; A162-N166 PolarHBondContact O-N 3.11Å; A162-C167 CarbonylContact C-O 3.37Å; A162-C167 PolarHBondContact O-N 3.28Å; A162-C167 VanDerWaalsContact O-N 3.09Å; A162-V169 HydrophobicContact CB-CB 4.34Å; A162-V169 HydrophobicContact CB-CG2 3.47Å; A162-V169 VanDerWaalsContact CB-CG2 3.47Å; A162-F174 VanDerWaalsContact CA-CE2 3.41Å; A162-F174 HydrophobicContact CB-CD1 4.4Å; A162-F174 HydrophobicContact CB-CD2 3.67Å; A162-F174 HydrophobicContact CB-CE1 4.24Å; A162-F174 HydrophobicContact CB-CE2 3.53Å; A162-F174 HydrophobicContact CB-CG 4.11Å; A162-F174 HydrophobicContact CB-CZ 3.82Å
163	K	87.4	Confident	89.3	Confident	155 Å²	155	68.3 Å²	68.3	67%	0.674	32%	0.324	S	S	*	.	H	α-helix	trans	-61.7	-41.3	175	-71.6	176	179.6	-172.1	0	112.6	Q159 K160 H161 L165 N166	Q159-K163 WeakPolarHBondContact O-CG 3.45Å; Q159-K163 PolarHBondContact O-N 2.94Å; K160-K163 PolarHBondContact O-N 3.17Å; H161-K163 VanDerWaalsContact C-N 3.32Å; H161-K163 PolarHBondContact O-N 2.85Å; K163-L165 VanDerWaalsContact C-N 3.28Å; K163-L165 PolarHBondContact O-N 3.46Å; K163-N166 PolarHBondContact O-N 2.83Å; K163-N166 VanDerWaalsContact O-N 3.11Å
164	Q	84.9	Confident	89	Confident	101 Å²	101	67.8 Å²	67.8	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-30.3	176.1	-71.4	169.8	-57.7	0	0	112.7	K160 H161 A162 N166	K160-Q164 WeakPolarHBondContact O-CG 3.37Å; K160-Q164 PolarHBondContact O-N 2.7Å; K160-Q164 PolarHBondContact O-OE1 3.46Å; H161-Q164 PolarHBondContact O-N 2.77Å; H161-Q164 VanDerWaalsContact O-N 3.15Å; A162-Q164 PolarHBondContact O-N 3.03Å; Q164-N166 PolarHBondContact O-N 2.74Å
165	L	84.5	Confident	88.7	Confident	37 Å²	37	69.7 Å²	69.7	19%	0.194	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	3.6	174.3	-64.7	178.5	0	0	0	113.4	H161 A162 K163 C167 R173 F174 A177 F328	H161-L165 WeakPolarHBondContact O-CG 3.4Å; H161-L165 PolarHBondContact O-N 3.11Å; A162-L165 CarbonylContact O-C 3.53Å; A162-L165 PolarHBondContact O-N 2.89Å; K163-L165 VanDerWaalsContact C-N 3.28Å; K163-L165 PolarHBondContact O-N 3.46Å; L165-C167 VanDerWaalsContact C-N 3.25Å; L165-C167 VanDerWaalsContact CB-SG 3.56Å; L165-C167 PolarHBondContact O-N 3.25Å; L165-R173 PolarHBondContact O-NH1 3.09Å; L165-R173 PolarHBondContact O-NH2 3.18Å; L165-F174 HydrophobicContact CD1-CD2 3.98Å; L165-F174 HydrophobicContact CD1-CE2 4.17Å; L165-A177 HydrophobicContact CD1-CB 4.35Å; L165-F328 HydrophobicContact CD2-CE1 4.23Å; L165-F328 HydrophobicContact CD2-CE2 4.11Å; L165-F328 HydrophobicContact CD2-CZ 3.49Å; L165-F328 VanDerWaalsContact CD2-CZ 3.49Å
166	N	87.7	Confident	88.5	Confident	145 Å²	145	65.2 Å²	65.2	78%	0.775	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	40	-173.7	-67.7	-50.5	0	0	0	113.3	A162 K163 Q164	A162-N166 PolarHBondContact O-N 3.11Å; K163-N166 PolarHBondContact O-N 2.83Å; K163-N166 VanDerWaalsContact O-N 3.11Å; Q164-N166 PolarHBondContact O-N 2.74Å
167	C	87.4	Confident	88.4	Confident	22 Å²	22	63.2 Å²	63.2	15%	0.149	31%	0.305	C	S	.	.	S	Bend	trans	-135	156.9	179.7	63.9	0	0	0	0	112.5	A162 L165	A162-C167 CarbonylContact C-O 3.37Å; A162-C167 PolarHBondContact O-N 3.28Å; A162-C167 VanDerWaalsContact O-N 3.09Å; L165-C167 VanDerWaalsContact C-N 3.25Å; L165-C167 VanDerWaalsContact CB-SG 3.56Å; L165-C167 PolarHBondContact O-N 3.25Å
168	D	90	Very high	88.3	Confident	92 Å²	92	60.3 Å²	60.3	49%	0.492	30%	0.295	S	S	.	.			trans	-74.9	148.1	170.9	-178.6	55.7	0	0	0	111	N170 S171 F174	D168-N170 PolarHBondContact O-N 2.97Å; D168-N170 WeakPolarHBondContact OD2-CA 3.41Å; D168-N170 WeakPolarHBondContact OD2-CB 3.21Å; D168-N170 PolarHBondContact OD2-N 3.25Å; D168-N170 PolarHBondContact OD2-ND2 3Å; D168-S171 WeakPolarHBondContact O-CB 3.41Å; D168-S171 PolarHBondContact O-N 3.44Å; D168-S171 PolarHBondContact O-OG 3.33Å; D168-F174 WeakPolarHBondContact O-CB 3.19Å
169	V	88.6	Confident	88.1	Confident	21 Å²	21	60.8 Å²	60.8	13%	0.127	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.7	179.5	-177.5	0	0	0	0	112	W154 Q159 A162 F174	W154-V169 HydrophobicContact CH2-CG1 4.26Å; W154-V169 HydrophobicContact CZ2-CG1 3.45Å; W154-V169 VanDerWaalsContact CZ2-CG1 3.45Å; Q159-V169 HydrophobicContact CB-CG2 4.37Å; Q159-V169 HydrophobicContact CG-CG2 4.08Å; A162-V169 HydrophobicContact CB-CB 4.34Å; A162-V169 HydrophobicContact CB-CG2 3.47Å; A162-V169 VanDerWaalsContact CB-CG2 3.47Å; V169-F174 HydrophobicContact CB-CD1 4.45Å; V169-F174 HydrophobicContact CG1-CD1 4.16Å; V169-F174 HydrophobicContact CG1-CE1 3.95Å; V169-F174 VanDerWaalsContact O-CD1 3.31Å; V169-F174 WeakPolarHBondContact O-CD1 3.44Å
170	N	87.5	Confident	88	Confident	107 Å²	107	59.1 Å²	59.1	57%	0.572	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-7	177.3	-48.6	-81	0	0	0	112.9	D168 K175	D168-N170 PolarHBondContact O-N 2.97Å; D168-N170 WeakPolarHBondContact OD2-CA 3.41Å; D168-N170 WeakPolarHBondContact OD2-CB 3.21Å; D168-N170 PolarHBondContact OD2-N 3.25Å; D168-N170 PolarHBondContact OD2-ND2 3Å; N170-K175 VanDerWaalsContact O-CE 3.26Å; N170-K175 WeakPolarHBondContact O-CE 3.45Å; N170-K175 PolarHBondContact O-NZ 3.43Å
171	S	90.5	Very high	88.1	Confident	33 Å²	33	56.4 Å²	56.4	23%	0.231	28%	0.279	C	S	.	.	S	Bend	trans	-62.3	148.5	-179.6	72.1	0	0	0	0	111.7	D168 R173 F174 K175	D168-S171 WeakPolarHBondContact O-CB 3.41Å; D168-S171 PolarHBondContact O-N 3.44Å; D168-S171 PolarHBondContact O-OG 3.33Å; S171-R173 VanDerWaalsContact C-N 3.29Å; S171-R173 PolarHBondContact O-N 2.79Å; S171-F174 PolarHBondContact O-N 3.47Å; S171-F174 WeakPolarHBondContact OG-CB 3.36Å; S171-F174 PolarHBondContact OG-N 3.05Å; S171-F174 VanDerWaalsContact OG-N 3.16Å; S171-K175 WeakPolarHBondContact O-CG 3.43Å; S171-K175 PolarHBondContact O-N 2.87Å; S171-K175 VanDerWaalsContact O-N 3.17Å
172	K	89.4	Confident	88.3	Confident	147 Å²	147	55.6 Å²	55.6	64%	0.639	28%	0.275	S	S	*	.	H	α-helix	trans	-55.7	-47.9	175.3	-165.9	-155.8	168.5	-161.4	0	110.4	F174 K175 D176	K172-F174 VanDerWaalsContact C-N 3.34Å; K172-F174 PolarHBondContact O-N 3.4Å; K172-K175 CarbonylContact O-C 3.6Å; K172-K175 WeakPolarHBondContact O-CB 3.24Å; K172-K175 PolarHBondContact O-N 2.93Å; K172-D176 VanDerWaalsContact CE-OD2 3.23Å; K172-D176 WeakPolarHBondContact CE-OD2 3.36Å; K172-D176 WeakPolarHBondContact CG-OD2 3.45Å; K172-D176 IonicContact NZ-OD2 3.83Å; K172-D176 VanDerWaalsContact O-CG 3.26Å; K172-D176 PolarHBondContact O-N 3.32Å
173	R	87.4	Confident	88.4	Confident	75 Å²	75	56.3 Å²	56.3	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-55	-40.4	178.3	-176.9	168.2	166.1	-91.9	-24.8	113.8	L165 S171 A177 W324	L165-R173 PolarHBondContact O-NH1 3.09Å; L165-R173 PolarHBondContact O-NH2 3.18Å; S171-R173 VanDerWaalsContact C-N 3.29Å; S171-R173 PolarHBondContact O-N 2.79Å; R173-A177 WeakPolarHBondContact O-CB 3.45Å; R173-A177 PolarHBondContact O-N 3.41Å; R173-A177 VanDerWaalsContact O-N 3.1Å; R173-W324 VanDerWaalsContact CZ-CH2 3.48Å; R173-W324 VanDerWaalsContact NH2-CZ3 3.27Å
174	F	90.1	Very high	88.5	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.009	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-42.8	174.8	-170.9	-110.1	0	0	0	112.3	V158 H161 A162 L165 D168 V169 S171 K172 A177 M178 W182	V158-F174 HydrophobicContact CG1-CE1 3.72Å; V158-F174 HydrophobicContact CG1-CZ 3.71Å; H161-F174 HydrophobicContact CB-CE2 4.37Å; A162-F174 VanDerWaalsContact CA-CE2 3.41Å; A162-F174 HydrophobicContact CB-CD1 4.4Å; A162-F174 HydrophobicContact CB-CD2 3.67Å; A162-F174 HydrophobicContact CB-CE1 4.24Å; A162-F174 HydrophobicContact CB-CE2 3.53Å; A162-F174 HydrophobicContact CB-CG 4.11Å; A162-F174 HydrophobicContact CB-CZ 3.82Å; L165-F174 HydrophobicContact CD1-CD2 3.98Å; L165-F174 HydrophobicContact CD1-CE2 4.17Å; D168-F174 WeakPolarHBondContact O-CB 3.19Å; V169-F174 HydrophobicContact CB-CD1 4.45Å; V169-F174 HydrophobicContact CG1-CD1 4.16Å; V169-F174 HydrophobicContact CG1-CE1 3.95Å; V169-F174 VanDerWaalsContact O-CD1 3.31Å; V169-F174 WeakPolarHBondContact O-CD1 3.44Å; S171-F174 PolarHBondContact O-N 3.47Å; S171-F174 WeakPolarHBondContact OG-CB 3.36Å; S171-F174 PolarHBondContact OG-N 3.05Å; S171-F174 VanDerWaalsContact OG-N 3.16Å; K172-F174 VanDerWaalsContact C-N 3.34Å; K172-F174 PolarHBondContact O-N 3.4Å; F174-A177 PolarHBondContact O-N 3.35Å; F174-M178 HydrophobicContact CD1-CG 4.12Å; F174-M178 HydrophobicContact CD1-SD 3.65Å; F174-M178 HydrophobicContact CE1-CG 3.81Å; F174-M178 HydrophobicContact CE1-SD 3.27Å; F174-M178 WeakPolarHBondContact CE1-SD 3.39Å; F174-M178 HydrophobicContact CZ-CG 4.07Å; F174-M178 HydrophobicContact CZ-SD 4.03Å; F174-M178 WeakPolarHBondContact O-CG 3.39Å; F174-M178 PolarHBondContact O-N 3.3Å; F174-W182 HydrophobicContact CZ-CZ3 4.29Å
175	K	89.8	Confident	88.7	Confident	55 Å²	55	50.2 Å²	50.2	24%	0.239	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-39.6	178.4	-68.1	167.4	173.5	160	0	112	N170 S171 K172 M178 R179 F302 W303	N170-K175 VanDerWaalsContact O-CE 3.26Å; N170-K175 WeakPolarHBondContact O-CE 3.45Å; N170-K175 PolarHBondContact O-NZ 3.43Å; S171-K175 WeakPolarHBondContact O-CG 3.43Å; S171-K175 PolarHBondContact O-N 2.87Å; S171-K175 VanDerWaalsContact O-N 3.17Å; K172-K175 CarbonylContact O-C 3.6Å; K172-K175 WeakPolarHBondContact O-CB 3.24Å; K172-K175 PolarHBondContact O-N 2.93Å; K175-M178 WeakPolarHBondContact O-CB 3.37Å; K175-M178 PolarHBondContact O-N 3.26Å; K175-R179 VanDerWaalsContact O-CB 3.29Å; K175-R179 WeakPolarHBondContact O-CB 3.38Å; K175-R179 PolarHBondContact O-N 3.04Å; K175-F302 HydrophobicContact CB-CE1 4.26Å; K175-W303 HydrophobicContact CB-CH2 4.18Å; K175-W303 HydrophobicContact CB-CZ2 4.1Å; K175-W303 HydrophobicContact CD-CZ2 4.29Å; K175-W303 HydrophobicContact CG-CH2 4.17Å; K175-W303 HydrophobicContact CG-CZ2 3.92Å
176	D	89.2	Confident	88.9	Confident	22 Å²	22	48.5 Å²	48.5	12%	0.118	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-47.8	174.5	-65.9	-24.6	0	0	0	110.2	K172 M178 R179 F180 F302	K172-D176 VanDerWaalsContact CE-OD2 3.23Å; K172-D176 WeakPolarHBondContact CE-OD2 3.36Å; K172-D176 WeakPolarHBondContact CG-OD2 3.45Å; K172-D176 IonicContact NZ-OD2 3.83Å; K172-D176 VanDerWaalsContact O-CG 3.26Å; K172-D176 PolarHBondContact O-N 3.32Å; D176-M178 VanDerWaalsContact C-N 3.33Å; D176-M178 PolarHBondContact O-N 3.03Å; D176-R179 PolarHBondContact O-N 2.97Å; D176-F180 HydrophobicContact CB-CD2 4.09Å; D176-F180 HydrophobicContact CB-CE2 4.28Å; D176-F180 WeakPolarHBondContact O-CB 3.17Å; D176-F180 VanDerWaalsContact O-CD2 3.23Å; D176-F180 WeakPolarHBondContact O-CD2 3.4Å; D176-F180 PolarHBondContact O-N 3.21Å; D176-F302 WeakPolarHBondContact OD1-CZ 3.43Å
177	A	89.7	Confident	89	Confident	21 Å²	21	43.9 Å²	43.9	17%	0.174	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-38.9	174.4	0	0	0	0	0	112.9	L165 R173 F174 L181 W182	L165-A177 HydrophobicContact CD1-CB 4.35Å; R173-A177 WeakPolarHBondContact O-CB 3.45Å; R173-A177 PolarHBondContact O-N 3.41Å; R173-A177 VanDerWaalsContact O-N 3.1Å; F174-A177 PolarHBondContact O-N 3.35Å; A177-L181 WeakPolarHBondContact O-CB 3.06Å; A177-L181 PolarHBondContact O-N 3.17Å; A177-L181 VanDerWaalsContact O-N 3.15Å; A177-W182 PolarHBondContact O-N 3.31Å
178	M	89.5	Confident	89.2	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.03	24%	0.243	C	C	.	.	I	π-helix	trans	-62.1	-49.6	172.6	-74.6	-179.6	65.8	0	0	112	L125 F174 K175 D176 W182 M183 W303	L125-M178 HydrophobicContact CB-CE 3.97Å; L125-M178 HydrophobicContact CD1-CE 4.02Å; L125-M178 HydrophobicContact CD2-CE 3.73Å; L125-M178 HydrophobicContact CG-CE 4.08Å; F174-M178 HydrophobicContact CD1-CG 4.12Å; F174-M178 HydrophobicContact CD1-SD 3.65Å; F174-M178 HydrophobicContact CE1-CG 3.81Å; F174-M178 HydrophobicContact CE1-SD 3.27Å; F174-M178 WeakPolarHBondContact CE1-SD 3.39Å; F174-M178 HydrophobicContact CZ-CG 4.07Å; F174-M178 HydrophobicContact CZ-SD 4.03Å; F174-M178 WeakPolarHBondContact O-CG 3.39Å; F174-M178 PolarHBondContact O-N 3.3Å; K175-M178 WeakPolarHBondContact O-CB 3.37Å; K175-M178 PolarHBondContact O-N 3.26Å; D176-M178 VanDerWaalsContact C-N 3.33Å; D176-M178 PolarHBondContact O-N 3.03Å; M178-W182 HydrophobicContact CG-CE3 4.1Å; M178-W182 PolarHBondContact O-N 2.9Å; M178-M183 WeakPolarHBondContact O-CB 3.25Å; M178-M183 WeakPolarHBondContact O-CG 3.47Å; M178-M183 PolarHBondContact O-N 2.84Å; M178-W303 HydrophobicContact CE-CH2 4.35Å; M178-W303 HydrophobicContact CE-CZ3 4.34Å; M178-W303 HydrophobicContact SD-CH2 4.45Å
179	R	86.7	Confident	89.2	Confident	10 Å²	10	47.4 Å²	47.4	4%	0.038	24%	0.235	C	C	.	.	I	π-helix	trans	-71.2	-42.1	-172.9	176.6	173	174.1	76.5	-19.4	113.2	K175 D176 P184 D301 F302 S304 S307 A308	K175-R179 VanDerWaalsContact O-CB 3.29Å; K175-R179 WeakPolarHBondContact O-CB 3.38Å; K175-R179 PolarHBondContact O-N 3.04Å; D176-R179 PolarHBondContact O-N 2.97Å; R179-P184 VanDerWaalsContact O-CD 3.3Å; R179-P184 WeakPolarHBondContact O-CD 3.19Å; R179-D301 PolarHBondContact NH2-O 2.89Å; R179-F302 VanDerWaalsContact CD-O 3.25Å; R179-F302 WeakPolarHBondContact CD-O 3.16Å; R179-F302 PolarHBondContact NE-O 3.49Å; R179-F302 PolarHBondContact NH1-O 2.88Å; R179-F302 PolarHBondContact NH2-O 3.43Å; R179-S304 PolarHBondContact NH1-O 2.8Å; R179-S304 PolarHBondContact NH2-O 3.38Å; R179-S307 VanDerWaalsContact NH2-C 3.31Å; R179-A308 HydrophobicContact CG-CB 4.34Å
180	F	89.3	Confident	89.2	Confident	37 Å²	37	46.7 Å²	46.7	16%	0.162	23%	0.232	C	C	.	.	I	π-helix	trans	-98.6	-21.2	-171.5	-60.6	-64.5	0	0	0	114	D176 A308 H311 L312	D176-F180 HydrophobicContact CB-CD2 4.09Å; D176-F180 HydrophobicContact CB-CE2 4.28Å; D176-F180 WeakPolarHBondContact O-CB 3.17Å; D176-F180 VanDerWaalsContact O-CD2 3.23Å; D176-F180 WeakPolarHBondContact O-CD2 3.4Å; D176-F180 PolarHBondContact O-N 3.21Å; F180-A308 HydrophobicContact CE1-CB 4.43Å; F180-H311 HydrophobicContact CE1-CB 4.03Å; F180-H311 HydrophobicContact CZ-CB 3.97Å; F180-L312 HydrophobicContact CD1-CD2 4.15Å; F180-L312 HydrophobicContact CD1-CG 3.96Å; F180-L312 HydrophobicContact CE1-CG 4.4Å
181	L	87.3	Confident	89.4	Confident	64 Å²	64	44 Å²	44	34%	0.335	22%	0.224	S	C	.	.	I	π-helix	trans	-115.5	-58.4	179.6	-53	173.4	0	0	0	112	A177 R185 W343 M351	A177-L181 WeakPolarHBondContact O-CB 3.06Å; A177-L181 PolarHBondContact O-N 3.17Å; A177-L181 VanDerWaalsContact O-N 3.15Å; L181-R185 VanDerWaalsContact O-CG 3.26Å; L181-R185 WeakPolarHBondContact O-CG 3.5Å; L181-R185 PolarHBondContact O-N 3.26Å; L181-W343 HydrophobicContact CB-CH2 4.19Å; L181-M351 HydrophobicContact CD2-CE 4.47Å
182	W	88.3	Confident	89.3	Confident	14 Å²	14	46.3 Å²	46.3	5%	0.053	24%	0.237	C	C	.	.	I	π-helix	trans	-71.6	-51.4	-169.2	-168.9	1	0	0	0	113.2	L125 V158 H161 F174 A177 M178 R185 L186 L342	L125-W182 HydrophobicContact CD1-CD2 4.29Å; V158-W182 HydrophobicContact CB-CH2 4.22Å; V158-W182 HydrophobicContact CB-CZ3 4.39Å; V158-W182 HydrophobicContact CG1-CH2 4.41Å; V158-W182 HydrophobicContact CG1-CZ3 4.1Å; V158-W182 HydrophobicContact CG2-CH2 3.79Å; V158-W182 HydrophobicContact CG2-CZ3 4.27Å; H161-W182 HydrophobicContact CB-CZ3 4.3Å; F174-W182 HydrophobicContact CZ-CZ3 4.29Å; A177-W182 PolarHBondContact O-N 3.31Å; M178-W182 HydrophobicContact CG-CE3 4.1Å; M178-W182 PolarHBondContact O-N 2.9Å; W182-R185 PolarHBondContact O-N 3.46Å; W182-L186 PolarHBondContact O-N 3.17Å; W182-L342 HydrophobicContact CZ2-CD1 3.65Å; W182-L342 VanDerWaalsContact NE1-CD2 3.35Å
183	M	91	Very high	89.2	Confident	17 Å²	17	42.1 Å²	42.1	8%	0.084	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-44	-178.4	-69.8	176.9	72.2	0	0	112.6	L122 L125 D126 M178 R185 L186 A187 W303	L122-M183 HydrophobicContact CD2-CB 4.08Å; L122-M183 HydrophobicContact CD2-CG 4.34Å; L122-M183 WeakPolarHBondContact CD2-O 3.27Å; L125-M183 HydrophobicContact CB-CG 4.5Å; L125-M183 HydrophobicContact CB-SD 4.35Å; L125-M183 HydrophobicContact CD1-CG 3.94Å; D126-M183 HydrophobicContact CB-CE 4.42Å; M178-M183 WeakPolarHBondContact O-CB 3.25Å; M178-M183 WeakPolarHBondContact O-CG 3.47Å; M178-M183 PolarHBondContact O-N 2.84Å; M183-R185 VanDerWaalsContact C-N 3.32Å; M183-R185 PolarHBondContact O-N 3.21Å; M183-L186 PolarHBondContact O-N 3.13Å; M183-A187 PolarHBondContact O-N 3.44Å; M183-W303 HydrophobicContact SD-CE3 4.18Å; M183-W303 HydrophobicContact SD-CZ3 4.01Å
184	P	90	Very high	89	Confident	61 Å²	61	42.5 Å²	42.5	40%	0.396	25%	0.249	S	C	.	.	H	α-helix	trans	-57.9	-40.7	173.8	-28.4	37.8	0	0	0	113.4	R179 A187 E188	R179-P184 VanDerWaalsContact O-CD 3.3Å; R179-P184 WeakPolarHBondContact O-CD 3.19Å; P184-A187 PolarHBondContact O-N 3.09Å; P184-E188 PolarHBondContact O-N 2.83Å
185	R	88.2	Confident	88.3	Confident	66 Å²	66	50.1 Å²	50.1	25%	0.249	28%	0.284	C	S	.	.	H	α-helix	trans	-68.9	-34.4	176.7	-68.6	-56.9	-160.5	151	20.2	113.5	L181 W182 M183 E188 R189 D347	L181-R185 VanDerWaalsContact O-CG 3.26Å; L181-R185 WeakPolarHBondContact O-CG 3.5Å; L181-R185 PolarHBondContact O-N 3.26Å; W182-R185 PolarHBondContact O-N 3.46Å; M183-R185 VanDerWaalsContact C-N 3.32Å; M183-R185 PolarHBondContact O-N 3.21Å; R185-E188 VanDerWaalsContact CD-OE2 3.27Å; R185-E188 WeakPolarHBondContact CD-OE2 3.41Å; R185-E188 IonicContact CZ-OE2 2.75Å; R185-E188 IonicContact NE-OE2 2.76Å; R185-E188 IonicContact NH1-OE1 3.75Å; R185-E188 IonicContact NH1-OE2 3.33Å; R185-E188 PolarHBondContact NH1-OE2 2.88Å; R185-R189 WeakPolarHBondContact O-CG 3.42Å; R185-R189 PolarHBondContact O-N 3.4Å; R185-D347 IonicContact CZ-OD1 3.22Å; R185-D347 IonicContact NH1-OD1 2.8Å; R185-D347 IonicContact NH2-OD1 2.88Å; R185-D347 PolarHBondContact NH2-OD1 3.41Å
186	L	90.1	Very high	87.1	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-67.3	-37.8	170.4	-73.8	174.7	0	0	0	111.7	Q121 L122 L125 W182 M183 R189 A190	Q121-L186 HydrophobicContact CB-CD1 3.92Å; Q121-L186 HydrophobicContact CB-CD2 4.27Å; L122-L186 HydrophobicContact CD1-CB 4.31Å; L122-L186 HydrophobicContact CD2-CB 3.63Å; L122-L186 HydrophobicContact CD2-CD1 4.35Å; L122-L186 HydrophobicContact CG-CB 3.73Å; L122-L186 HydrophobicContact CG-CD1 4.48Å; L125-L186 HydrophobicContact CD1-CD1 3.96Å; W182-L186 PolarHBondContact O-N 3.17Å; M183-L186 PolarHBondContact O-N 3.13Å; L186-R189 PolarHBondContact O-N 3.1Å; L186-A190 WeakPolarHBondContact O-CB 3.4Å; L186-A190 PolarHBondContact O-N 3.3Å
187	A	90.3	Very high	85.4	Confident	47 Å²	47	58.9 Å²	58.9	39%	0.388	34%	0.335	S	S	.	.	H	α-helix	trans	-66.3	-38.9	176	0	0	0	0	0	112.5	L122 M183 P184 A190 A191	L122-A187 HydrophobicContact CD1-CB 4.11Å; M183-A187 PolarHBondContact O-N 3.44Å; P184-A187 PolarHBondContact O-N 3.09Å; A187-A190 PolarHBondContact O-N 3.17Å; A187-A191 WeakPolarHBondContact O-CB 3.4Å; A187-A191 PolarHBondContact O-N 2.87Å
188	E	89.9	Confident	83.5	Confident	103 Å²	103	65.6 Å²	65.6	48%	0.481	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-49.9	170.3	-175.6	179	-160.2	0	0	111.1	P184 R185 A190 A191 T192	P184-E188 PolarHBondContact O-N 2.83Å; R185-E188 VanDerWaalsContact CD-OE2 3.27Å; R185-E188 WeakPolarHBondContact CD-OE2 3.41Å; R185-E188 IonicContact CZ-OE2 2.75Å; R185-E188 IonicContact NE-OE2 2.76Å; R185-E188 IonicContact NH1-OE1 3.75Å; R185-E188 IonicContact NH1-OE2 3.33Å; R185-E188 PolarHBondContact NH1-OE2 2.88Å; E188-A190 PolarHBondContact O-N 2.85Å; E188-A191 PolarHBondContact O-N 3.44Å; E188-T192 WeakPolarHBondContact O-CG2 3.42Å; E188-T192 PolarHBondContact O-N 3.41Å; E188-T192 PolarHBondContact O-OG1 2.9Å
189	R	89.8	Confident	81.5	Confident	86 Å²	86	70.8 Å²	70.8	33%	0.325	40%	0.397	S	S	.	.	H	α-helix	trans	-60.6	-43.6	177	-71.7	175.9	-172.6	161	7.5	112.4	A118 R185 L186 T192 A193 L342	A118-R189 HydrophobicContact CB-CB 4.1Å; R185-R189 WeakPolarHBondContact O-CG 3.42Å; R185-R189 PolarHBondContact O-N 3.4Å; L186-R189 PolarHBondContact O-N 3.1Å; R189-T192 PolarHBondContact O-N 3.11Å; R189-T192 PolarHBondContact O-OG1 2.91Å; R189-A193 WeakPolarHBondContact O-CB 3.34Å; R189-A193 PolarHBondContact O-N 3.41Å; R189-L342 PolarHBondContact NH2-O 3.44Å
190	A	90.2	Very high	79.6	Confident	6 Å²	6	77.9 Å²	77.9	5%	0.05	43%	0.431	C	S	.	.	H	α-helix	trans	-58.9	-47.8	174.5	0	0	0	0	0	112.1	A118 D119 L122 L186 A187 E188 T192 A193 A194	A118-A190 HydrophobicContact CB-CB 3.82Å; D119-A190 WeakPolarHBondContact OD1-CB 3.43Å; L122-A190 HydrophobicContact CD1-CB 4.33Å; L186-A190 WeakPolarHBondContact O-CB 3.4Å; L186-A190 PolarHBondContact O-N 3.3Å; A187-A190 PolarHBondContact O-N 3.17Å; E188-A190 PolarHBondContact O-N 2.85Å; A190-T192 PolarHBondContact O-N 2.76Å; A190-A193 PolarHBondContact O-N 3.04Å; A190-A194 PolarHBondContact O-N 3.09Å
191	A	90.4	Very high	77.6	Confident	50 Å²	50	85.2 Å²	85.2	41%	0.413	47%	0.465	S	S	.	.	H	α-helix	trans	-60.9	-42.3	177	0	0	0	0	0	112.2	A187 E188 A194 H195	A187-A191 WeakPolarHBondContact O-CB 3.4Å; A187-A191 PolarHBondContact O-N 2.87Å; E188-A191 PolarHBondContact O-N 3.44Å; A191-A194 PolarHBondContact O-N 3.43Å; A191-H195 PolarHBondContact O-N 3.46Å; A191-H195 PolarHBondContact O-ND1 3.42Å
192	T	89.4	Confident	75.7	Confident	81 Å²	81	87.5 Å²	87.5	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-39.1	176.1	60.5	0	0	0	0	112.8	E188 R189 A190 A194 H195 Q196	E188-T192 WeakPolarHBondContact O-CG2 3.42Å; E188-T192 PolarHBondContact O-N 3.41Å; E188-T192 PolarHBondContact O-OG1 2.9Å; R189-T192 PolarHBondContact O-N 3.11Å; R189-T192 PolarHBondContact O-OG1 2.91Å; A190-T192 PolarHBondContact O-N 2.76Å; T192-A194 VanDerWaalsContact C-N 3.35Å; T192-A194 PolarHBondContact O-N 3.3Å; T192-H195 PolarHBondContact O-N 2.91Å; T192-Q196 PolarHBondContact O-N 3.48Å
193	A	87	Confident	73.5	Confident	59 Å²	59	91.6 Å²	91.6	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-37.7	176.5	0	0	0	0	0	112.4	R189 A190 H195 Q196	R189-A193 WeakPolarHBondContact O-CB 3.34Å; R189-A193 PolarHBondContact O-N 3.41Å; A190-A193 PolarHBondContact O-N 3.04Å; A193-H195 VanDerWaalsContact C-N 3.27Å; A193-H195 PolarHBondContact O-N 3.23Å; A193-Q196 PolarHBondContact O-N 2.86Å
194	A	82.5	Confident	71.2	Confident	84 Å²	84	94 Å²	94	69%	0.694	54%	0.541	S	S	*	.	H	α-helix	trans	-67	-24.7	175.8	0	0	0	0	0	113.8	A190 A191 T192	A190-A194 PolarHBondContact O-N 3.09Å; A191-A194 PolarHBondContact O-N 3.43Å; T192-A194 VanDerWaalsContact C-N 3.35Å; T192-A194 PolarHBondContact O-N 3.3Å
195	H	75.8	Confident	68.9	Low	161 Å²	161	95.7 Å²	95.7	75%	0.745	56%	0.56	S	S	*	*	H	α-helix	trans	-92	-8.2	178.9	-73.9	84.4	0	0	0	114.1	A191 T192 A193 P197	A191-H195 PolarHBondContact O-N 3.46Å; A191-H195 PolarHBondContact O-ND1 3.42Å; T192-H195 PolarHBondContact O-N 2.91Å; A193-H195 VanDerWaalsContact C-N 3.27Å; A193-H195 PolarHBondContact O-N 3.23Å; H195-P197 VanDerWaalsContact O-CD 3.25Å; H195-P197 WeakPolarHBondContact O-CD 3.44Å
196	Q	64.9	Low	66.8	Low	149 Å²	149	98.1 Å²	98.1	70%	0.696	59%	0.585	S	S	*	*	S	Bend	trans	-73.4	116.8	171.7	-74.3	-170.8	-5.7	0	0	109.3	T192 A193 Q198	T192-Q196 PolarHBondContact O-N 3.48Å; A193-Q196 PolarHBondContact O-N 2.86Å; Q196-Q198 PolarHBondContact O-N 3.38Å; Q196-Q198 VanDerWaalsContact O-N 3.09Å
197	P	53.7	Low	64.9	Low	112 Å²	112	104.7 Å²	104.7	73%	0.727	62%	0.621	S	S	*	*			trans	-62.4	119.9	168.2	27.2	-31.9	0	0	0	107.2	H195	H195-P197 VanDerWaalsContact O-CD 3.25Å; H195-P197 WeakPolarHBondContact O-CD 3.44Å
198	Q	49	Very low	63.1	Low	163 Å²	163	109.6 Å²	109.6	76%	0.762	64%	0.641	S	S	*	*			trans	-43	134.4	167.9	-77.1	-77.8	-19	0	0	108.4	Q196 Q200	Q196-Q198 PolarHBondContact O-N 3.38Å; Q196-Q198 VanDerWaalsContact O-N 3.09Å; Q198-Q200 PolarHBondContact O-N 3.31Å
199	P	48.4	Very low	60.9	Low	115 Å²	115	110.5 Å²	110.5	75%	0.747	65%	0.653	S	S	*	*			trans	-65.2	88.9	173.3	27.6	-32.9	0	0	0	107.6	H201	P199-H201 PolarHBondContact O-N 3.39Å
200	Q	46.9	Very low	58.5	Low	159 Å²	159	115 Å²	115	74%	0.743	68%	0.682	S	S	*	*			trans	-50.9	109.6	166.3	49.9	-170.7	-60	0	0	105.7	Q198 V202	Q198-Q200 PolarHBondContact O-N 3.31Å; Q200-V202 PolarHBondContact O-N 3.22Å
201	H	47.3	Very low	56	Low	191 Å²	191	120.7 Å²	120.7	88%	0.884	72%	0.716	S	S	*	*			trans	-57.5	99.7	174	-125	-88	0	0	0	104.9	P199 A203	P199-H201 PolarHBondContact O-N 3.39Å; H201-A203 VanDerWaalsContact C-N 3.28Å; H201-A203 PolarHBondContact O-N 3.05Å
202	V	46.3	Very low	53.3	Low	112 Å²	112	122.9 Å²	122.9	68%	0.679	73%	0.734	S	S	*	*			trans	-62.8	104.1	171.8	-77.7	0	0	0	0	104.8	Q200 A204	Q200-V202 PolarHBondContact O-N 3.22Å; V202-A204 HydrophobicContact CB-CB 4.28Å; V202-A204 HydrophobicContact CG2-CB 4.3Å; V202-A204 PolarHBondContact O-N 3Å
203	A	42.6	Very low	50.7	Low	100 Å²	100	124 Å²	124	83%	0.826	75%	0.752	S	S	*	*			trans	-62.5	69.2	149.5	0	0	0	0	0	106.4	H201 A205	H201-A203 VanDerWaalsContact C-N 3.28Å; H201-A203 PolarHBondContact O-N 3.05Å; A203-A205 PolarHBondContact O-N 2.95Å
204	A	43.5	Very low	48.2	Very low	68 Å²	68	126 Å²	126	56%	0.562	77%	0.768	S	S	*	*			trans	-66.9	92.2	174.3	0	0	0	0	0	105.1	V202 C206	V202-A204 HydrophobicContact CB-CB 4.28Å; V202-A204 HydrophobicContact CG2-CB 4.3Å; V202-A204 PolarHBondContact O-N 3Å; A204-C206 PolarHBondContact O-N 3.09Å
205	A	40.4	Very low	46	Very low	95 Å²	95	127 Å²	127	79%	0.785	78%	0.776	S	S	*	*			trans	-47.6	112.4	-175.1	0	0	0	0	0	109	A203 N207	A203-A205 PolarHBondContact O-N 2.95Å; A205-N207 VanDerWaalsContact C-N 3.34Å; A205-N207 PolarHBondContact O-N 2.68Å
206	C	44.2	Very low	44.3	Very low	117 Å²	117	124.2 Å²	124.2	79%	0.791	78%	0.782	S	S	*	*			trans	-70.2	96.4	-177.6	-53.8	0	0	0	0	108.9	A204	A204-C206 PolarHBondContact O-N 3.09Å
207	N	51.6	Low	43.2	Very low	140 Å²	140	121.9 Å²	121.9	75%	0.749	79%	0.787	S	S	*	*			trans	72.5	93.5	152.1	-51.2	-32.2	0	0	0	117.3	A205	A205-N207 VanDerWaalsContact C-N 3.34Å; A205-N207 PolarHBondContact O-N 2.68Å
208	N	51.5	Low	42.8	Very low	151 Å²	151	124 Å²	124	81%	0.807	79%	0.792	S	S	*	*				38.6	110	119.6	-65.3	-16.3	0	0	0	119
209	V	44.1	Very low	42.6	Very low	122 Å²	122	120.6 Å²	120.6	74%	0.739	79%	0.787	S	S	*	*			trans	53.8	82	133.5	-166.6	0	0	0	0	116.7	V211	V209-V211 VanDerWaalsContact C-N 3.28Å; V209-V211 PolarHBondContact O-N 3.39Å
210	L	38.1	Very low	42.5	Very low	181 Å²	181	120.3 Å²	120.3	95%	0.948	79%	0.788	S	S	*	*			trans	-79	67.3	154.5	-80.5	168.5	0	0	0	111.5
211	V	38.3	Very low	42.6	Very low	124 Å²	124	118 Å²	118	75%	0.752	79%	0.789	S	S	*	*			trans	-153.2	140	161	170.1	0	0	0	0	108.9	V209	V209-V211 VanDerWaalsContact C-N 3.28Å; V209-V211 PolarHBondContact O-N 3.39Å
212	A	33.2	Very low	42.2	Very low	97 Å²	97	115.2 Å²	115.2	80%	0.802	79%	0.789	S	S	*	*	S	Bend	trans	75.3	75.6	171.6	0	0	0	0	0	118.5
213	A	35.9	Very low	41.9	Very low	104 Å²	104	114.5 Å²	114.5	86%	0.86	79%	0.789	S	S	*	*			trans	-168.9	61.1	139.8	0	0	0	0	0	112
214	A	33.6	Very low	41.7	Very low	100 Å²	100	121.8 Å²	121.8	83%	0.826	80%	0.795	S	S	*	*			trans	-77.6	145.9	159.5	0	0	0	0	0	109.2
215	A	36.1	Very low	41.6	Very low	105 Å²	105	123.9 Å²	123.9	87%	0.868	81%	0.806	S	S	*	*			trans	66.1	77.4	172.4	0	0	0	0	0	117.8
216	A	41.1	Very low	41.8	Very low	104 Å²	104	124.9 Å²	124.9	86%	0.86	81%	0.807	S	S	*	*			trans	-144.6	109.3	140.3	0	0	0	0	0	109
217	A	40.7	Very low	42.1	Very low	99 Å²	99	124.6 Å²	124.6	82%	0.818	80%	0.804	S	S	*	*			trans	-83.9	167.9	176.7	0	0	0	0	0	111.5
218	N	47.3	Very low	41.6	Very low	156 Å²	156	128.4 Å²	128.4	83%	0.834	81%	0.807	S	S	*	*			trans	93.7	135.5	153.9	-129.3	16.5	0	0	0	119.4
219	S	43.1	Very low	41.2	Very low	93 Å²	93	126.2 Å²	126.2	65%	0.65	80%	0.804	S	S	*	*			trans	85.2	112.1	151.8	-60	0	0	0	0	122.2
220	S	47.4	Very low	41.3	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	80%	0.802	S	S	*	*				73.8	98.7	129.8	60.9	0	0	0	0	121.6
221	S	48.2	Very low	41.6	Very low	112 Å²	112	120.7 Å²	120.7	78%	0.783	79%	0.791	S	S	*	*				54.2	108.8	110.1	173.9	0	0	0	0	119.5
222	C	40	Very low	41.9	Very low	131 Å²	131	121.3 Å²	121.3	89%	0.885	80%	0.795	S	S	*	*				-144.1	140.1	114.7	51.5	0	0	0	0	110.9
223	C	38.5	Very low	42.2	Very low	98 Å²	98	122.4 Å²	122.4	66%	0.662	79%	0.792	S	S	*	*			trans	-115.9	155.2	-178.3	48.7	0	0	0	0	109.5
224	W	39.7	Very low	42.3	Very low	252 Å²	252	123.8 Å²	123.8	96%	0.955	79%	0.789	S	S	*	*			trans	-165.6	95.7	145	-69.7	-34.1	0	0	0	106.4
225	S	40.7	Very low	42.6	Very low	113 Å²	113	123.5 Å²	123.5	79%	0.79	79%	0.787	S	S	*	*				88.9	99.9	88.3	-67.8	0	0	0	0	114.5
226	S	44	Very low	42.5	Very low	115 Å²	115	123.3 Å²	123.3	80%	0.804	79%	0.786	S	S	*	*			trans	-76.5	-169.6	163.1	-36.8	0	0	0	0	110.7
227	P	50.2	Low	42.2	Very low	112 Å²	112	124.6 Å²	124.6	73%	0.727	79%	0.787	S	S	*	*				-158.7	167.2	56.9	42.2	-19.3	0	0	0	121
228	R	42.1	Very low	42	Very low	219 Å²	219	126.2 Å²	126.2	83%	0.826	79%	0.792	S	S	*	*			trans	58.6	128.3	141.9	-79.8	173.7	162.3	-115.7	-3.2	120.7
229	S	43.9	Very low	41.6	Very low	105 Å²	105	122.7 Å²	122.7	73%	0.734	79%	0.793	S	S	*	*				-160.9	132	67.1	-68.4	0	0	0	0	111.4
230	S	46.2	Very low	41.3	Very low	101 Å²	101	123.7 Å²	123.7	71%	0.706	80%	0.8	S	S	*	*				71.1	130.9	96.1	-49	0	0	0	0	114.8
231	A	43.2	Very low	41.1	Very low	86 Å²	86	124.4 Å²	124.4	71%	0.711	81%	0.805	S	S	*	*			cis	-170.2	174.1	-6.6	0	0	0	0	0	110.9
232	V	44	Very low	40.6	Very low	138 Å²	138	124.5 Å²	124.5	84%	0.836	81%	0.805	S	S	*	*			trans	70.7	134.8	152.9	159.4	0	0	0	0	117.5
233	T	41.4	Very low	40.5	Very low	120 Å²	120	124.5 Å²	124.5	74%	0.736	81%	0.805	S	S	*	*			cis	-158.3	163.8	-6.9	-92.3	0	0	0	0	111.7
234	T	37.1	Very low	40.3	Very low	132 Å²	132	124.9 Å²	124.9	81%	0.81	81%	0.809	S	S	*	*			trans	-71.2	148.3	-173.9	51	0	0	0	0	118.9
235	A	39	Very low	40.3	Very low	95 Å²	95	117.9 Å²	117.9	79%	0.785	80%	0.799	S	S	*	*			trans	161.7	130.2	131.1	0	0	0	0	0	108.7
236	A	34.4	Very low	40.2	Very low	101 Å²	101	119.8 Å²	119.8	84%	0.835	80%	0.799	S	S	*	*			cis	78.6	86.2	23.8	0	0	0	0	0	116.2
237	C	36.3	Very low	39.8	Very low	131 Å²	131	119.8 Å²	119.8	89%	0.885	80%	0.795	S	S	*	*			trans	-157.7	132.5	147.7	55.4	0	0	0	0	112.3
238	S	36.1	Very low	39.4	Very low	133 Å²	133	119.8 Å²	119.8	93%	0.93	80%	0.797	S	S	*	*			trans	-85	150.3	170.7	-47.3	0	0	0	0	110.4
239	G	39.1	Very low	39.2	Very low	82 Å²	82	118.1 Å²	118.1	85%	0.845	80%	0.799	S	S	*	*			trans	-157.8	103.3	175.9	0	0	0	0	0	112.4
240	S	37	Very low	39.1	Very low	114 Å²	114	118.5 Å²	118.5	80%	0.797	80%	0.802	S	S	*	*			trans	-99.1	135.4	174.6	-177.2	0	0	0	0	109.9
241	S	42.9	Very low	38.8	Very low	123 Å²	123	117.2 Å²	117.2	86%	0.86	80%	0.797	S	S	*	*			trans	-150.5	112.2	168.1	-63.2	0	0	0	0	110.7
242	S	36.9	Very low	38.7	Very low	113 Å²	113	121.3 Å²	121.3	79%	0.79	80%	0.801	S	S	*	*			trans	-81.4	148.5	169.7	-49.2	0	0	0	0	111
243	C	37.3	Very low	38.4	Very low	131 Å²	131	120.2 Å²	120.2	89%	0.885	79%	0.791	S	S	*	*			trans	-138	121.9	156.7	59.7	0	0	0	0	110.4
244	S	36	Very low	38.3	Very low	106 Å²	106	121.2 Å²	121.2	74%	0.741	79%	0.792	S	S	*	*			trans	-113.9	156.5	177.2	-49	0	0	0	0	109.5
245	S	38.1	Very low	38.4	Very low	106 Å²	106	122.3 Å²	122.3	74%	0.741	79%	0.793	S	S	*	*				132.9	150.8	129.9	-51.9	0	0	0	0	116
246	L	38.4	Very low	38.3	Very low	153 Å²	153	125.4 Å²	125.4	80%	0.801	80%	0.796	S	S	*	*			trans	78.4	108	163.5	-44.8	-176.7	0	0	0	116.1
247	T	36.8	Very low	38.3	Very low	115 Å²	115	124 Å²	124	71%	0.706	79%	0.792	S	S	*	*			cis	93.8	113.8	33.8	69.1	0	0	0	0	116
248	S	42.3	Very low	38.3	Very low	112 Å²	112	122.9 Å²	122.9	78%	0.783	79%	0.791	S	S	*	*			trans	-170	112.3	148.4	-68.6	0	0	0	0	104.9
249	E	36.6	Very low	38.2	Very low	183 Å²	183	127.5 Å²	127.5	86%	0.855	79%	0.788	S	S	*	*				49.6	130.4	74.4	-68.8	-179.1	90.3	0	0	112.7
250	S	41.7	Very low	38.4	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	78%	0.778	S	S	*	*			cis	-158.5	179.1	-2.6	52.8	0	0	0	0	106.8
251	A	41.1	Very low	38.4	Very low	74 Å²	74	132.3 Å²	132.3	61%	0.612	78%	0.784	S	S	*	*			cis	-164.1	159.7	20.9	0	0	0	0	0	111.6
252	H	39.9	Very low	37.9	Very low	171 Å²	171	130.8 Å²	130.8	79%	0.792	78%	0.779	S	S	*	*			trans	45.8	149.3	145.1	-67.4	-49.8	0	0	0	122.5
253	N	37.5	Very low	37.7	Very low	115 Å²	115	130 Å²	130	62%	0.615	78%	0.78	S	S	*	*			cis	165.9	142.3	-23.1	-118.8	48.7	0	0	0	105.9
254	D	39.8	Very low	37.7	Very low	142 Å²	142	128.5 Å²	128.5	76%	0.759	78%	0.776	S	S	*	*			trans	64	154.7	156.6	-40.5	-34.3	0	0	0	116.3
255	D	39.2	Very low	37.7	Very low	155 Å²	155	129.3 Å²	129.3	83%	0.829	78%	0.776	S	S	*	*			cis	-146.4	178.4	2.5	-163.5	5.2	0	0	0	110.7
256	D	36.9	Very low	37.3	Very low	160 Å²	160	131.9 Å²	131.9	86%	0.856	78%	0.781	S	S	*	*			trans	-66.5	165.2	179.6	-99	-64.5	0	0	0	116.9
257	G	34.7	Very low	37	Very low	72 Å²	72	129.2 Å²	129.2	74%	0.742	78%	0.781	S	S	*	*			trans	160.1	83.4	160.4	0	0	0	0	0	121.8
258	A	36.9	Very low	36.8	Very low	106 Å²	106	128.9 Å²	128.9	88%	0.876	79%	0.79	S	S	*	*			trans	27	132.2	145.6	0	0	0	0	0	124.9
259	R	32.9	Very low	36.3	Very low	231 Å²	231	128.2 Å²	128.2	87%	0.872	79%	0.791	S	S	*	*			trans	-48	177.3	154.5	-75.8	170.8	67.1	-159.1	4	115.1
260	P	43.2	Very low	36.2	Very low	96 Å²	96	124.3 Å²	124.3	62%	0.623	79%	0.79	S	S	*	*			cis	-134	178.6	-36.8	36.9	-20.7	0	0	0	112.5
261	H	37.8	Very low	35.8	Very low	201 Å²	201	123.9 Å²	123.9	93%	0.931	79%	0.793	S	S	*	*			trans	-138.1	144.7	159.9	-113.5	-89.9	0	0	0	113.5
262	A	32.7	Very low	35.7	Very low	90 Å²	90	124.5 Å²	124.5	74%	0.744	80%	0.799	S	S	*	*			trans	-114.8	171.6	-179.5	0	0	0	0	0	111.7
263	A	32.7	Very low	35.7	Very low	98 Å²	98	123.4 Å²	123.4	81%	0.81	80%	0.804	S	S	*	*			trans	77.8	101.4	163	0	0	0	0	0	119.8
264	A	37	Very low	35.6	Very low	98 Å²	98	121 Å²	121	81%	0.81	81%	0.807	S	S	*	*			trans	-164.7	101.6	139.5	0	0	0	0	0	106.4
265	V	34.6	Very low	35.4	Very low	123 Å²	123	121.7 Å²	121.7	75%	0.745	81%	0.81	S	S	*	*				76	102.5	61.7	-177.4	0	0	0	0	113.4
266	L	31.6	Very low	35.2	Very low	160 Å²	160	122.2 Å²	122.2	84%	0.838	81%	0.813	S	S	*	*			trans	64.4	116.6	151.3	-67.5	168	0	0	0	122
267	A	30.5	Very low	35.2	Very low	97 Å²	97	122.7 Å²	122.7	80%	0.802	82%	0.816	S	S	*	*				62.3	107.4	126.3	0	0	0	0	0	120.9
268	A	33.8	Very low	35.2	Very low	108 Å²	108	128.8 Å²	128.8	89%	0.893	82%	0.818	S	S	*	*			trans	-142.8	129.6	140.9	0	0	0	0	0	108.8
269	A	32.2	Very low	35.4	Very low	99 Å²	99	133.8 Å²	133.8	82%	0.818	81%	0.814	S	S	*	*			trans	-110.8	158.1	-177.3	0	0	0	0	0	111.7
270	A	33.2	Very low	35.4	Very low	101 Å²	101	127.2 Å²	127.2	84%	0.835	82%	0.819	S	S	*	*			trans	59.6	107.4	160.5	0	0	0	0	0	118.7
271	A	34.1	Very low	35.1	Very low	104 Å²	104	126.5 Å²	126.5	86%	0.86	82%	0.821	S	S	*	*				167.4	113.6	110.7	0	0	0	0	0	112.2
272	A	38.3	Very low	35.3	Very low	88 Å²	88	122.8 Å²	122.8	73%	0.727	81%	0.812	S	S	*	*			trans	156.4	85.5	156.1	0	0	0	0	0	108
273	T	39.8	Very low	35.6	Very low	148 Å²	148	125 Å²	125	91%	0.908	82%	0.816	S	S	*	*				46.1	105.8	87.2	67.5	0	0	0	0	114
274	G	35.3	Very low	36.1	Very low	65 Å²	65	126.6 Å²	126.6	67%	0.67	82%	0.816	S	S	*	*			trans	153.6	85.1	173.8	0	0	0	0	0	112.7
275	D	35.3	Very low	36.7	Very low	155 Å²	155	125.6 Å²	125.6	83%	0.829	80%	0.8	S	S	*	*			trans	45.1	102.5	145.5	-44.4	-31.6	0	0	0	119.8
276	D	36.4	Very low	37.3	Very low	167 Å²	167	128 Å²	128	89%	0.893	81%	0.805	S	S	*	*				177.5	114.2	120.8	-100.5	-32.5	0	0	0	112	Y278	D276-Y278 PolarHBondContact O-N 2.81Å
277	D	36	Very low	38	Very low	170 Å²	170	129.2 Å²	129.2	91%	0.909	81%	0.807	S	S	*	*			trans	-81.4	85.8	-177.3	-78.1	-54.9	0	0	0	113.7
278	Y	35.5	Very low	39	Very low	200 Å²	200	131.6 Å²	131.6	78%	0.784	80%	0.801	S	S	*	*			trans	-158.4	131.4	159.5	-147	-106.3	0	0	0	112.6	D276	D276-Y278 PolarHBondContact O-N 2.81Å
279	W	41.3	Very low	39.9	Very low	210 Å²	210	130.2 Å²	130.2	80%	0.795	78%	0.779	S	S	*	*			trans	114.3	-5.9	175.7	-69.6	107.2	0	0	0	118.5	A281	W279-A281 VanDerWaalsContact C-N 3.31Å; W279-A281 PolarHBondContact O-N 2.99Å
280	G	32.3	Very low	40.6	Very low	94 Å²	94	132.1 Å²	132.1	97%	0.969	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	58.6	-178.8	0	0	0	0	0	117.1
281	A	36.8	Very low	41.2	Very low	81 Å²	81	133.2 Å²	133.2	67%	0.669	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142	5.6	173.6	0	0	0	0	0	115.4	W279 T283	W279-A281 VanDerWaalsContact C-N 3.31Å; W279-A281 PolarHBondContact O-N 2.99Å; A281-T283 PolarHBondContact O-N 2.76Å; A281-T283 VanDerWaalsContact O-N 3.12Å
282	V	41.2	Very low	42.1	Very low	123 Å²	123	133.7 Å²	133.7	75%	0.745	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	68.5	-177.9	-171.5	0	0	0	0	111.3
283	T	39.8	Very low	42.6	Very low	136 Å²	136	134.9 Å²	134.9	83%	0.834	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155	-1.1	168.9	2.8	0	0	0	0	117.9	A281	A281-T283 PolarHBondContact O-N 2.76Å; A281-T283 VanDerWaalsContact O-N 3.12Å
284	T	44.2	Very low	43	Very low	131 Å²	131	133.9 Å²	133.9	80%	0.804	72%	0.718	S	S	*	*	S	Bend	trans	-128.9	9.7	-171.2	-42.3	0	0	0	0	115.7
285	T	49.3	Very low	43.6	Very low	78 Å²	78	136.5 Å²	136.5	48%	0.479	71%	0.713	S	S	.	*			trans	-119.2	34.2	-178	-36.3	0	0	0	0	113.6	Q288 N289	T285-Q288 HydrophobicContact CG2-CB 4.15Å; T285-N289 PolarHBondContact O-ND2 3.35Å
286	M	46.2	Very low	44	Very low	172 Å²	172	133.7 Å²	133.7	85%	0.847	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-17.2	-177.2	-149.7	163.8	-177.8	0	0	114.5
287	Q	47.2	Very low	44.3	Very low	186 Å²	186	130.8 Å²	130.8	87%	0.869	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-26.8	174.5	-80	177.1	-19.3	0	0	114.4	N289	Q287-N289 VanDerWaalsContact C-N 3.34Å
288	Q	50.7	Low	44.5	Very low	148 Å²	148	130.2 Å²	130.2	69%	0.692	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-23.4	173.9	-81.1	177.3	-20.4	0	0	113.5	T285 H290 H291	T285-Q288 HydrophobicContact CG2-CB 4.15Å; Q288-H290 VanDerWaalsContact C-N 3.29Å; Q288-H290 PolarHBondContact O-N 2.99Å; Q288-H291 PolarHBondContact O-N 2.71Å
289	N	52.8	Low	44.9	Very low	79 Å²	79	125.4 Å²	125.4	42%	0.422	66%	0.656	S	S	.	*	H	α-helix	trans	-61.7	-33.1	179.2	-101.6	-68	0	0	0	113.2	T285 Q287 H291 Q292 Q293	T285-N289 PolarHBondContact O-ND2 3.35Å; Q287-N289 VanDerWaalsContact C-N 3.34Å; N289-H291 VanDerWaalsContact C-N 3.34Å; N289-H291 PolarHBondContact O-N 2.8Å; N289-Q292 PolarHBondContact O-N 2.8Å; N289-Q293 VanDerWaalsContact O-CB 3.28Å; N289-Q293 WeakPolarHBondContact O-CB 3.04Å; N289-Q293 PolarHBondContact O-N 2.74Å
290	H	47.3	Very low	44.9	Very low	138 Å²	138	120.2 Å²	120.2	64%	0.639	64%	0.639	S	S	*	*	H	α-helix	trans	-62.2	-37.5	-178.2	-101.8	-71.8	0	0	0	113.5	Q288 Q294	Q288-H290 VanDerWaalsContact C-N 3.29Å; Q288-H290 PolarHBondContact O-N 2.99Å; H290-Q294 PolarHBondContact O-N 2.75Å
291	H	46.7	Very low	45.7	Very low	124 Å²	124	120.6 Å²	120.6	57%	0.574	62%	0.619	S	S	*	*	H	α-helix	trans	-76.3	-36.1	179.1	-161.5	64.7	0	0	0	111.8	Q288 N289 Q293 Q294 Q295	Q288-H291 PolarHBondContact O-N 2.71Å; N289-H291 VanDerWaalsContact C-N 3.34Å; N289-H291 PolarHBondContact O-N 2.8Å; H291-Q293 VanDerWaalsContact C-N 3.27Å; H291-Q293 PolarHBondContact O-N 2.9Å; H291-Q294 PolarHBondContact O-N 3.2Å; H291-Q295 PolarHBondContact O-N 3.34Å
292	Q	51.6	Low	45.8	Very low	115 Å²	115	119.9 Å²	119.9	54%	0.537	60%	0.601	S	S	.	*	H	α-helix	trans	-69.3	-27.2	174.5	-160.1	169	41.2	0	0	112.4	N289 Q296	N289-Q292 PolarHBondContact O-N 2.8Å; Q292-Q296 WeakPolarHBondContact O-CG 3.46Å; Q292-Q296 PolarHBondContact O-N 2.81Å; Q292-Q296 PolarHBondContact O-NE2 3.42Å
293	Q	49.8	Very low	46	Very low	112 Å²	112	114.9 Å²	114.9	52%	0.523	57%	0.568	S	S	.	*	H	α-helix	trans	-76	-27.9	176.1	-163.4	161.3	51.1	0	0	112.9	N289 H291 N297	N289-Q293 VanDerWaalsContact O-CB 3.28Å; N289-Q293 WeakPolarHBondContact O-CB 3.04Å; N289-Q293 PolarHBondContact O-N 2.74Å; H291-Q293 VanDerWaalsContact C-N 3.27Å; H291-Q293 PolarHBondContact O-N 2.9Å; Q293-N297 PolarHBondContact O-N 2.66Å
294	Q	46.8	Very low	46.6	Very low	128 Å²	128	110.6 Å²	110.6	60%	0.598	54%	0.544	S	S	*	.	H	α-helix	trans	-67.9	-45.3	170.9	-77.9	179.9	-26.3	0	0	112.1	H290 H291 Q296 N297 E298	H290-Q294 PolarHBondContact O-N 2.75Å; H291-Q294 PolarHBondContact O-N 3.2Å; Q294-Q296 VanDerWaalsContact C-N 3.28Å; Q294-Q296 PolarHBondContact O-N 3.34Å; Q294-N297 WeakPolarHBondContact O-CA 3.29Å; Q294-N297 WeakPolarHBondContact O-CB 3.43Å; Q294-N297 PolarHBondContact O-N 3.4Å; Q294-E298 PolarHBondContact O-N 3.28Å
295	Q	48.7	Very low	46.9	Very low	119 Å²	119	109.5 Å²	109.5	56%	0.556	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-34	175.5	-65.1	-178.8	8	0	0	112.4	H291 N297 E298 Q299	H291-Q295 PolarHBondContact O-N 3.34Å; Q295-N297 PolarHBondContact O-N 2.74Å; Q295-E298 PolarHBondContact O-N 2.76Å; Q295-Q299 PolarHBondContact O-N 2.94Å
296	Q	43.5	Very low	46.7	Very low	96 Å²	96	108.9 Å²	108.9	45%	0.449	54%	0.54	S	S	.	.	H	α-helix	trans	-65.2	-26.9	171.6	-75.3	171.1	40.9	0	0	112.9	Q292 Q294 F300	Q292-Q296 WeakPolarHBondContact O-CG 3.46Å; Q292-Q296 PolarHBondContact O-N 2.81Å; Q292-Q296 PolarHBondContact O-NE2 3.42Å; Q294-Q296 VanDerWaalsContact C-N 3.28Å; Q294-Q296 PolarHBondContact O-N 3.34Å; Q296-F300 PolarHBondContact O-N 2.96Å
297	N	43.6	Very low	46.9	Very low	106 Å²	106	102 Å²	102	57%	0.567	51%	0.509	S	S	*	.	H	α-helix	trans	-77.1	-35.6	177.1	-116.2	35.4	0	0	0	112.5	Q293 Q294 Q295 Q299 F300	Q293-N297 PolarHBondContact O-N 2.66Å; Q294-N297 WeakPolarHBondContact O-CA 3.29Å; Q294-N297 WeakPolarHBondContact O-CB 3.43Å; Q294-N297 PolarHBondContact O-N 3.4Å; Q295-N297 PolarHBondContact O-N 2.74Å; N297-Q299 VanDerWaalsContact C-N 3.35Å; N297-F300 WeakPolarHBondContact O-CB 3.29Å; N297-F300 PolarHBondContact O-N 3.13Å
298	E	40.1	Very low	46.8	Very low	158 Å²	158	93.6 Å²	93.6	74%	0.738	47%	0.472	S	S	*	.	H	α-helix	trans	-70.2	-34	172.3	-65.5	-170.8	127.9	0	0	111.8	Q294 Q295 F300	Q294-E298 PolarHBondContact O-N 3.28Å; Q295-E298 PolarHBondContact O-N 2.76Å; E298-F300 PolarHBondContact O-N 2.68Å
299	Q	42.4	Very low	46.4	Very low	99 Å²	99	92.6 Å²	92.6	46%	0.463	47%	0.47	S	S	.	.	H	α-helix	trans	-67.7	-14.8	168.7	-166.5	178.7	-18.2	0	0	112.8	Q295 N297 F302	Q295-Q299 PolarHBondContact O-N 2.94Å; N297-Q299 VanDerWaalsContact C-N 3.35Å; Q299-F302 WeakPolarHBondContact O-CB 3.31Å
300	F	42.7	Very low	46	Very low	102 Å²	102	96 Å²	96	45%	0.447	48%	0.483	S	S	.	.	H	α-helix	trans	-76.9	-42.1	-176.8	-158.1	-104.7	0	0	0	112.2	R130 Q296 N297 E298 F302 W303	R130-F300 HydrophobicContact CG-CE2 4.32Å; Q296-F300 PolarHBondContact O-N 2.96Å; N297-F300 WeakPolarHBondContact O-CB 3.29Å; N297-F300 PolarHBondContact O-N 3.13Å; E298-F300 PolarHBondContact O-N 2.68Å; F300-F302 PolarHBondContact O-N 3.36Å; F300-W303 PolarHBondContact O-N 2.81Å; F300-W303 VanDerWaalsContact O-N 3.09Å
301	D	48.9	Very low	45.9	Very low	102 Å²	102	94.1 Å²	94.1	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-63.1	-26.9	174.5	-74	-33.7	0	0	0	112.2	R179 W303 S304 S307	R179-D301 PolarHBondContact NH2-O 2.89Å; D301-W303 PolarHBondContact O-N 3.03Å; D301-S304 PolarHBondContact O-N 3.25Å; D301-S307 VanDerWaalsContact O-CB 3.28Å; D301-S307 WeakPolarHBondContact O-CB 3.49Å; D301-S307 PolarHBondContact O-OG 3.45Å
302	F	38.8	Very low	45.6	Very low	66 Å²	66	91.8 Å²	91.8	29%	0.289	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.8	175.2	-170.9	-91.5	0	0	0	114	K175 D176 R179 Q299 F300	K175-F302 HydrophobicContact CB-CE1 4.26Å; D176-F302 WeakPolarHBondContact OD1-CZ 3.43Å; R179-F302 VanDerWaalsContact CD-O 3.25Å; R179-F302 WeakPolarHBondContact CD-O 3.16Å; R179-F302 PolarHBondContact NE-O 3.49Å; R179-F302 PolarHBondContact NH1-O 2.88Å; R179-F302 PolarHBondContact NH2-O 3.43Å; Q299-F302 WeakPolarHBondContact O-CB 3.31Å; F300-F302 PolarHBondContact O-N 3.36Å
303	W	44.9	Very low	45.2	Very low	17 Å²	17	91.8 Å²	91.8	6%	0.064	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-12.1	175.9	-68.3	94.7	0	0	0	114.9	S129 K175 M178 M183 F300 D301 T305	S129-W303 VanDerWaalsContact OG-CG 3.27Å; K175-W303 HydrophobicContact CB-CH2 4.18Å; K175-W303 HydrophobicContact CB-CZ2 4.1Å; K175-W303 HydrophobicContact CD-CZ2 4.29Å; K175-W303 HydrophobicContact CG-CH2 4.17Å; K175-W303 HydrophobicContact CG-CZ2 3.92Å; M178-W303 HydrophobicContact CE-CH2 4.35Å; M178-W303 HydrophobicContact CE-CZ3 4.34Å; M178-W303 HydrophobicContact SD-CH2 4.45Å; M183-W303 HydrophobicContact SD-CE3 4.18Å; M183-W303 HydrophobicContact SD-CZ3 4.01Å; F300-W303 PolarHBondContact O-N 2.81Å; F300-W303 VanDerWaalsContact O-N 3.09Å; D301-W303 PolarHBondContact O-N 3.03Å; W303-T305 PolarHBondContact O-N 3.36Å
304	S	52.6	Low	45.1	Very low	47 Å²	47	90.7 Å²	90.7	33%	0.329	48%	0.476	S	S	.	.			trans	-61.4	132.3	170.8	-175.4	0	0	0	0	111.3	R179 D301 A306 S307 A308	R179-S304 PolarHBondContact NH1-O 2.8Å; R179-S304 PolarHBondContact NH2-O 3.38Å; D301-S304 PolarHBondContact O-N 3.25Å; S304-A306 VanDerWaalsContact C-N 3.27Å; S304-A306 PolarHBondContact O-N 2.97Å; S304-S307 PolarHBondContact O-N 3.13Å; S304-A308 PolarHBondContact O-N 3.09Å
305	T	50.9	Low	44.7	Very low	108 Å²	108	86.1 Å²	86.1	66%	0.663	46%	0.459	S	S	*	.	H	α-helix	trans	-66	-29.5	177.5	48.2	0	0	0	0	112.2	W303 A308	W303-T305 PolarHBondContact O-N 3.36Å; T305-A308 WeakPolarHBondContact O-CB 3.28Å; T305-A308 PolarHBondContact O-N 3.04Å
306	A	45.2	Very low	44.2	Very low	65 Å²	65	84.8 Å²	84.8	54%	0.537	47%	0.469	S	S	.	.	H	α-helix	trans	-62.5	-42.3	175.6	0	0	0	0	0	112.1	S304 A308	S304-A306 VanDerWaalsContact C-N 3.27Å; S304-A306 PolarHBondContact O-N 2.97Å; A306-A308 VanDerWaalsContact C-N 3.29Å; A306-A308 PolarHBondContact O-N 2.77Å
307	S	49.5	Very low	44.3	Very low	26 Å²	26	84.2 Å²	84.2	18%	0.182	48%	0.481	C	S	.	.	H	α-helix	trans	-73.9	-18.3	176.8	-51.3	0	0	0	0	113	R179 D301 S304 Q310 H311	R179-S307 VanDerWaalsContact NH2-C 3.31Å; D301-S307 VanDerWaalsContact O-CB 3.28Å; D301-S307 WeakPolarHBondContact O-CB 3.49Å; D301-S307 PolarHBondContact O-OG 3.45Å; S304-S307 PolarHBondContact O-N 3.13Å; S307-Q310 PolarHBondContact O-N 3.15Å; S307-H311 PolarHBondContact O-CD2 3.27Å; S307-H311 PolarHBondContact O-N 3.2Å
308	A	44.6	Very low	44.2	Very low	11 Å²	11	83.1 Å²	83.1	9%	0.091	48%	0.475	C	S	.	.	H	α-helix	trans	-68.2	-39	177.6	0	0	0	0	0	111.7	R179 F180 S304 T305 A306 Q310 H311 L312	R179-A308 HydrophobicContact CG-CB 4.34Å; F180-A308 HydrophobicContact CE1-CB 4.43Å; S304-A308 PolarHBondContact O-N 3.09Å; T305-A308 WeakPolarHBondContact O-CB 3.28Å; T305-A308 PolarHBondContact O-N 3.04Å; A306-A308 VanDerWaalsContact C-N 3.29Å; A306-A308 PolarHBondContact O-N 2.77Å; A308-Q310 VanDerWaalsContact C-N 3.31Å; A308-Q310 PolarHBondContact O-N 2.61Å; A308-H311 PolarHBondContact O-N 3.48Å; A308-L312 PolarHBondContact O-N 2.87Å; A308-L312 VanDerWaalsContact O-N 3.08Å
309	L	43.1	Very low	44.5	Very low	126 Å²	126	83.5 Å²	83.5	66%	0.66	48%	0.477	S	S	*	.	H	α-helix	trans	-66.2	-30.6	178.4	-71.6	170.1	0	0	0	113	L312	L309-L312 HydrophobicContact CD2-CD1 4.16Å
310	Q	45.3	Very low	44.8	Very low	150 Å²	150	84.8 Å²	84.8	70%	0.701	49%	0.486	S	S	*	.	H	α-helix	trans	-76.3	-23.4	175.9	-66.9	-173.5	-12.8	0	0	113.4	S307 A308 T313	S307-Q310 PolarHBondContact O-N 3.15Å; A308-Q310 VanDerWaalsContact C-N 3.31Å; A308-Q310 PolarHBondContact O-N 2.61Å; Q310-T313 PolarHBondContact O-OG1 3.42Å; Q310-T313 VanDerWaalsContact O-OG1 3.05Å
311	H	44.2	Very low	44.7	Very low	99 Å²	99	83.5 Å²	83.5	46%	0.458	48%	0.484	S	S	.	.	H	α-helix	trans	-90.8	-21	175.6	-79.1	-65	0	0	0	114	F180 S307 A308 T313 T314 A315	F180-H311 HydrophobicContact CE1-CB 4.03Å; F180-H311 HydrophobicContact CZ-CB 3.97Å; S307-H311 PolarHBondContact O-CD2 3.27Å; S307-H311 PolarHBondContact O-N 3.2Å; A308-H311 PolarHBondContact O-N 3.48Å; H311-T313 PolarHBondContact O-N 3.28Å; H311-T314 WeakPolarHBondContact CA-OG1 3.3Å; H311-T314 PolarHBondContact O-N 3.35Å; H311-T314 PolarHBondContact O-OG1 3.03Å; H311-T314 VanDerWaalsContact O-OG1 3.11Å; H311-A315 WeakPolarHBondContact O-CB 3.21Å; H311-A315 PolarHBondContact O-N 3.48Å
312	L	40.1	Very low	44.5	Very low	76 Å²	76	83.2 Å²	83.2	40%	0.398	49%	0.486	S	S	.	.	H	α-helix	trans	-59.5	-31.8	174.6	-87.3	158.8	0	0	0	112.9	F180 A308 L309 T314 A316	F180-L312 HydrophobicContact CD1-CD2 4.15Å; F180-L312 HydrophobicContact CD1-CG 3.96Å; F180-L312 HydrophobicContact CE1-CG 4.4Å; A308-L312 PolarHBondContact O-N 2.87Å; A308-L312 VanDerWaalsContact O-N 3.08Å; L309-L312 HydrophobicContact CD2-CD1 4.16Å; L312-T314 VanDerWaalsContact C-N 3.3Å; L312-T314 PolarHBondContact O-N 3.04Å; L312-A316 WeakPolarHBondContact O-CB 3.47Å; L312-A316 PolarHBondContact O-N 3.1Å
313	T	43.9	Very low	44.5	Very low	114 Å²	114	82 Å²	82	70%	0.699	49%	0.492	S	S	*	.	H	α-helix	trans	-73.7	-17.2	175.5	57.6	0	0	0	0	114	Q310 H311	Q310-T313 PolarHBondContact O-OG1 3.42Å; Q310-T313 VanDerWaalsContact O-OG1 3.05Å; H311-T313 PolarHBondContact O-N 3.28Å
314	T	47.4	Very low	44.3	Very low	90 Å²	90	86.8 Å²	86.8	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-104.6	-32.8	178	28.3	0	0	0	0	112.8	H311 L312 A317	H311-T314 WeakPolarHBondContact CA-OG1 3.3Å; H311-T314 PolarHBondContact O-N 3.35Å; H311-T314 PolarHBondContact O-OG1 3.03Å; H311-T314 VanDerWaalsContact O-OG1 3.11Å; L312-T314 VanDerWaalsContact C-N 3.3Å; L312-T314 PolarHBondContact O-N 3.04Å; T314-A317 PolarHBondContact O-N 3.31Å
315	A	39	Very low	43.7	Very low	31 Å²	31	86.1 Å²	86.1	26%	0.256	50%	0.504	S	S	.	.	H	α-helix	trans	-74.2	-22.5	177.3	0	0	0	0	0	113.4	H311 A317 D318	H311-A315 WeakPolarHBondContact O-CB 3.21Å; H311-A315 PolarHBondContact O-N 3.48Å; A315-A317 PolarHBondContact O-N 3.46Å; A315-D318 WeakPolarHBondContact O-CB 3.39Å; A315-D318 PolarHBondContact O-N 3.04Å
316	A	37.9	Very low	43.2	Very low	91 Å²	91	87.2 Å²	87.2	75%	0.752	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-7.5	173.6	0	0	0	0	0	114.3	L312	L312-A316 WeakPolarHBondContact O-CB 3.47Å; L312-A316 PolarHBondContact O-N 3.1Å
317	A	44	Very low	42.7	Very low	85 Å²	85	87.1 Å²	87.1	70%	0.702	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-4.9	173.6	0	0	0	0	0	113.9	T314 A315	T314-A317 PolarHBondContact O-N 3.31Å; A315-A317 PolarHBondContact O-N 3.46Å
318	D	41.7	Very low	42.1	Very low	83 Å²	83	90.9 Å²	90.9	44%	0.444	52%	0.52	S	S	.	.			trans	-93.1	102.6	-173.5	-156.4	-4.5	0	0	0	111.9	A315 D320 L321	A315-D318 WeakPolarHBondContact O-CB 3.39Å; A315-D318 PolarHBondContact O-N 3.04Å; D318-D320 PolarHBondContact O-N 3.29Å; D318-L321 PolarHBondContact O-N 3.26Å
319	Q	46.9	Very low	41.8	Very low	166 Å²	166	93.6 Å²	93.6	78%	0.776	54%	0.538	S	S	*	.	H	α-helix	trans	-64	-20.5	-179.6	-68.2	-178.1	-15.8	0	0	112.8	L321 T322 G323	Q319-L321 PolarHBondContact O-N 3.41Å; Q319-T322 PolarHBondContact O-N 2.85Å; Q319-T322 PolarHBondContact O-OG1 3.4Å; Q319-T322 VanDerWaalsContact O-OG1 3.1Å; Q319-G323 PolarHBondContact O-N 3.36Å
320	D	49	Very low	41.5	Very low	125 Å²	125	94.8 Å²	94.8	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-73.3	-0.5	176.2	-98.3	-5	0	0	0	113.8	D318 W324	D318-D320 PolarHBondContact O-N 3.29Å; D320-W324 PolarHBondContact O-NE1 2.9Å
321	L	39.9	Very low	41	Very low	75 Å²	75	94.5 Å²	94.5	39%	0.393	55%	0.549	S	S	.	.	H	α-helix	trans	-100.3	-32.4	171.8	-105.3	151.3	0	0	0	113.1	D318 Q319	D318-L321 PolarHBondContact O-N 3.26Å; Q319-L321 PolarHBondContact O-N 3.41Å
322	T	45	Very low	40.3	Very low	96 Å²	96	93.4 Å²	93.4	59%	0.589	56%	0.564	S	S	*	*	H	α-helix	trans	-76.8	-39.1	-178.4	53.3	0	0	0	0	112.5	Q319 W324 V325	Q319-T322 PolarHBondContact O-N 2.85Å; Q319-T322 PolarHBondContact O-OG1 3.4Å; Q319-T322 VanDerWaalsContact O-OG1 3.1Å; T322-W324 PolarHBondContact O-N 3.46Å; T322-V325 WeakPolarHBondContact O-CB 3.36Å; T322-V325 PolarHBondContact O-N 3.09Å; T322-V325 VanDerWaalsContact O-N 3.14Å
323	G	38.8	Very low	40	Very low	41 Å²	41	97.4 Å²	97.4	42%	0.423	58%	0.584	S	S	.	*	H	α-helix	trans	-61.6	-25.5	179.1	0	0	0	0	0	114.5	Q319	Q319-G323 PolarHBondContact O-N 3.36Å
324	W	40.8	Very low	39.3	Very low	117 Å²	117	99.2 Å²	99.2	44%	0.443	59%	0.589	S	S	.	*	H	α-helix	trans	-77.3	-20.7	178.3	-72.2	79.4	0	0	0	113.8	R173 D320 T322 Q326 F328	R173-W324 VanDerWaalsContact CZ-CH2 3.48Å; R173-W324 VanDerWaalsContact NH2-CZ3 3.27Å; D320-W324 PolarHBondContact O-NE1 2.9Å; T322-W324 PolarHBondContact O-N 3.46Å; W324-Q326 VanDerWaalsContact C-N 3.31Å; W324-F328 WeakPolarHBondContact O-CD2 3.27Å; W324-F328 VanDerWaalsContact O-CE2 3.26Å; W324-F328 WeakPolarHBondContact O-CE2 3.19Å
325	V	41.1	Very low	38.5	Very low	33 Å²	33	100.7 Å²	100.7	20%	0.2	60%	0.603	C	S	.	*	H	α-helix	trans	-65.6	-38.8	175.8	176.5	0	0	0	0	110.3	T322 G327 F328 M351	T322-V325 WeakPolarHBondContact O-CB 3.36Å; T322-V325 PolarHBondContact O-N 3.09Å; T322-V325 VanDerWaalsContact O-N 3.14Å; V325-G327 VanDerWaalsContact C-N 3.31Å; V325-G327 PolarHBondContact O-N 3.46Å; V325-F328 PolarHBondContact O-N 3.22Å; V325-M351 HydrophobicContact CG1-CB 3.49Å; V325-M351 VanDerWaalsContact CG1-CB 3.49Å; V325-M351 HydrophobicContact CG1-SD 4.47Å; V325-M351 HydrophobicContact CG2-CB 4.28Å; V325-M351 HydrophobicContact CG2-SD 4.39Å
326	Q	39.6	Very low	37.9	Very low	132 Å²	132	102.8 Å²	102.8	62%	0.617	63%	0.628	S	S	*	*	H	α-helix	trans	-66.9	-29.2	-177.2	-70.4	175.3	-36.6	0	0	113.2	W324 F328 S329	W324-Q326 VanDerWaalsContact C-N 3.31Å; Q326-F328 PolarHBondContact O-N 2.92Å; Q326-S329 PolarHBondContact O-N 3.3Å
327	G	35.7	Very low	37.8	Very low	62 Å²	62	103.8 Å²	103.8	64%	0.639	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-3.8	-179.3	0	0	0	0	0	116	V325	V325-G327 VanDerWaalsContact C-N 3.31Å; V325-G327 PolarHBondContact O-N 3.46Å
328	F	36.2	Very low	37.1	Very low	105 Å²	105	105.5 Å²	105.5	46%	0.461	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.3	-5.5	179.1	-71.9	-75.9	0	0	0	114.4	L165 W324 V325 Q326	L165-F328 HydrophobicContact CD2-CE1 4.23Å; L165-F328 HydrophobicContact CD2-CE2 4.11Å; L165-F328 HydrophobicContact CD2-CZ 3.49Å; L165-F328 VanDerWaalsContact CD2-CZ 3.49Å; W324-F328 WeakPolarHBondContact O-CD2 3.27Å; W324-F328 VanDerWaalsContact O-CE2 3.26Å; W324-F328 WeakPolarHBondContact O-CE2 3.19Å; V325-F328 PolarHBondContact O-N 3.22Å; Q326-F328 PolarHBondContact O-N 2.92Å
329	S	38.3	Very low	36.9	Very low	68 Å²	68	107 Å²	107	48%	0.476	65%	0.653	S	S	.	*	S	Bend	trans	-86.5	-23.9	-172	-61.4	0	0	0	0	115.1	Q326	Q326-S329 PolarHBondContact O-N 3.3Å
330	D	36.7	Very low	36.7	Very low	151 Å²	151	103.1 Å²	103.1	81%	0.807	64%	0.637	S	S	*	*	S	Bend	trans	-93.9	-18.1	-167.4	-76.4	-36.2	0	0	0	115.4
331	D	34.6	Very low	36.3	Very low	145 Å²	145	101.6 Å²	101.6	78%	0.775	64%	0.637	S	S	*	*	S	Bend	trans	-107.3	66.6	-172.8	-85.7	-35.5	0	0	0	114.8	I333	D331-I333 PolarHBondContact O-N 2.68Å
332	G	29.8	Very low	36.6	Very low	76 Å²	76	99 Å²	99	78%	0.784	62%	0.623	S	S	*	*				59.6	-0.5	128.5	0	0	0	0	0	124	L334	G332-L334 PolarHBondContact O-N 3.23Å; G332-L334 VanDerWaalsContact O-N 3.08Å
333	I	34.1	Very low	36.8	Very low	159 Å²	159	98.5 Å²	98.5	82%	0.815	61%	0.611	S	S	*	*			trans	-89.2	66.2	-176.4	-50	-178.3	0	0	0	112.5	D331	D331-I333 PolarHBondContact O-N 2.68Å
334	L	29.4	Very low	37.2	Very low	152 Å²	152	98.7 Å²	98.7	80%	0.796	61%	0.605	S	S	*	*			trans	-108.8	73.3	173.3	-71.2	177.1	0	0	0	112.3	G332 L345	G332-L334 PolarHBondContact O-N 3.23Å; G332-L334 VanDerWaalsContact O-N 3.08Å; L334-L345 HydrophobicContact CD2-CD1 4.28Å
335	S	29	Very low	36.7	Very low	121 Å²	121	98 Å²	98	85%	0.846	61%	0.61	S	S	*	*			trans	-167.9	107.7	164.2	-176.7	0	0	0	0	111.1
336	G	28.4	Very low	36.7	Very low	75 Å²	75	101.9 Å²	101.9	77%	0.773	63%	0.629	S	S	*	*	S	Bend	trans	161.3	73.9	176.8	0	0	0	0	0	117.4
337	S	34.1	Very low	36.8	Very low	113 Å²	113	96.5 Å²	96.5	79%	0.79	61%	0.605	S	S	*	*			trans	44.4	76	152.3	-168.7	0	0	0	0	119.4	S339	S337-S339 PolarHBondContact O-N 2.91Å
338	S	30.5	Very low	37.1	Very low	120 Å²	120	96.1 Å²	96.1	84%	0.839	59%	0.588	S	S	*	*	S	Bend		29.4	83.2	128.6	-173.3	0	0	0	0	119.6
339	S	37.6	Very low	37.5	Very low	114 Å²	114	99.2 Å²	99.2	80%	0.797	60%	0.596	S	S	*	*	S	Bend	trans	172.7	-21.9	140.6	57.4	0	0	0	0	111.7	S337	S337-S339 PolarHBondContact O-N 2.91Å
340	D	42.3	Very low	37.8	Very low	85 Å²	85	105.6 Å²	105.6	46%	0.455	61%	0.61	S	S	.	*			trans	-125.6	13.4	-153.7	-126.7	4.4	0	0	0	114.2	R157 L342	R157-D340 IonicContact CZ-OD2 3.57Å; R157-D340 IonicContact NH1-OD1 3.15Å; R157-D340 IonicContact NH1-OD2 2.74Å; R157-D340 PolarHBondContact NH1-OD2 2.94Å; R157-D340 IonicContact NH2-OD1 3.74Å; R157-D340 IonicContact NH2-OD2 3.42Å; R157-D340 PolarHBondContact NH2-OD2 3.28Å; D340-L342 PolarHBondContact O-N 3.05Å
341	S	40.8	Very low	38	Very low	93 Å²	93	101.5 Å²	101.5	65%	0.65	59%	0.587	S	S	*	*			trans	-72	107.5	171	-165.3	0	0	0	0	108.4	W343	S341-W343 WeakPolarHBondContact CB-O 3.28Å; S341-W343 CarbonylContact O-C 3.57Å; S341-W343 PolarHBondContact O-N 3.12Å; S341-W343 VanDerWaalsContact O-N 3.11Å; S341-W343 PolarHBondContact OG-O 2.88Å
342	L	46.9	Very low	38.1	Very low	21 Å²	21	102.8 Å²	102.8	11%	0.11	59%	0.588	C	S	.	*	S	Bend	trans	-59.6	-25.8	-176.7	-118.8	157	0	0	0	112.4	H161 W182 R189 D340	H161-L342 WeakPolarHBondContact NE2-CD1 3.48Å; W182-L342 HydrophobicContact CZ2-CD1 3.65Å; W182-L342 VanDerWaalsContact NE1-CD2 3.35Å; R189-L342 PolarHBondContact NH2-O 3.44Å; D340-L342 PolarHBondContact O-N 3.05Å
343	W	47.6	Very low	38.5	Very low	86 Å²	86	104.1 Å²	104.1	33%	0.326	58%	0.578	S	S	.	*	S	Bend	trans	-106.2	118.3	165.8	-46.9	108.4	0	0	0	108.9	L181 S341 D347 I348 M351	L181-W343 HydrophobicContact CB-CH2 4.19Å; S341-W343 WeakPolarHBondContact CB-O 3.28Å; S341-W343 CarbonylContact O-C 3.57Å; S341-W343 PolarHBondContact O-N 3.12Å; S341-W343 VanDerWaalsContact O-N 3.11Å; S341-W343 PolarHBondContact OG-O 2.88Å; W343-D347 HydrophobicContact CE3-CB 4.42Å; W343-I348 HydrophobicContact CB-CD1 4.37Å; W343-I348 HydrophobicContact CB-CG1 4.29Å; W343-M351 HydrophobicContact CE3-CE 4.29Å; W343-M351 HydrophobicContact CZ3-CE 3.72Å
344	S	46.9	Very low	38.7	Very low	44 Å²	44	101.2 Å²	101.2	31%	0.308	57%	0.566	S	S	.	*			trans	-72.7	161.7	159.7	66.2	0	0	0	0	109.5	D346 D347 I348	S344-D346 PolarHBondContact O-N 3.05Å; S344-D347 WeakPolarHBondContact CB-OD2 3.37Å; S344-D347 PolarHBondContact N-OD2 3.03Å; S344-D347 WeakPolarHBondContact O-CB 3.19Å; S344-D347 PolarHBondContact O-N 2.82Å; S344-D347 VanDerWaalsContact O-N 3.08Å; S344-D347 PolarHBondContact OG-N 2.74Å; S344-D347 VanDerWaalsContact OG-N 3.12Å; S344-D347 PolarHBondContact OG-OD2 2.93Å; S344-I348 PolarHBondContact O-N 2.86Å
345	L	32.1	Very low	39.2	Very low	103 Å²	103	98.4 Å²	98.4	54%	0.539	55%	0.553	S	S	.	*	H	α-helix	trans	-59.8	-36.6	174.4	-140.1	80.6	0	0	0	110.4	L334 D347 I348 W349	L334-L345 HydrophobicContact CD2-CD1 4.28Å; L345-D347 VanDerWaalsContact C-N 3.31Å; L345-D347 PolarHBondContact O-N 3.45Å; L345-I348 PolarHBondContact O-N 2.91Å; L345-W349 PolarHBondContact O-N 2.75Å; L345-W349 VanDerWaalsContact O-N 3.14Å
346	D	40	Very low	39.8	Very low	114 Å²	114	97.1 Å²	97.1	61%	0.61	54%	0.536	S	S	*	.	H	α-helix	trans	-62.2	-31.7	174.2	-59	-88.6	0	0	0	113.8	S344 I348 R350	S344-D346 PolarHBondContact O-N 3.05Å; D346-I348 VanDerWaalsContact C-N 3.33Å; D346-R350 WeakPolarHBondContact O-CG 3.41Å; D346-R350 PolarHBondContact O-N 3.19Å
347	D	42.5	Very low	40.5	Very low	19 Å²	19	98.4 Å²	98.4	10%	0.102	52%	0.521	C	S	.	.	H	α-helix	trans	-70.8	-29.8	176.4	-70.6	-56.2	0	0	0	112.4	R185 W343 S344 L345 M351	R185-D347 IonicContact CZ-OD1 3.22Å; R185-D347 IonicContact NH1-OD1 2.8Å; R185-D347 IonicContact NH2-OD1 2.88Å; R185-D347 PolarHBondContact NH2-OD1 3.41Å; W343-D347 HydrophobicContact CE3-CB 4.42Å; S344-D347 WeakPolarHBondContact CB-OD2 3.37Å; S344-D347 PolarHBondContact N-OD2 3.03Å; S344-D347 WeakPolarHBondContact O-CB 3.19Å; S344-D347 PolarHBondContact O-N 2.82Å; S344-D347 VanDerWaalsContact O-N 3.08Å; S344-D347 PolarHBondContact OG-N 2.74Å; S344-D347 VanDerWaalsContact OG-N 3.12Å; S344-D347 PolarHBondContact OG-OD2 2.93Å; L345-D347 VanDerWaalsContact C-N 3.31Å; L345-D347 PolarHBondContact O-N 3.45Å; D347-M351 WeakPolarHBondContact O-CG 3.45Å
348	I	41.7	Very low	41	Very low	55 Å²	55	97.5 Å²	97.5	28%	0.282	50%	0.503	S	S	.	.	H	α-helix	trans	-75.8	-42.7	175.8	-62.4	164.6	0	0	0	109.7	W343 S344 L345 D346 R350 M351	W343-I348 HydrophobicContact CB-CD1 4.37Å; W343-I348 HydrophobicContact CB-CG1 4.29Å; S344-I348 PolarHBondContact O-N 2.86Å; L345-I348 PolarHBondContact O-N 2.91Å; D346-I348 VanDerWaalsContact C-N 3.33Å; I348-R350 VanDerWaalsContact C-N 3.27Å; I348-R350 PolarHBondContact O-N 2.84Å; I348-M351 PolarHBondContact O-N 2.97Å; I348-M351 VanDerWaalsContact O-N 3.16Å
349	W	44	Very low	41.7	Very low	169 Å²	169	95.9 Å²	95.9	64%	0.64	48%	0.479	S	S	*	.	H	α-helix	trans	-65.9	-23.4	177.8	-85.5	104.2	0	0	0	114.6	L345 M351	L345-W349 PolarHBondContact O-N 2.75Å; L345-W349 VanDerWaalsContact O-N 3.14Å; W349-M351 VanDerWaalsContact C-N 3.3Å
350	R	44.7	Very low	42	Very low	203 Å²	203	94.5 Å²	94.5	77%	0.766	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	5.5	174.5	-71.9	-176.9	-178	-143.4	3.3	114.5	D346 I348	D346-R350 WeakPolarHBondContact O-CG 3.41Å; D346-R350 PolarHBondContact O-N 3.19Å; I348-R350 VanDerWaalsContact C-N 3.27Å; I348-R350 PolarHBondContact O-N 2.84Å
351	M	40.5	Very low	42	Very low	64 Å²	64	95.3 Å²	95.3	32%	0.315	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	6	175.5	-62.7	-174.2	-175	0	0	113.4	L181 V325 W343 D347 I348 W349	L181-M351 HydrophobicContact CD2-CE 4.47Å; V325-M351 HydrophobicContact CG1-CB 3.49Å; V325-M351 VanDerWaalsContact CG1-CB 3.49Å; V325-M351 HydrophobicContact CG1-SD 4.47Å; V325-M351 HydrophobicContact CG2-CB 4.28Å; V325-M351 HydrophobicContact CG2-SD 4.39Å; W343-M351 HydrophobicContact CE3-CE 4.29Å; W343-M351 HydrophobicContact CZ3-CE 3.72Å; D347-M351 WeakPolarHBondContact O-CG 3.45Å; I348-M351 PolarHBondContact O-N 2.97Å; I348-M351 VanDerWaalsContact O-N 3.16Å; W349-M351 VanDerWaalsContact C-N 3.3Å
352	Q	36.5	Very low	42.1	Very low	172 Å²	172	95.5 Å²	95.5	80%	0.804	44%	0.436	S	S	*	.			trans	-92.6	0	162.6	-68.8	-173.2	-14.9	0	0	110.4

Retrieved 352 of 352 residues in 58.9 ms (Link to these results)

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