A0A087XVP5_POEFO Loading...

Glutaminyl-peptide cyclotransferase

AlphaFold DB , UniProt , Accession A0A087XVP5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 394 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45	Very low	38.8	Very low	253 Å²	253	158.7 Å²	158.7	100%	1.246	77%	0.774	S	S	*	*				0	154.7	0	-76.7	166.3	154.9	0	0	109.1
2	S	36.2	Very low	40.4	Very low	112 Å²	112	154.1 Å²	154.1	78%	0.783	77%	0.765	S	S	*	*			trans	-141.9	131	-173.4	178.8	0	0	0	0	113.5
3	R	36.3	Very low	39.8	Very low	240 Å²	240	154.5 Å²	154.5	91%	0.906	76%	0.763	S	S	*	*			trans	-146.8	119	152.3	-68.6	-169	174.8	178.8	-2.2	104.5
4	S	36.7	Very low	39.4	Very low	87 Å²	87	154.6 Å²	154.6	61%	0.608	76%	0.761	S	S	*	*			cis	59.8	120.7	44.6	-170.9	0	0	0	0	110.8
5	S	35.7	Very low	38.8	Very low	108 Å²	108	151.5 Å²	151.5	76%	0.755	76%	0.76	S	S	*	*				-134.1	158.3	51.4	48.4	0	0	0	0	113.8
6	R	40.8	Very low	38.4	Very low	191 Å²	191	152.3 Å²	152.3	72%	0.721	77%	0.768	S	S	*	*			cis	67.3	144.3	44.2	-63.9	179.7	168.5	-165.7	-0.1	112.4
7	R	41.3	Very low	38	Very low	165 Å²	165	148.4 Å²	148.4	62%	0.623	78%	0.775	S	S	*	*			cis	-169.7	176.2	-3.7	-112.4	174.9	175	-166.2	-2.6	107.4
8	Y	36.9	Very low	37.6	Very low	158 Å²	158	144.7 Å²	144.7	62%	0.62	78%	0.778	S	S	*	*			cis	-164	179.6	3.6	-130.6	-19.2	0	0	0	111.6
9	N	33.7	Very low	37.4	Very low	119 Å²	119	142.8 Å²	142.8	64%	0.636	78%	0.778	S	S	*	*			trans	46.5	126.7	146.7	-57.2	-15.9	0	0	0	122.3
10	K	35.1	Very low	37.5	Very low	196 Å²	196	144 Å²	144	85%	0.852	78%	0.782	S	S	*	*				49.3	150.1	67.2	-85.2	-168.6	177.4	-174.7	0	115.9
11	P	49	Very low	37.9	Very low	117 Å²	117	143.1 Å²	143.1	76%	0.76	78%	0.784	S	S	*	*			cis	-127.8	-115.1	-5	25.4	1.8	0	0	0	116.6
12	P	58.1	Low	37.8	Very low	103 Å²	103	134.9 Å²	134.9	67%	0.669	76%	0.764	S	S	*	*				-128.7	-165.1	-110.2	42.9	-25.4	0	0	0	117.7
13	Q	32.8	Very low	37.7	Very low	159 Å²	159	135.8 Å²	135.8	74%	0.743	77%	0.769	S	S	*	*			trans	96.2	118.2	151.7	-86.7	175.8	-74.3	0	0	123
14	Q	33.7	Very low	37.8	Very low	157 Å²	157	131.8 Å²	131.8	73%	0.734	77%	0.765	S	S	*	*				57.7	125.4	129.1	-76.8	175.9	-41.4	0	0	124.6
15	S	31.2	Very low	38.1	Very low	107 Å²	107	139 Å²	139	75%	0.748	78%	0.779	S	S	*	*				109	135.9	125.6	75.9	0	0	0	0	121.9
16	N	32	Very low	38.7	Very low	164 Å²	164	140 Å²	140	88%	0.877	78%	0.781	S	S	*	*			trans	44.5	127.6	149.6	-64.5	1	0	0	0	123.4
17	G	32.2	Very low	39.3	Very low	87 Å²	87	142.4 Å²	142.4	90%	0.897	79%	0.79	S	S	*	*			trans	119.3	133.3	133.1	0	0	0	0	0	117.2
18	G	29.9	Very low	40	Very low	81 Å²	81	139.7 Å²	139.7	84%	0.835	79%	0.786	S	S	*	*			trans	139.3	139.7	171.1	0	0	0	0	0	113.6
19	S	34.3	Very low	41	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	78%	0.779	S	S	*	*			trans	-145.3	138.1	-170.4	51.6	0	0	0	0	114.7
20	L	39.9	Very low	42.2	Very low	167 Å²	167	140.5 Å²	140.5	87%	0.874	79%	0.789	S	S	*	*			trans	64.5	166.1	163	-61.1	170.4	0	0	0	117.1
21	P	44.6	Very low	43.2	Very low	125 Å²	125	134.5 Å²	134.5	81%	0.812	78%	0.776	S	S	*	*			cis	-111.9	-173.9	-10.1	30.5	-11.5	0	0	0	113.1
22	G	42.6	Very low	43.6	Very low	80 Å²	80	136.9 Å²	136.9	83%	0.825	77%	0.77	S	S	*	*			trans	-96.6	-178.7	-174.2	0	0	0	0	0	116.1
23	C	35.6	Very low	44	Very low	131 Å²	131	136.5 Å²	136.5	89%	0.885	77%	0.765	S	S	*	*			trans	-150.9	130.9	170.5	-167.6	0	0	0	0	110.2
24	D	37.2	Very low	45.6	Very low	157 Å²	157	134.6 Å²	134.6	84%	0.84	76%	0.76	S	S	*	*			trans	-78.4	130.1	-169	-78.9	-62.3	0	0	0	114.6	V26	D24-V26 PolarHBondContact O-N 3.38Å
25	R	44.2	Very low	47.2	Very low	237 Å²	237	132.6 Å²	132.6	89%	0.894	75%	0.753	S	S	*	*			trans	-84.7	98.7	168.7	-84.4	-174.1	167	-175	-3.7	110.9	R27	R25-R27 PolarHBondContact O-N 3.39Å
26	V	47.1	Very low	49.1	Very low	131 Å²	131	133.2 Å²	133.2	79%	0.794	75%	0.748	S	S	*	*			trans	-57.5	101.2	172.2	-178.7	0	0	0	0	110.8	D24 I28	D24-V26 PolarHBondContact O-N 3.38Å; V26-I28 HydrophobicContact CG1-CG1 4.47Å; V26-I28 PolarHBondContact O-N 3.19Å; V26-I28 VanDerWaalsContact O-N 3.14Å
27	R	54.2	Low	50.9	Low	240 Å²	240	127 Å²	127	91%	0.906	72%	0.722	S	S	*	*			trans	-76.2	95.9	171	-78.2	-176.3	171.6	178.9	-1.3	109.8	R25 P29	R25-R27 PolarHBondContact O-N 3.39Å; R27-P29 WeakPolarHBondContact O-CD 3.38Å
28	I	56.5	Low	53	Low	108 Å²	108	128.5 Å²	128.5	55%	0.554	71%	0.709	S	S	*	*			trans	-62.1	122	166.6	-61.7	176.5	0	0	0	108.1	V26 R32 V33	V26-I28 HydrophobicContact CG1-CG1 4.47Å; V26-I28 PolarHBondContact O-N 3.19Å; V26-I28 VanDerWaalsContact O-N 3.14Å; I28-R32 HydrophobicContact CG2-CB 3.79Å; I28-V33 HydrophobicContact CG2-CG2 4.37Å
29	P	57	Low	55.1	Low	72 Å²	72	129.5 Å²	129.5	47%	0.468	70%	0.695	S	S	.	*			trans	-67.6	142	-178.6	26.9	-34.3	0	0	0	110.7	R27 A31 R32	R27-P29 WeakPolarHBondContact O-CD 3.38Å; P29-A31 PolarHBondContact O-N 2.69Å; P29-R32 HydrophobicContact CG-CG 4.27Å; P29-R32 PolarHBondContact O-N 2.71Å
30	R	59.2	Low	56.8	Low	222 Å²	222	127.8 Å²	127.8	84%	0.838	68%	0.682	S	S	*	*	H	α-helix	trans	-50.1	-32.4	-176	-73.1	177.8	170.3	166.3	-5.4	113.8	R32 V33 L34	R30-R32 VanDerWaalsContact C-N 3.32Å; R30-R32 PolarHBondContact O-N 3.17Å; R30-V33 PolarHBondContact O-N 3.07Å; R30-L34 PolarHBondContact O-N 3.34Å; R30-L34 VanDerWaalsContact O-N 3.09Å
31	A	56.4	Low	58.7	Low	70 Å²	70	124.5 Å²	124.5	58%	0.579	67%	0.669	S	S	*	*	H	α-helix	trans	-56.9	-37.7	174.6	0	0	0	0	0	113.8	P29 L34 L35	P29-A31 PolarHBondContact O-N 2.69Å; A31-L34 PolarHBondContact O-N 2.7Å; A31-L35 WeakPolarHBondContact O-CB 3.46Å; A31-L35 PolarHBondContact O-N 3.18Å
32	R	57.2	Low	60.4	Low	167 Å²	167	124.1 Å²	124.1	63%	0.63	66%	0.66	S	S	*	*	H	α-helix	trans	-70.2	-33.4	177.3	-76.6	-173.8	177.7	-178.5	-0.5	112.6	I28 P29 R30 L35 L36	I28-R32 HydrophobicContact CG2-CB 3.79Å; P29-R32 HydrophobicContact CG-CG 4.27Å; P29-R32 PolarHBondContact O-N 2.71Å; R30-R32 VanDerWaalsContact C-N 3.32Å; R30-R32 PolarHBondContact O-N 3.17Å; R32-L35 PolarHBondContact O-N 3.07Å; R32-L36 WeakPolarHBondContact O-CB 3.16Å; R32-L36 VanDerWaalsContact O-CG 3.31Å; R32-L36 WeakPolarHBondContact O-CG 3.29Å; R32-L36 PolarHBondContact O-N 3.25Å
33	V	65.6	Low	62.2	Low	95 Å²	95	124.5 Å²	124.5	58%	0.576	65%	0.646	S	S	*	*	H	α-helix	trans	-68.5	-42.8	175.4	-177.6	0	0	0	0	110.4	I28 R30 L36 G37	I28-V33 HydrophobicContact CG2-CG2 4.37Å; R30-V33 PolarHBondContact O-N 3.07Å; V33-L36 PolarHBondContact O-N 3.13Å; V33-G37 PolarHBondContact O-N 3.09Å
34	L	66.1	Low	64.2	Low	120 Å²	120	124.1 Å²	124.1	63%	0.628	63%	0.634	S	S	*	*	H	α-helix	trans	-61.9	-42.6	172.5	-77.9	161.8	0	0	0	112.2	R30 A31 L36 G37 L38	R30-L34 PolarHBondContact O-N 3.34Å; R30-L34 VanDerWaalsContact O-N 3.09Å; A31-L34 PolarHBondContact O-N 2.7Å; L34-L36 PolarHBondContact O-N 3.44Å; L34-G37 PolarHBondContact O-N 3.19Å; L34-L38 WeakPolarHBondContact O-CG 3.29Å; L34-L38 PolarHBondContact O-N 3.07Å
35	L	68.8	Low	66.2	Low	115 Å²	115	119.3 Å²	119.3	60%	0.602	62%	0.616	S	S	*	*	H	α-helix	trans	-63.7	-41.3	178.3	-155.6	80	0	0	0	112.1	A31 R32 L38 L39	A31-L35 WeakPolarHBondContact O-CB 3.46Å; A31-L35 PolarHBondContact O-N 3.18Å; R32-L35 PolarHBondContact O-N 3.07Å; L35-L38 PolarHBondContact O-N 2.9Å; L35-L39 PolarHBondContact O-N 3.41Å
36	L	69.9	Low	67.9	Low	120 Å²	120	112.1 Å²	112.1	63%	0.628	60%	0.599	S	S	*	*	H	α-helix	trans	-66.4	-38.7	175.3	-73.7	166.6	0	0	0	112.3	R32 V33 L34 L39 S40	R32-L36 WeakPolarHBondContact O-CB 3.16Å; R32-L36 VanDerWaalsContact O-CG 3.31Å; R32-L36 WeakPolarHBondContact O-CG 3.29Å; R32-L36 PolarHBondContact O-N 3.25Å; V33-L36 PolarHBondContact O-N 3.13Å; L34-L36 PolarHBondContact O-N 3.44Å; L36-L39 PolarHBondContact O-N 3.06Å; L36-S40 PolarHBondContact O-N 3.49Å; L36-S40 PolarHBondContact O-OG 2.9Å
37	G	71.4	Confident	69.4	Low	33 Å²	33	110 Å²	110	34%	0.34	59%	0.586	S	S	.	*	H	α-helix	trans	-66.6	-37	174.2	0	0	0	0	0	113.4	V33 L34 S40 V41	V33-G37 PolarHBondContact O-N 3.09Å; L34-G37 PolarHBondContact O-N 3.19Å; G37-S40 PolarHBondContact O-OG 3.12Å; G37-S40 VanDerWaalsContact O-OG 3.08Å; G37-V41 WeakPolarHBondContact O-CG2 3.38Å; G37-V41 PolarHBondContact O-N 3.21Å; G37-V41 VanDerWaalsContact O-N 3.14Å
38	L	74.3	Confident	70.3	Confident	118 Å²	118	103.6 Å²	103.6	62%	0.618	57%	0.569	S	S	*	*	H	α-helix	trans	-67.7	-39.4	172.2	-74.2	165.4	0	0	0	111.5	L34 L35 L42	L34-L38 WeakPolarHBondContact O-CG 3.29Å; L34-L38 PolarHBondContact O-N 3.07Å; L35-L38 PolarHBondContact O-N 2.9Å; L38-L42 WeakPolarHBondContact O-CB 3.4Å; L38-L42 PolarHBondContact O-N 2.82Å
39	L	74.3	Confident	71	Confident	103 Å²	103	101.7 Å²	101.7	54%	0.539	57%	0.565	S	S	.	*	H	α-helix	trans	-63.4	-43.3	175.6	-125.4	79.7	0	0	0	112.2	L35 L36 L42 V43	L35-L39 PolarHBondContact O-N 3.41Å; L36-L39 PolarHBondContact O-N 3.06Å; L39-L42 PolarHBondContact O-N 2.78Å; L39-V43 WeakPolarHBondContact O-CG2 3.5Å; L39-V43 PolarHBondContact O-N 2.88Å
40	S	70.4	Confident	71.5	Confident	72 Å²	72	102.2 Å²	102.2	50%	0.503	57%	0.567	S	S	.	*	H	α-helix	trans	-69.5	-35.8	-180	60.8	0	0	0	0	112.7	L36 G37 V43 L44	L36-S40 PolarHBondContact O-N 3.49Å; L36-S40 PolarHBondContact O-OG 2.9Å; G37-S40 PolarHBondContact O-OG 3.12Å; G37-S40 VanDerWaalsContact O-OG 3.08Å; S40-V43 PolarHBondContact O-N 3.11Å; S40-L44 WeakPolarHBondContact O-CB 3.26Å; S40-L44 PolarHBondContact O-N 3.41Å
41	V	79.9	Confident	72	Confident	98 Å²	98	100 Å²	100	59%	0.594	56%	0.56	S	S	*	*	H	α-helix	trans	-64.1	-41.6	170.3	170.8	0	0	0	0	111.2	G37 L44 A45	G37-V41 WeakPolarHBondContact O-CG2 3.38Å; G37-V41 PolarHBondContact O-N 3.21Å; G37-V41 VanDerWaalsContact O-N 3.14Å; V41-L44 PolarHBondContact O-N 3.11Å; V41-A45 WeakPolarHBondContact O-CB 3.3Å; V41-A45 PolarHBondContact O-N 2.86Å
42	L	80.2	Confident	72.6	Confident	118 Å²	118	101.5 Å²	101.5	62%	0.618	56%	0.557	S	S	*	*	H	α-helix	trans	-63.9	-44.5	177	-163.8	79.6	0	0	0	111.7	L38 L39 A45 V46	L38-L42 WeakPolarHBondContact O-CB 3.4Å; L38-L42 PolarHBondContact O-N 2.82Å; L39-L42 PolarHBondContact O-N 2.78Å; L42-A45 PolarHBondContact O-N 3.46Å; L42-V46 WeakPolarHBondContact O-CG2 3.41Å; L42-V46 PolarHBondContact O-N 2.92Å
43	V	80.1	Confident	72.5	Confident	87 Å²	87	96.2 Å²	96.2	53%	0.527	55%	0.546	S	S	.	.	H	α-helix	trans	-62.1	-43.2	175.4	169.6	0	0	0	0	111.1	L39 S40 A45 V46 V47	L39-V43 WeakPolarHBondContact O-CG2 3.5Å; L39-V43 PolarHBondContact O-N 2.88Å; S40-V43 PolarHBondContact O-N 3.11Å; V43-A45 VanDerWaalsContact C-N 3.34Å; V43-A45 PolarHBondContact O-N 2.89Å; V43-V46 PolarHBondContact O-N 3.21Å; V43-V47 HydrophobicContact CG1-CG2 4.4Å; V43-V47 WeakPolarHBondContact O-CG2 3.48Å; V43-V47 PolarHBondContact O-N 3.48Å
44	L	78.6	Confident	71.8	Confident	123 Å²	123	97.3 Å²	97.3	64%	0.644	55%	0.549	S	S	*	.	H	α-helix	trans	-62.7	-41.1	176.9	-170.5	70.1	0	0	0	111.7	S40 V41 V47 L48	S40-L44 WeakPolarHBondContact O-CB 3.26Å; S40-L44 PolarHBondContact O-N 3.41Å; V41-L44 PolarHBondContact O-N 3.11Å; L44-V47 PolarHBondContact O-N 3.33Å; L44-L48 WeakPolarHBondContact O-CB 3.3Å; L44-L48 PolarHBondContact O-N 3.32Å
45	A	79	Confident	70.9	Confident	56 Å²	56	97.8 Å²	97.8	46%	0.463	55%	0.552	S	S	.	*	H	α-helix	trans	-65.5	-39.1	175.9	0	0	0	0	0	112.5	V41 L42 V43 S49	V41-A45 WeakPolarHBondContact O-CB 3.3Å; V41-A45 PolarHBondContact O-N 2.86Å; L42-A45 PolarHBondContact O-N 3.46Å; V43-A45 VanDerWaalsContact C-N 3.34Å; V43-A45 PolarHBondContact O-N 2.89Å; A45-S49 VanDerWaalsContact O-CB 3.27Å; A45-S49 WeakPolarHBondContact O-CB 3.27Å; A45-S49 PolarHBondContact O-N 3.49Å
46	V	79.4	Confident	69.7	Low	86 Å²	86	97.7 Å²	97.7	52%	0.521	56%	0.556	S	S	.	*	H	α-helix	trans	-66.9	-44.3	174.5	170.8	0	0	0	0	111.1	L42 V43 L48 S49 V50	L42-V46 WeakPolarHBondContact O-CG2 3.41Å; L42-V46 PolarHBondContact O-N 2.92Å; V43-V46 PolarHBondContact O-N 3.21Å; V46-L48 PolarHBondContact O-N 3.03Å; V46-S49 PolarHBondContact O-N 3.43Å; V46-V50 WeakPolarHBondContact O-CG2 3.17Å; V46-V50 PolarHBondContact O-N 3.38Å
47	V	78.3	Confident	68.2	Low	87 Å²	87	96.4 Å²	96.4	53%	0.527	56%	0.558	S	S	.	*	H	α-helix	trans	-61.2	-44.1	176	169.7	0	0	0	0	111	V43 L44 V50 Y51	V43-V47 HydrophobicContact CG1-CG2 4.4Å; V43-V47 WeakPolarHBondContact O-CG2 3.48Å; V43-V47 PolarHBondContact O-N 3.48Å; L44-V47 PolarHBondContact O-N 3.33Å; V47-V50 PolarHBondContact O-N 3.14Å; V47-Y51 WeakPolarHBondContact O-CB 3.45Å; V47-Y51 PolarHBondContact O-N 3.13Å
48	L	74.3	Confident	66.6	Low	106 Å²	106	97.2 Å²	97.2	56%	0.555	57%	0.566	S	S	*	*	H	α-helix	trans	-64.6	-40.8	176.7	-169.1	70	0	0	0	111.8	L44 V46 Y51 L52	L44-L48 WeakPolarHBondContact O-CB 3.3Å; L44-L48 PolarHBondContact O-N 3.32Å; V46-L48 PolarHBondContact O-N 3.03Å; L48-Y51 PolarHBondContact O-N 2.99Å; L48-L52 HydrophobicContact CG-CD1 4.13Å; L48-L52 WeakPolarHBondContact O-CB 3.33Å; L48-L52 VanDerWaalsContact O-CG 3.3Å; L48-L52 WeakPolarHBondContact O-CG 3.39Å; L48-L52 PolarHBondContact O-N 3.31Å
49	S	69.7	Low	64.6	Low	68 Å²	68	95.2 Å²	95.2	48%	0.476	57%	0.573	S	S	.	*	H	α-helix	trans	-61.9	-44	175.1	-173.8	0	0	0	0	112	A45 V46 L52 S53	A45-S49 VanDerWaalsContact O-CB 3.27Å; A45-S49 WeakPolarHBondContact O-CB 3.27Å; A45-S49 PolarHBondContact O-N 3.49Å; V46-S49 PolarHBondContact O-N 3.43Å; S49-L52 PolarHBondContact O-N 3.1Å; S49-S53 VanDerWaalsContact O-CB 3.29Å; S49-S53 WeakPolarHBondContact O-CB 3.47Å; S49-S53 PolarHBondContact O-N 3.11Å; S49-S53 PolarHBondContact O-OG 2.84Å
50	V	68.4	Low	62.7	Low	82 Å²	82	99.5 Å²	99.5	50%	0.497	59%	0.591	S	S	.	*	H	α-helix	trans	-65.1	-39	175.4	170.3	0	0	0	0	111.4	V46 V47 S53 N54	V46-V50 WeakPolarHBondContact O-CG2 3.17Å; V46-V50 PolarHBondContact O-N 3.38Å; V47-V50 PolarHBondContact O-N 3.14Å; V50-S53 PolarHBondContact O-N 3.04Å; V50-N54 PolarHBondContact O-N 3.2Å
51	Y	70.1	Confident	61	Low	175 Å²	175	98.8 Å²	98.8	69%	0.686	59%	0.594	S	S	*	*	H	α-helix	trans	-62.7	-49.5	176.9	-155.5	-88.8	0	0	0	111.6	V47 L48 S53 N54 D55	V47-Y51 WeakPolarHBondContact O-CB 3.45Å; V47-Y51 PolarHBondContact O-N 3.13Å; L48-Y51 PolarHBondContact O-N 2.99Å; Y51-S53 VanDerWaalsContact C-N 3.31Å; Y51-S53 PolarHBondContact O-N 3.08Å; Y51-N54 PolarHBondContact O-N 2.72Å; Y51-D55 PolarHBondContact O-N 3.45Å; Y51-D55 VanDerWaalsContact O-N 3.16Å
52	L	69.2	Low	58.9	Low	102 Å²	102	99.9 Å²	99.9	53%	0.534	61%	0.606	S	S	.	*	H	α-helix	trans	-63.4	-34.8	175.5	-68.2	167.2	0	0	0	112.4	L48 S49 D55 T56	L48-L52 HydrophobicContact CG-CD1 4.13Å; L48-L52 WeakPolarHBondContact O-CB 3.33Å; L48-L52 VanDerWaalsContact O-CG 3.3Å; L48-L52 WeakPolarHBondContact O-CG 3.39Å; L48-L52 PolarHBondContact O-N 3.31Å; S49-L52 PolarHBondContact O-N 3.1Å; L52-D55 PolarHBondContact O-N 3.48Å; L52-T56 PolarHBondContact O-N 3.42Å
53	S	55.5	Low	57	Low	57 Å²	57	105.6 Å²	105.6	40%	0.399	62%	0.619	S	S	.	*	H	α-helix	trans	-70.3	-38.6	177	-57.8	0	0	0	0	112.4	S49 V50 Y51 D55 T56 S57	S49-S53 VanDerWaalsContact O-CB 3.29Å; S49-S53 WeakPolarHBondContact O-CB 3.47Å; S49-S53 PolarHBondContact O-N 3.11Å; S49-S53 PolarHBondContact O-OG 2.84Å; V50-S53 PolarHBondContact O-N 3.04Å; Y51-S53 VanDerWaalsContact C-N 3.31Å; Y51-S53 PolarHBondContact O-N 3.08Å; S53-D55 VanDerWaalsContact C-N 3.33Å; S53-T56 PolarHBondContact O-N 2.74Å; S53-T56 PolarHBondContact O-OG1 3.18Å; S53-S57 PolarHBondContact O-N 3.48Å; S53-S57 PolarHBondContact O-OG 3.45Å
54	N	49.8	Very low	55.2	Low	118 Å²	118	108.9 Å²	108.9	63%	0.631	63%	0.633	S	S	*	*	H	α-helix	trans	-64.5	-37.5	173.9	-92.7	10.3	0	0	0	112	V50 Y51 T56 S57	V50-N54 PolarHBondContact O-N 3.2Å; Y51-N54 PolarHBondContact O-N 2.72Å; N54-T56 PolarHBondContact O-N 3.4Å; N54-S57 WeakPolarHBondContact O-CB 3.35Å; N54-S57 PolarHBondContact O-N 3.28Å
55	D	47.9	Very low	53.8	Low	130 Å²	130	108.5 Å²	108.5	70%	0.695	64%	0.638	S	S	*	*	H	α-helix	trans	-61.4	-31.1	175.5	-127.1	-4.8	0	0	0	111.8	Y51 L52 S53 S57	Y51-D55 PolarHBondContact O-N 3.45Å; Y51-D55 VanDerWaalsContact O-N 3.16Å; L52-D55 PolarHBondContact O-N 3.48Å; S53-D55 VanDerWaalsContact C-N 3.33Å; D55-S57 VanDerWaalsContact C-N 3.3Å; D55-S57 PolarHBondContact O-N 3.01Å
56	T	42.1	Very low	52.6	Low	112 Å²	112	110.3 Å²	110.3	69%	0.687	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-3.6	173.8	60.8	0	0	0	0	114.8	L52 S53 N54 G58	L52-T56 PolarHBondContact O-N 3.42Å; S53-T56 PolarHBondContact O-N 2.74Å; S53-T56 PolarHBondContact O-OG1 3.18Å; N54-T56 PolarHBondContact O-N 3.4Å; T56-G58 VanDerWaalsContact C-N 3.35Å
57	S	39.5	Very low	51.8	Low	94 Å²	94	108.8 Å²	108.8	66%	0.657	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	9	-179.8	-61.9	0	0	0	0	113.8	S53 N54 D55 G59	S53-S57 PolarHBondContact O-N 3.48Å; S53-S57 PolarHBondContact O-OG 3.45Å; N54-S57 WeakPolarHBondContact O-CB 3.35Å; N54-S57 PolarHBondContact O-N 3.28Å; D55-S57 VanDerWaalsContact C-N 3.3Å; D55-S57 PolarHBondContact O-N 3.01Å; S57-G59 PolarHBondContact O-N 3.06Å
58	G	36.8	Very low	52	Low	50 Å²	50	108.4 Å²	108.4	52%	0.515	64%	0.639	S	S	.	*	S	Bend	trans	-79.1	108.6	163.9	0	0	0	0	0	111.4	T56 H60	T56-G58 VanDerWaalsContact C-N 3.35Å; G58-H60 PolarHBondContact O-N 3.26Å
59	G	33.3	Very low	52.5	Low	75 Å²	75	104.5 Å²	104.5	77%	0.773	62%	0.618	S	S	*	*			trans	-54.6	133.4	-176.2	0	0	0	0	0	113.7	S57 G61	S57-G59 PolarHBondContact O-N 3.06Å; G59-G61 PolarHBondContact O-N 2.76Å
60	H	35.1	Very low	53.2	Low	194 Å²	194	104.9 Å²	104.9	90%	0.898	62%	0.618	S	S	*	*			trans	-71.7	62.7	178.8	-80.2	30.1	0	0	0	113	G58	G58-H60 PolarHBondContact O-N 3.26Å
61	G	34.3	Very low	54.2	Low	56 Å²	56	107.3 Å²	107.3	58%	0.577	62%	0.622	S	S	*	*			trans	-69.1	133	148	0	0	0	0	0	108.3	G59 R63	G59-G61 PolarHBondContact O-N 2.76Å; G61-R63 VanDerWaalsContact C-N 3.25Å; G61-R63 PolarHBondContact O-N 2.87Å
62	S	35.4	Very low	55.2	Low	121 Å²	121	101.4 Å²	101.4	85%	0.846	60%	0.602	S	S	*	*			trans	-68.4	80.6	179.3	41.4	0	0	0	0	111.2	L64	S62-L64 VanDerWaalsContact C-N 3.34Å; S62-L64 PolarHBondContact O-N 3.31Å
63	R	39.3	Very low	56.3	Low	238 Å²	238	98.8 Å²	98.8	90%	0.898	59%	0.585	S	S	*	*			trans	-62.4	96.3	168.3	-73.9	-174	176.3	-175.7	-0.8	108.6	G61	G61-R63 VanDerWaalsContact C-N 3.25Å; G61-R63 PolarHBondContact O-N 2.87Å
64	L	43.2	Very low	58.1	Low	156 Å²	156	101.3 Å²	101.3	82%	0.817	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-46.6	138.9	158	-68.7	166.9	0	0	0	108.1	S62 A66	S62-L64 VanDerWaalsContact C-N 3.34Å; S62-L64 PolarHBondContact O-N 3.31Å; L64-A66 PolarHBondContact O-N 2.82Å
65	P	49.4	Very low	60.2	Low	115 Å²	115	98.6 Å²	98.6	75%	0.747	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.6	132.3	176.3	-25.4	34.3	0	0	0	110.1	V67	P65-V67 PolarHBondContact O-N 2.72Å; P65-V67 VanDerWaalsContact O-N 3.15Å
66	A	53.1	Low	62.5	Low	94 Å²	94	94.1 Å²	94.1	78%	0.777	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-58.8	122.5	175.3	0	0	0	0	0	108.7	L64 D68	L64-A66 PolarHBondContact O-N 2.82Å; A66-D68 PolarHBondContact O-N 2.78Å; A66-D68 VanDerWaalsContact O-N 3.12Å
67	V	62.9	Low	65.1	Low	55 Å²	55	95.3 Å²	95.3	33%	0.333	55%	0.554	S	S	.	*			trans	-66.4	112	-174.5	178.8	0	0	0	0	109	P65 L69 A264	P65-V67 PolarHBondContact O-N 2.72Å; P65-V67 VanDerWaalsContact O-N 3.15Å; V67-L69 VanDerWaalsContact C-N 3.34Å; V67-L69 HydrophobicContact CG1-CD2 3.63Å; V67-L69 HydrophobicContact CG1-CG 4.19Å; V67-L69 PolarHBondContact O-N 2.67Å; V67-L69 VanDerWaalsContact O-N 3.16Å; V67-A264 VanDerWaalsContact CB-O 3.29Å; V67-A264 WeakPolarHBondContact CB-O 3.47Å
68	D	82.1	Confident	67.9	Low	79 Å²	79	92.8 Å²	92.8	42%	0.422	54%	0.536	S	S	.	.			trans	-85.1	83.4	172.4	-179.6	-12.5	0	0	0	107.9	A66 V70 K71 D72	A66-D68 PolarHBondContact O-N 2.78Å; A66-D68 VanDerWaalsContact O-N 3.12Å; D68-V70 PolarHBondContact O-N 2.88Å; D68-V70 VanDerWaalsContact O-N 3.1Å; D68-V70 PolarHBondContact OD1-N 3.12Å; D68-K71 HydrophobicContact CB-CB 3.9Å; D68-K71 HydrophobicContact CB-CD 4.25Å; D68-K71 PolarHBondContact O-N 2.58Å; D68-K71 VanDerWaalsContact O-N 3.11Å; D68-K71 WeakPolarHBondContact OD1-CB 3.17Å; D68-K71 PolarHBondContact OD1-N 2.94Å; D68-K71 WeakPolarHBondContact OD2-CB 3.28Å; D68-D72 WeakPolarHBondContact O-CB 3.2Å; D68-D72 PolarHBondContact O-N 3.42Å
69	L	85.3	Confident	70.7	Confident	23 Å²	23	92.9 Å²	92.9	12%	0.12	53%	0.528	C	S	.	.	H	α-helix	trans	-51.4	-35.8	-177.7	-60.5	166.5	0	0	0	112.2	V67 R73 R166 A264 A268 Q272	V67-L69 VanDerWaalsContact C-N 3.34Å; V67-L69 HydrophobicContact CG1-CD2 3.63Å; V67-L69 HydrophobicContact CG1-CG 4.19Å; V67-L69 PolarHBondContact O-N 2.67Å; V67-L69 VanDerWaalsContact O-N 3.16Å; L69-R73 WeakPolarHBondContact O-CB 3.24Å; L69-R73 PolarHBondContact O-N 3.16Å; L69-R166 HydrophobicContact CD2-CG 3.78Å; L69-A264 HydrophobicContact CD1-CB 3.89Å; L69-A264 HydrophobicContact CD2-CB 3.76Å; L69-A264 HydrophobicContact CG-CB 4.41Å; L69-A268 HydrophobicContact CD1-CB 3.84Å; L69-Q272 HydrophobicContact CD1-CB 4.49Å
70	V	84.9	Confident	73.7	Confident	77 Å²	77	98.9 Å²	98.9	47%	0.467	53%	0.533	S	S	.	.	H	α-helix	trans	-70.1	-48.3	-178.8	179.6	0	0	0	0	110.5	D68 L74	D68-V70 PolarHBondContact O-N 2.88Å; D68-V70 VanDerWaalsContact O-N 3.1Å; D68-V70 PolarHBondContact OD1-N 3.12Å; V70-L74 HydrophobicContact CG1-CD1 3.96Å; V70-L74 WeakPolarHBondContact O-CB 3.2Å; V70-L74 WeakPolarHBondContact O-CG 3.49Å; V70-L74 PolarHBondContact O-N 3.5Å
71	K	89.1	Confident	76.6	Confident	133 Å²	133	90 Å²	90	58%	0.578	49%	0.493	S	S	*	.	H	α-helix	trans	-64.9	-39.3	175.3	176.6	-173.8	172.8	-168.7	0	112.5	D68 L74 S75	D68-K71 HydrophobicContact CB-CB 3.9Å; D68-K71 HydrophobicContact CB-CD 4.25Å; D68-K71 PolarHBondContact O-N 2.58Å; D68-K71 VanDerWaalsContact O-N 3.11Å; D68-K71 WeakPolarHBondContact OD1-CB 3.17Å; D68-K71 PolarHBondContact OD1-N 2.94Å; D68-K71 WeakPolarHBondContact OD2-CB 3.28Å; K71-L74 PolarHBondContact O-N 3.18Å; K71-S75 WeakPolarHBondContact O-CB 3.36Å; K71-S75 PolarHBondContact O-N 3.17Å; K71-S75 PolarHBondContact O-OG 3.49Å
72	D	91.7	Very high	79.6	Confident	51 Å²	51	89.8 Å²	89.8	27%	0.273	48%	0.483	S	S	.	.	H	α-helix	trans	-69.4	-41	-179	-73.5	-2	0	0	0	110.9	D68 S75 H76 R166	D68-D72 WeakPolarHBondContact O-CB 3.2Å; D68-D72 PolarHBondContact O-N 3.42Å; D72-S75 WeakPolarHBondContact CA-OG 3.49Å; D72-S75 PolarHBondContact O-N 3.34Å; D72-S75 PolarHBondContact O-OG 3.34Å; D72-S75 VanDerWaalsContact O-OG 3.13Å; D72-H76 PolarHBondContact O-N 3.25Å; D72-R166 PolarHBondContact O-NH1 2.92Å
73	R	92.4	Very high	82.6	Confident	46 Å²	46	88.2 Å²	88.2	17%	0.174	47%	0.467	C	S	.	.	H	α-helix	trans	-61.3	-45.8	170.5	-179.4	170.1	75.6	171.4	6.7	113.2	L69 H76 V274 D275 R299	L69-R73 WeakPolarHBondContact O-CB 3.24Å; L69-R73 PolarHBondContact O-N 3.16Å; R73-H76 WeakPolarHBondContact O-CB 3.35Å; R73-V274 PolarHBondContact NH1-O 2.76Å; R73-D275 WeakPolarHBondContact CB-OD1 3.46Å; R73-D275 VanDerWaalsContact CD-CA 3.47Å; R73-D275 VanDerWaalsContact CD-O 3.25Å; R73-D275 WeakPolarHBondContact CD-O 3.01Å; R73-D275 HydrophobicContact CG-CB 4.1Å; R73-D275 WeakPolarHBondContact CG-O 3.28Å; R73-R299 PolarHBondContact O-NH2 2.98Å
74	L	91.9	Very high	85.3	Confident	110 Å²	110	80.2 Å²	80.2	58%	0.576	45%	0.453	S	S	*	.	H	α-helix	trans	-70.6	-35	178.4	-71.8	171.6	0	0	0	112.5	V70 K71	V70-L74 HydrophobicContact CG1-CD1 3.96Å; V70-L74 WeakPolarHBondContact O-CB 3.2Å; V70-L74 WeakPolarHBondContact O-CG 3.49Å; V70-L74 PolarHBondContact O-N 3.5Å; K71-L74 PolarHBondContact O-N 3.18Å
75	S	94.4	Very high	88	Confident	62 Å²	62	76.3 Å²	76.3	43%	0.434	43%	0.43	S	S	.	.	H	α-helix	trans	-77.2	-27.5	177.9	62.7	0	0	0	0	113	K71 D72 K77	K71-S75 WeakPolarHBondContact O-CB 3.36Å; K71-S75 PolarHBondContact O-N 3.17Å; K71-S75 PolarHBondContact O-OG 3.49Å; D72-S75 WeakPolarHBondContact CA-OG 3.49Å; D72-S75 PolarHBondContact O-N 3.34Å; D72-S75 PolarHBondContact O-OG 3.34Å; D72-S75 VanDerWaalsContact O-OG 3.13Å; S75-K77 WeakPolarHBondContact O-CD 3.41Å; S75-K77 WeakPolarHBondContact O-CE 3.45Å; S75-K77 VanDerWaalsContact O-CG 3.3Å; S75-K77 WeakPolarHBondContact O-CG 3.24Å; S75-K77 PolarHBondContact O-N 3.27Å; S75-K77 PolarHBondContact O-NZ 2.87Å
76	H	97	Very high	90.3	Very high	36 Å²	36	70.9 Å²	70.9	17%	0.167	40%	0.395	C	S	.	.			trans	-43.1	128.2	177.3	-162.6	58.2	0	0	0	113.1	D72 R73 R299 W300 Y391	D72-H76 PolarHBondContact O-N 3.25Å; R73-H76 WeakPolarHBondContact O-CB 3.35Å; H76-R299 PolarHBondContact O-NH1 2.69Å; H76-W300 AromaticContact CD2-CH2 3.68Å; H76-W300 AromaticContact CD2-CZ2 3.84Å; H76-Y391 AromaticContact CD2-CE1 3.6Å; H76-Y391 AromaticContact CD2-CZ 3.65Å; H76-Y391 AromaticContact NE2-CD1 3.59Å; H76-Y391 AromaticContact NE2-CE1 3.46Å; H76-Y391 WeakPolarHBondContact NE2-CE1 3.48Å; H76-Y391 AromaticContact NE2-CZ 4Å; H76-Y391 PolarHBondContact NE2-O 3.48Å
77	K	96.6	Very high	92.4	Very high	136 Å²	136	73.1 Å²	73.1	59%	0.591	38%	0.383	S	S	*	.			trans	-122.1	146.1	-176.1	-57.7	-52.8	174.3	-143.1	0	111.1	S75 S79	S75-K77 WeakPolarHBondContact O-CD 3.41Å; S75-K77 WeakPolarHBondContact O-CE 3.45Å; S75-K77 VanDerWaalsContact O-CG 3.3Å; S75-K77 WeakPolarHBondContact O-CG 3.24Å; S75-K77 PolarHBondContact O-N 3.27Å; S75-K77 PolarHBondContact O-NZ 2.87Å; K77-S79 PolarHBondContact O-N 2.74Å
78	P	97.1	Very high	94.1	Very high	42 Å²	42	76.3 Å²	76.3	27%	0.273	39%	0.389	S	S	.	.			trans	-64.1	133.7	169.5	27.4	-34	0	0	0	111.2	W300 R303 E390	P78-W300 HydrophobicContact CB-CZ3 4.11Å; P78-W300 HydrophobicContact CG-CZ3 4.36Å; P78-R303 HydrophobicContact CB-CG 4.48Å; P78-R303 HydrophobicContact CG-CG 4.44Å; P78-E390 CarbonylContact C-O 3.51Å; P78-E390 VanDerWaalsContact CA-O 3.3Å; P78-E390 WeakPolarHBondContact CA-O 3.3Å; P78-E390 HydrophobicContact CB-CB 4.06Å
79	S	96.8	Very high	94.9	Very high	51 Å²	51	72.8 Å²	72.8	36%	0.357	37%	0.37	S	S	.	.			trans	-64.2	150.1	169.5	-73.2	0	0	0	0	111.9	K77 V81 E390 G393	K77-S79 PolarHBondContact O-N 2.74Å; S79-V81 PolarHBondContact O-N 2.73Å; S79-V81 VanDerWaalsContact O-N 3.14Å; S79-E390 PolarHBondContact N-O 2.74Å; S79-G393 WeakPolarHBondContact OG-CA 3.49Å
80	K	95.3	Very high	95.5	Very high	201 Å²	201	72 Å²	72	87%	0.874	37%	0.367	S	S	*	.			trans	-83.5	86.3	179.5	-70.9	-178.9	179	176.8	0	111.4	S82	K80-S82 PolarHBondContact O-N 2.78Å
81	V	95.9	Very high	96.2	Very high	8 Å²	8	72.7 Å²	72.7	5%	0.048	38%	0.375	C	S	.	.			trans	-69.9	125.3	170	178.2	0	0	0	0	109.7	S79 Q85 I86 L89 R310 A389 E390	S79-V81 PolarHBondContact O-N 2.73Å; S79-V81 VanDerWaalsContact O-N 3.14Å; V81-Q85 HydrophobicContact CG1-CB 3.54Å; V81-I86 HydrophobicContact CG1-CG1 3.75Å; V81-L89 HydrophobicContact CG1-CD1 3.8Å; V81-R310 PolarHBondContact O-NH2 3.26Å; V81-A389 HydrophobicContact CG2-CB 4.08Å; V81-E390 HydrophobicContact CB-CG 4.04Å; V81-E390 HydrophobicContact CG2-CB 4.44Å; V81-E390 HydrophobicContact CG2-CG 3.54Å
82	S	97.6	Very high	96.6	Very high	52 Å²	52	68.9 Å²	68.9	36%	0.364	36%	0.361	S	S	.	.			trans	-76.9	168.5	178.7	67.8	0	0	0	0	113.6	K80 A84 Q85 I86	K80-S82 PolarHBondContact O-N 2.78Å; S82-A84 VanDerWaalsContact C-N 3.28Å; S82-A84 PolarHBondContact O-N 3.33Å; S82-Q85 VanDerWaalsContact CB-OE1 3.25Å; S82-Q85 PolarHBondContact O-N 2.79Å; S82-Q85 WeakPolarHBondContact OG-CG 3.41Å; S82-Q85 PolarHBondContact OG-N 3.15Å; S82-Q85 VanDerWaalsContact OG-N 3.17Å; S82-Q85 PolarHBondContact OG-OE1 2.93Å; S82-I86 PolarHBondContact O-N 2.89Å
83	V	97.7	Very high	97	Very high	87 Å²	87	67 Å²	67	53%	0.527	35%	0.351	S	S	.	.	H	α-helix	trans	-56.5	-42.6	173.6	178.6	0	0	0	0	111.3	I86 R87	V83-I86 PolarHBondContact O-N 3.17Å; V83-R87 PolarHBondContact O-N 3.06Å
84	A	98	Very high	97.3	Very high	71 Å²	71	67.8 Å²	67.8	59%	0.587	36%	0.359	S	S	*	.	H	α-helix	trans	-67.6	-39.7	177.3	0	0	0	0	0	112.5	S82 R87 R88	S82-A84 VanDerWaalsContact C-N 3.28Å; S82-A84 PolarHBondContact O-N 3.33Å; A84-R87 PolarHBondContact O-N 2.84Å; A84-R88 PolarHBondContact O-N 3.14Å
85	Q	97.9	Very high	97.6	Very high	74 Å²	74	63.5 Å²	63.5	35%	0.346	34%	0.342	S	S	.	.	H	α-helix	trans	-65.6	-38.7	173.9	-74.6	159.9	-78.5	0	0	112	V81 S82 R87 R88 L89	V81-Q85 HydrophobicContact CG1-CB 3.54Å; S82-Q85 VanDerWaalsContact CB-OE1 3.25Å; S82-Q85 PolarHBondContact O-N 2.79Å; S82-Q85 WeakPolarHBondContact OG-CG 3.41Å; S82-Q85 PolarHBondContact OG-N 3.15Å; S82-Q85 VanDerWaalsContact OG-N 3.17Å; S82-Q85 PolarHBondContact OG-OE1 2.93Å; Q85-R87 VanDerWaalsContact C-N 3.32Å; Q85-R87 PolarHBondContact O-N 3.47Å; Q85-R88 PolarHBondContact O-N 2.92Å; Q85-L89 WeakPolarHBondContact O-CB 3.24Å; Q85-L89 VanDerWaalsContact O-CG 3.27Å; Q85-L89 WeakPolarHBondContact O-CG 3.41Å; Q85-L89 PolarHBondContact O-N 2.86Å
86	I	98.2	Very high	97.8	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-58.6	-44.3	173.7	-74.2	-174.2	0	0	0	111.2	V81 S82 V83 R88 L89 A90 R310 L311 Q314 L316 V386	V81-I86 HydrophobicContact CG1-CG1 3.75Å; S82-I86 PolarHBondContact O-N 2.89Å; V83-I86 PolarHBondContact O-N 3.17Å; I86-R88 VanDerWaalsContact C-N 3.34Å; I86-R88 PolarHBondContact O-N 3.38Å; I86-L89 PolarHBondContact O-N 3.05Å; I86-A90 VanDerWaalsContact O-CB 3.3Å; I86-A90 WeakPolarHBondContact O-CB 3.33Å; I86-A90 PolarHBondContact O-N 3.45Å; I86-R310 HydrophobicContact CD1-CB 3.76Å; I86-R310 VanDerWaalsContact CD1-CZ 3.48Å; I86-L311 HydrophobicContact CG2-CD2 3.54Å; I86-L311 HydrophobicContact CG2-CG 4.13Å; I86-Q314 VanDerWaalsContact CG2-NE2 3.3Å; I86-L316 HydrophobicContact CG2-CD1 3.83Å; I86-V386 HydrophobicContact CD1-CG1 4.1Å; I86-V386 HydrophobicContact CG1-CG1 4.15Å; I86-V386 HydrophobicContact CG1-CG2 4.09Å; I86-V386 HydrophobicContact CG2-CG2 4.27Å
87	R	98.4	Very high	97.8	Very high	141 Å²	141	64.6 Å²	64.6	53%	0.532	35%	0.348	S	S	.	.	H	α-helix	trans	-59.4	-45.8	176	-68.8	174	-171.5	-178	-2.5	111.4	V83 A84 Q85 A90 S91 L316	V83-R87 PolarHBondContact O-N 3.06Å; A84-R87 PolarHBondContact O-N 2.84Å; Q85-R87 VanDerWaalsContact C-N 3.32Å; Q85-R87 PolarHBondContact O-N 3.47Å; R87-A90 PolarHBondContact O-N 2.84Å; R87-S91 WeakPolarHBondContact O-CB 3.39Å; R87-S91 PolarHBondContact O-N 3.44Å; R87-S91 PolarHBondContact O-OG 3.31Å; R87-S91 VanDerWaalsContact O-OG 3.13Å; R87-L316 HydrophobicContact CG-CD1 4.1Å
88	R	98.4	Very high	97.9	Very high	122 Å²	122	58.2 Å²	58.2	46%	0.46	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-42.5	177.1	-178.7	176.9	175.9	-101.1	-12.4	112.6	A84 Q85 I86 S91 L92	A84-R88 PolarHBondContact O-N 3.14Å; Q85-R88 PolarHBondContact O-N 2.92Å; I86-R88 VanDerWaalsContact C-N 3.34Å; I86-R88 PolarHBondContact O-N 3.38Å; R88-S91 PolarHBondContact O-N 3.38Å; R88-S91 PolarHBondContact O-OG 3.11Å; R88-L92 HydrophobicContact CG-CD1 4.34Å; R88-L92 WeakPolarHBondContact O-CD1 3.36Å; R88-L92 VanDerWaalsContact O-CG 3.26Å; R88-L92 WeakPolarHBondContact O-CG 3.19Å; R88-L92 PolarHBondContact O-N 3.26Å
89	L	98.4	Very high	98	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-46.4	177.9	-69.4	162.7	0	0	0	110.8	V81 Q85 I86 S91 L92 L210 V386 A389	V81-L89 HydrophobicContact CG1-CD1 3.8Å; Q85-L89 WeakPolarHBondContact O-CB 3.24Å; Q85-L89 VanDerWaalsContact O-CG 3.27Å; Q85-L89 WeakPolarHBondContact O-CG 3.41Å; Q85-L89 PolarHBondContact O-N 2.86Å; I86-L89 PolarHBondContact O-N 3.05Å; L89-S91 VanDerWaalsContact C-N 3.25Å; L89-S91 PolarHBondContact O-N 2.78Å; L89-L92 PolarHBondContact O-N 3.19Å; L89-L210 HydrophobicContact CD2-CD2 3.64Å; L89-V386 HydrophobicContact CB-CG2 4.46Å; L89-V386 HydrophobicContact CD1-CG2 4.37Å; L89-A389 HydrophobicContact CD1-CB 3.44Å; L89-A389 VanDerWaalsContact CD1-CB 3.44Å; L89-A389 HydrophobicContact CD2-CB 3.88Å; L89-A389 HydrophobicContact CG-CB 4.33Å
90	A	98.5	Very high	98.1	Very high	6 Å²	6	58.1 Å²	58.1	5%	0.05	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-24.7	178.8	0	0	0	0	0	113.7	I86 R87 L311 L316 K382	I86-A90 VanDerWaalsContact O-CB 3.3Å; I86-A90 WeakPolarHBondContact O-CB 3.33Å; I86-A90 PolarHBondContact O-N 3.45Å; R87-A90 PolarHBondContact O-N 2.84Å; A90-L311 HydrophobicContact CB-CD2 3.74Å; A90-L316 HydrophobicContact CB-CB 4.31Å; A90-L316 HydrophobicContact CB-CD1 4.03Å; A90-L316 HydrophobicContact CB-CD2 4.39Å; A90-L316 HydrophobicContact CB-CG 4.47Å; A90-K382 HydrophobicContact CB-CD 4.35Å; A90-K382 HydrophobicContact CB-CG 4.28Å; A90-K382 WeakPolarHBondContact O-CE 3.27Å
91	S	98.4	Very high	98.3	Very high	92 Å²	92	51.9 Å²	51.9	64%	0.643	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.3	176.1	68.3	0	0	0	0	114.6	R87 R88 L89	R87-S91 WeakPolarHBondContact O-CB 3.39Å; R87-S91 PolarHBondContact O-N 3.44Å; R87-S91 PolarHBondContact O-OG 3.31Å; R87-S91 VanDerWaalsContact O-OG 3.13Å; R88-S91 PolarHBondContact O-N 3.38Å; R88-S91 PolarHBondContact O-OG 3.11Å; L89-S91 VanDerWaalsContact C-N 3.25Å; L89-S91 PolarHBondContact O-N 2.78Å
92	L	98.5	Very high	98.4	Very high	54 Å²	54	51.7 Å²	51.7	28%	0.283	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-25	173.7	-74.3	165.1	0	0	0	112.3	R88 L89 D94 R97 S209	R88-L92 HydrophobicContact CG-CD1 4.34Å; R88-L92 WeakPolarHBondContact O-CD1 3.36Å; R88-L92 VanDerWaalsContact O-CG 3.26Å; R88-L92 WeakPolarHBondContact O-CG 3.19Å; R88-L92 PolarHBondContact O-N 3.26Å; L89-L92 PolarHBondContact O-N 3.19Å; L92-D94 PolarHBondContact O-N 2.98Å; L92-R97 PolarHBondContact O-NH2 2.95Å; L92-S209 WeakPolarHBondContact O-CB 3.28Å
93	V	98.6	Very high	98.5	Very high	11 Å²	11	49.2 Å²	49.2	7%	0.067	27%	0.27	C	S	.	.			trans	-65.6	118.9	169.4	178.9	0	0	0	0	108.7	E205 E378 T381 K382 A385	V93-E205 VanDerWaalsContact CA-OE1 3.3Å; V93-E205 WeakPolarHBondContact CA-OE1 3.29Å; V93-E205 HydrophobicContact CG1-CG 4.35Å; V93-E378 HydrophobicContact CG1-CG 4.16Å; V93-T381 HydrophobicContact CG1-CG2 3.64Å; V93-T381 HydrophobicContact CG2-CG2 4.06Å; V93-K382 HydrophobicContact CB-CG 3.99Å; V93-K382 HydrophobicContact CG1-CG 4.19Å; V93-K382 HydrophobicContact CG2-CG 4.01Å; V93-A385 HydrophobicContact CG2-CB 4.09Å
94	D	98.7	Very high	98.5	Very high	62 Å²	62	50.1 Å²	50.1	33%	0.332	26%	0.264	S	S	.	.			trans	-112.2	100.6	-176	179.7	-18.4	0	0	0	108.8	L92 A96 R97 L98 E205	L92-D94 PolarHBondContact O-N 2.98Å; D94-A96 PolarHBondContact O-N 3.22Å; D94-A96 WeakPolarHBondContact OD1-CB 3.42Å; D94-A96 PolarHBondContact OD1-N 2.93Å; D94-R97 HydrophobicContact CB-CB 3.87Å; D94-R97 VanDerWaalsContact CB-CZ 3.42Å; D94-R97 VanDerWaalsContact CB-NH1 3.29Å; D94-R97 PolarHBondContact O-N 2.85Å; D94-R97 PolarHBondContact OD1-N 3.3Å; D94-R97 IonicContact OD2-CZ 3.48Å; D94-R97 IonicContact OD2-NH1 3.71Å; D94-R97 PolarHBondContact OD2-NH1 3.02Å; D94-L98 WeakPolarHBondContact O-CB 3.3Å; D94-L98 PolarHBondContact O-N 2.72Å; D94-E205 PolarHBondContact N-OE1 3.42Å
95	G	98.3	Very high	98.6	Very high	21 Å²	21	49 Å²	49	22%	0.216	25%	0.252	C	S	.	.	H	α-helix	trans	-61.4	-22.4	-179.2	0	0	0	0	0	114	W99	G95-W99 WeakPolarHBondContact O-CB 3.47Å; G95-W99 PolarHBondContact O-N 3.47Å
96	A	98.6	Very high	98.6	Very high	62 Å²	62	45.5 Å²	45.5	51%	0.512	24%	0.235	S	C	.	.	H	α-helix	trans	-79.4	-43.8	174.9	0	0	0	0	0	111.1	D94 W99 E100	D94-A96 PolarHBondContact O-N 3.22Å; D94-A96 WeakPolarHBondContact OD1-CB 3.42Å; D94-A96 PolarHBondContact OD1-N 2.93Å; A96-W99 PolarHBondContact O-N 3.48Å; A96-E100 VanDerWaalsContact O-CB 3.3Å; A96-E100 WeakPolarHBondContact O-CB 3.46Å; A96-E100 WeakPolarHBondContact O-CG 3.27Å; A96-E100 PolarHBondContact O-N 3.24Å
97	R	98.8	Very high	98.6	Very high	59 Å²	59	46.6 Å²	46.6	22%	0.223	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-45.9	174	-176.5	176	59.1	-113.8	2.6	111.9	L92 D94 W99 T101 H102 E205	L92-R97 PolarHBondContact O-NH2 2.95Å; D94-R97 HydrophobicContact CB-CB 3.87Å; D94-R97 VanDerWaalsContact CB-CZ 3.42Å; D94-R97 VanDerWaalsContact CB-NH1 3.29Å; D94-R97 PolarHBondContact O-N 2.85Å; D94-R97 PolarHBondContact OD1-N 3.3Å; D94-R97 IonicContact OD2-CZ 3.48Å; D94-R97 IonicContact OD2-NH1 3.71Å; D94-R97 PolarHBondContact OD2-NH1 3.02Å; R97-W99 VanDerWaalsContact C-N 3.26Å; R97-W99 PolarHBondContact O-N 3.44Å; R97-T101 HydrophobicContact CG-CG2 4.46Å; R97-T101 WeakPolarHBondContact O-CA 3.39Å; R97-T101 WeakPolarHBondContact O-CB 3.31Å; R97-T101 PolarHBondContact O-N 3.41Å; R97-H102 PolarHBondContact O-N 2.84Å; R97-E205 IonicContact CZ-OE1 3.72Å; R97-E205 IonicContact CZ-OE2 2.68Å; R97-E205 VanDerWaalsContact CZ-OE2 3.26Å; R97-E205 IonicContact NE-OE1 3.89Å; R97-E205 IonicContact NE-OE2 3.4Å; R97-E205 PolarHBondContact NE-OE2 3.46Å; R97-E205 VanDerWaalsContact NH2-CD 3.26Å; R97-E205 IonicContact NH2-OE1 3.48Å; R97-E205 PolarHBondContact NH2-OE1 3.28Å; R97-E205 IonicContact NH2-OE2 3.32Å; R97-E205 PolarHBondContact NH2-OE2 3.29Å
98	L	98.8	Very high	98.6	Very high	2 Å²	2	43 Å²	43	1%	0.01	23%	0.231	C	C	.	.	I	π-helix	trans	-49.1	-51	173.9	-167	169.9	0	0	0	110.3	D94 H102 L103 A201 E205 V377 T381	D94-L98 WeakPolarHBondContact O-CB 3.3Å; D94-L98 PolarHBondContact O-N 2.72Å; L98-H102 CarbonylContact O-C 3.55Å; L98-H102 WeakPolarHBondContact O-CB 3.22Å; L98-H102 PolarHBondContact O-N 3.18Å; L98-L103 PolarHBondContact O-N 2.87Å; L98-A201 HydrophobicContact CD2-CB 4.08Å; L98-E205 HydrophobicContact CB-CB 4.16Å; L98-E205 HydrophobicContact CB-CG 4Å; L98-E205 HydrophobicContact CD1-CB 4.37Å; L98-E205 HydrophobicContact CD1-CG 4.14Å; L98-E205 HydrophobicContact CG-CB 3.99Å; L98-E205 HydrophobicContact CG-CG 4.13Å; L98-V377 HydrophobicContact CD1-CG1 3.93Å; L98-V377 HydrophobicContact CD2-CG1 3.72Å; L98-T381 HydrophobicContact CD1-CG2 4.17Å; L98-T381 WeakPolarHBondContact CD1-OG1 3.33Å
99	W	98.8	Very high	98.6	Very high	5 Å²	5	41.2 Å²	41.2	2%	0.019	23%	0.228	C	C	.	.	I	π-helix	trans	-76.2	-54.2	-174.8	-147.1	-85.6	0	0	0	114	G95 A96 R97 L103 R104 E369 M372 R374 V377	G95-W99 WeakPolarHBondContact O-CB 3.47Å; G95-W99 PolarHBondContact O-N 3.47Å; A96-W99 PolarHBondContact O-N 3.48Å; R97-W99 VanDerWaalsContact C-N 3.26Å; R97-W99 PolarHBondContact O-N 3.44Å; W99-L103 HydrophobicContact CD2-CD2 3.77Å; W99-L103 HydrophobicContact CE3-CD2 3.87Å; W99-L103 HydrophobicContact CG-CD2 4.43Å; W99-L103 HydrophobicContact CH2-CD2 4.06Å; W99-L103 HydrophobicContact CZ2-CD2 3.92Å; W99-L103 HydrophobicContact CZ3-CD2 4Å; W99-L103 PolarHBondContact O-N 3.32Å; W99-R104 PolarHBondContact O-N 3.15Å; W99-E369 HydrophobicContact CZ2-CG 3.76Å; W99-E369 PolarHBondContact NE1-OE1 3.35Å; W99-M372 HydrophobicContact CH2-CB 3.46Å; W99-M372 VanDerWaalsContact CH2-CB 3.46Å; W99-M372 HydrophobicContact CH2-CG 4.41Å; W99-M372 HydrophobicContact CZ2-CB 3.93Å; W99-R374 VanDerWaalsContact CD1-CZ 3.45Å; W99-R374 HydrophobicContact CD2-CG 4.1Å; W99-R374 HydrophobicContact CE3-CG 3.8Å; W99-R374 VanDerWaalsContact CG-NH1 3.28Å; W99-R374 HydrophobicContact CH2-CB 4.28Å; W99-R374 HydrophobicContact CH2-CG 3.28Å; W99-R374 HydrophobicContact CZ2-CG 3.66Å; W99-R374 HydrophobicContact CZ3-CB 4.15Å; W99-R374 HydrophobicContact CZ3-CG 3.41Å; W99-R374 VanDerWaalsContact CZ3-CG 3.41Å; W99-R374 VanDerWaalsContact NE1-CZ 3.26Å; W99-V377 HydrophobicContact CZ3-CB 4.25Å; W99-V377 HydrophobicContact CZ3-CG1 4.4Å; W99-V377 HydrophobicContact CZ3-CG2 4.14Å
100	E	98.6	Very high	98.6	Very high	85 Å²	85	41 Å²	41	40%	0.397	23%	0.227	S	C	.	.	I	π-helix	trans	-83.1	-28.4	-168.9	-55.6	-58.7	138.1	0	0	112.5	A96 R104 R374	A96-E100 VanDerWaalsContact O-CB 3.3Å; A96-E100 WeakPolarHBondContact O-CB 3.46Å; A96-E100 WeakPolarHBondContact O-CG 3.27Å; A96-E100 PolarHBondContact O-N 3.24Å; E100-R104 VanDerWaalsContact CD-NH1 3.3Å; E100-R104 IonicContact OE1-CZ 3.4Å; E100-R104 IonicContact OE1-NE 3.71Å; E100-R104 IonicContact OE1-NH1 3.27Å; E100-R104 PolarHBondContact OE1-NH1 2.84Å; E100-R104 WeakPolarHBondContact OE2-CD 3.3Å; E100-R104 IonicContact OE2-CZ 2.58Å; E100-R104 IonicContact OE2-NE 3.59Å; E100-R104 IonicContact OE2-NH1 2.69Å; E100-R104 PolarHBondContact OE2-NH1 2.91Å; E100-R374 IonicContact OE1-NH1 3.98Å
101	T	98.8	Very high	98.6	Very high	70 Å²	70	42 Å²	42	43%	0.429	23%	0.231	S	C	.	.	I	π-helix	trans	-102.6	-32.4	-177.4	-48.3	0	0	0	0	113.1	R97 H123	R97-T101 HydrophobicContact CG-CG2 4.46Å; R97-T101 WeakPolarHBondContact O-CA 3.39Å; R97-T101 WeakPolarHBondContact O-CB 3.31Å; R97-T101 PolarHBondContact O-N 3.41Å; T101-H123 PolarHBondContact O-CE1 3.01Å; T101-H123 PolarHBondContact O-NE2 3.13Å
102	H	98.8	Very high	98.6	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.019	20%	0.204	C	C	.	.	I	π-helix	trans	-111.3	-34.5	-174	-58.3	-46	0	0	0	114.7	R97 L98 I106 A201 L204 E205 T208	R97-H102 PolarHBondContact O-N 2.84Å; L98-H102 CarbonylContact O-C 3.55Å; L98-H102 WeakPolarHBondContact O-CB 3.22Å; L98-H102 PolarHBondContact O-N 3.18Å; H102-I106 VanDerWaalsContact O-CD1 3.22Å; H102-I106 WeakPolarHBondContact O-CD1 3.42Å; H102-I106 WeakPolarHBondContact O-CG1 2.99Å; H102-A201 HydrophobicContact CB-CB 3.99Å; H102-L204 HydrophobicContact CB-CB 3.99Å; H102-L204 HydrophobicContact CB-CD1 4.19Å; H102-E205 IonicContact CD2-OE2 3.81Å; H102-E205 IonicContact NE2-OE2 3.77Å; H102-T208 PolarHBondContact NE2-OG1 2.91Å
103	L	98.9	Very high	98.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-85.9	-53.9	179.6	179.9	59.2	0	0	0	112.7	L98 W99 P105 I106 L107 A197 V198 A201	L98-L103 PolarHBondContact O-N 2.87Å; W99-L103 HydrophobicContact CD2-CD2 3.77Å; W99-L103 HydrophobicContact CE3-CD2 3.87Å; W99-L103 HydrophobicContact CG-CD2 4.43Å; W99-L103 HydrophobicContact CH2-CD2 4.06Å; W99-L103 HydrophobicContact CZ2-CD2 3.92Å; W99-L103 HydrophobicContact CZ3-CD2 4Å; W99-L103 PolarHBondContact O-N 3.32Å; L103-P105 VanDerWaalsContact C-CD 3.5Å; L103-I106 WeakPolarHBondContact O-CA 3.46Å; L103-I106 WeakPolarHBondContact O-CB 3.37Å; L103-I106 PolarHBondContact O-N 3.28Å; L103-L107 HydrophobicContact CD1-CD1 4.21Å; L103-L107 HydrophobicContact CD1-CD2 4.06Å; L103-L107 HydrophobicContact CD1-CG 3.99Å; L103-L107 HydrophobicContact CD2-CD1 4.28Å; L103-L107 HydrophobicContact CG-CD1 3.81Å; L103-L107 HydrophobicContact CG-CG 4.07Å; L103-L107 PolarHBondContact O-N 3.43Å; L103-A197 HydrophobicContact CD1-CB 3.78Å; L103-V198 HydrophobicContact CD1-CB 4.49Å; L103-V198 HydrophobicContact CD1-CG2 3.77Å; L103-V198 HydrophobicContact CD2-CG2 3.79Å; L103-V198 HydrophobicContact CG-CG2 4.45Å; L103-A201 HydrophobicContact CB-CB 3.69Å; L103-A201 HydrophobicContact CD1-CB 4.19Å
104	R	98.8	Very high	98.5	Very high	106 Å²	106	39.8 Å²	39.8	40%	0.4	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-37.7	-174.2	-82.2	-178.9	166.5	178.9	-4.7	115.3	W99 E100 I106 L107 E369	W99-R104 PolarHBondContact O-N 3.15Å; E100-R104 VanDerWaalsContact CD-NH1 3.3Å; E100-R104 IonicContact OE1-CZ 3.4Å; E100-R104 IonicContact OE1-NE 3.71Å; E100-R104 IonicContact OE1-NH1 3.27Å; E100-R104 PolarHBondContact OE1-NH1 2.84Å; E100-R104 WeakPolarHBondContact OE2-CD 3.3Å; E100-R104 IonicContact OE2-CZ 2.58Å; E100-R104 IonicContact OE2-NE 3.59Å; E100-R104 IonicContact OE2-NH1 2.69Å; E100-R104 PolarHBondContact OE2-NH1 2.91Å; R104-I106 PolarHBondContact O-N 2.89Å; R104-L107 PolarHBondContact O-N 3.32Å; R104-E369 IonicContact CZ-OE1 3.78Å; R104-E369 IonicContact CZ-OE2 3.75Å; R104-E369 IonicContact NE-OE1 2.65Å; R104-E369 PolarHBondContact NE-OE1 2.92Å; R104-E369 IonicContact NE-OE2 3.35Å; R104-E369 PolarHBondContact NE-OE2 3.13Å; R104-E369 IonicContact NH2-OE1 3.47Å; R104-E369 PolarHBondContact NH2-OE1 2.91Å; R104-E369 IonicContact NH2-OE2 2.67Å; R104-E369 PolarHBondContact NH2-OE2 2.87Å; R104-E369 VanDerWaalsContact NH2-OE2 3.16Å
105	P	98.8	Very high	98.5	Very high	49 Å²	49	47.8 Å²	47.8	32%	0.318	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.7	173.9	-24.1	36.7	0	0	0	115.1	L103	L103-P105 VanDerWaalsContact C-CD 3.5Å
106	I	98.9	Very high	98.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-19.6	-178.9	-52.5	-175.3	0	0	0	111.7	H102 L103 R104 I108 R110 V120 I124 A197 C200 L204	H102-I106 VanDerWaalsContact O-CD1 3.22Å; H102-I106 WeakPolarHBondContact O-CD1 3.42Å; H102-I106 WeakPolarHBondContact O-CG1 2.99Å; L103-I106 WeakPolarHBondContact O-CA 3.46Å; L103-I106 WeakPolarHBondContact O-CB 3.37Å; L103-I106 PolarHBondContact O-N 3.28Å; R104-I106 PolarHBondContact O-N 2.89Å; I106-I108 PolarHBondContact O-N 3.24Å; I106-R110 WeakPolarHBondContact O-CD 3.41Å; I106-R110 PolarHBondContact O-NH1 2.95Å; I106-V120 HydrophobicContact CB-CG1 4.44Å; I106-V120 HydrophobicContact CD1-CG1 4.48Å; I106-V120 HydrophobicContact CG1-CG1 4.14Å; I106-V120 HydrophobicContact CG2-CG1 3.87Å; I106-V120 HydrophobicContact CG2-CG2 4.3Å; I106-I124 HydrophobicContact CD1-CG1 4.5Å; I106-A197 HydrophobicContact CB-CB 4.27Å; I106-A197 HydrophobicContact CG2-CB 3.7Å; I106-C200 HydrophobicContact CD1-CB 3.54Å; I106-L204 HydrophobicContact CD1-CD1 4.22Å
107	L	98.7	Very high	98.5	Very high	23 Å²	23	44.5 Å²	44.5	12%	0.12	23%	0.225	C	C	.	.			trans	-77	59.7	179.2	-66.8	177.3	0	0	0	112.9	L103 R104 A193 A197 E369	L103-L107 HydrophobicContact CD1-CD1 4.21Å; L103-L107 HydrophobicContact CD1-CD2 4.06Å; L103-L107 HydrophobicContact CD1-CG 3.99Å; L103-L107 HydrophobicContact CD2-CD1 4.28Å; L103-L107 HydrophobicContact CG-CD1 3.81Å; L103-L107 HydrophobicContact CG-CG 4.07Å; L103-L107 PolarHBondContact O-N 3.43Å; R104-L107 PolarHBondContact O-N 3.32Å; L107-A193 HydrophobicContact CD2-CB 3.55Å; L107-A197 HydrophobicContact CD2-CB 3.85Å; L107-E369 HydrophobicContact CD1-CB 3.8Å; L107-E369 HydrophobicContact CD1-CG 3.82Å
108	I	98.4	Very high	98.5	Very high	65 Å²	65	45.6 Å²	45.6	33%	0.333	23%	0.234	S	C	.	.	S	Bend	trans	-134	158.1	171.9	59.9	175.8	0	0	0	109.1	I106 R110 A119 V120	I106-I108 PolarHBondContact O-N 3.24Å; I108-R110 WeakPolarHBondContact O-CG 3.5Å; I108-R110 PolarHBondContact O-N 3.1Å; I108-A119 HydrophobicContact CD1-CB 4.2Å; I108-V120 HydrophobicContact CD1-CG2 4.09Å; I108-V120 HydrophobicContact CG1-CG2 4.05Å
109	E	98.1	Very high	98.5	Very high	86 Å²	86	47.6 Å²	47.6	40%	0.402	25%	0.251	S	S	.	.			trans	-59.4	124.9	166.6	179.3	-176.2	-115.1	0	0	109.1	L111 G116 V189	E109-L111 HydrophobicContact CG-CD2 4.14Å; E109-L111 HydrophobicContact CG-CG 3.92Å; E109-G116 WeakPolarHBondContact O-CA 3.35Å; E109-V189 HydrophobicContact CB-CB 4.03Å; E109-V189 HydrophobicContact CB-CG1 4.47Å; E109-V189 HydrophobicContact CB-CG2 3.89Å; E109-V189 HydrophobicContact CG-CB 4.48Å
110	R	98.5	Very high	98.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	S	.	.			trans	-141.4	39.2	-166.9	59.4	-172.6	-170.6	-93	-18.6	112.3	I106 I108 S117 V120 Y174 D175 S176 L191 G192 D195	I106-R110 WeakPolarHBondContact O-CD 3.41Å; I106-R110 PolarHBondContact O-NH1 2.95Å; I108-R110 WeakPolarHBondContact O-CG 3.5Å; I108-R110 PolarHBondContact O-N 3.1Å; R110-S117 WeakPolarHBondContact O-CB 3.42Å; R110-V120 HydrophobicContact CB-CG2 4.13Å; R110-Y174 WeakPolarHBondContact CD-O 3.19Å; R110-Y174 PolarHBondContact NE-O 2.87Å; R110-D175 VanDerWaalsContact CZ-O 3.26Å; R110-D175 PolarHBondContact NE-O 3.44Å; R110-D175 PolarHBondContact NH2-O 3.2Å; R110-S176 WeakPolarHBondContact CG-OG 3.46Å; R110-S176 PolarHBondContact N-OG 2.72Å; R110-S176 VanDerWaalsContact N-OG 3.07Å; R110-L191 PolarHBondContact NH1-O 3.2Å; R110-L191 PolarHBondContact NH2-O 3.44Å; R110-G192 PolarHBondContact NH2-O 3.28Å; R110-D195 PolarHBondContact NH2-O 3.14Å
111	L	98.3	Very high	98.6	Very high	26 Å²	26	44.2 Å²	44.2	14%	0.136	24%	0.236	C	C	.	.			trans	-54	145.8	176	-40.1	-178.5	0	0	0	110.6	E109 T114 S117 S176 A178	E109-L111 HydrophobicContact CG-CD2 4.14Å; E109-L111 HydrophobicContact CG-CG 3.92Å; L111-T114 HydrophobicContact CB-CG2 3.81Å; L111-T114 HydrophobicContact CG-CG2 4.47Å; L111-T114 VanDerWaalsContact O-CB 3.3Å; L111-T114 WeakPolarHBondContact O-CB 3.47Å; L111-T114 VanDerWaalsContact O-CG2 3.28Å; L111-T114 WeakPolarHBondContact O-CG2 3.42Å; L111-T114 PolarHBondContact O-N 3.19Å; L111-T114 VanDerWaalsContact O-N 3.13Å; L111-T114 PolarHBondContact O-OG1 3.02Å; L111-S117 VanDerWaalsContact O-CB 3.24Å; L111-S117 WeakPolarHBondContact O-CB 3.27Å; L111-S176 WeakPolarHBondContact CD2-O 3.21Å; L111-A178 HydrophobicContact CD1-CB 4.03Å; L111-A178 HydrophobicContact CD2-CB 3.98Å
112	P	98.6	Very high	98.6	Very high	11 Å²	11	46.2 Å²	46.2	7%	0.071	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	141.1	-176.7	-25.5	34.1	0	0	0	113.2	T114 V151 F153 D175 D232 F237	P112-T114 PolarHBondContact O-N 3.37Å; P112-V151 HydrophobicContact CB-CG1 4.02Å; P112-F153 HydrophobicContact CB-CD1 3.57Å; P112-F153 HydrophobicContact CB-CE1 3.59Å; P112-F153 HydrophobicContact CB-CG 4.47Å; P112-F153 HydrophobicContact CB-CZ 4.49Å; P112-F153 HydrophobicContact CG-CD1 4.02Å; P112-F153 HydrophobicContact CG-CE1 3.81Å; P112-D175 HydrophobicContact CG-CB 4.01Å; P112-D232 WeakPolarHBondContact CB-OD1 3.46Å; P112-F237 HydrophobicContact CB-CZ 4.13Å; P112-F237 HydrophobicContact CG-CE2 4.47Å; P112-F237 HydrophobicContact CG-CZ 3.98Å
113	G	96.9	Very high	98.6	Very high	53 Å²	53	47.6 Å²	47.6	55%	0.546	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	-1.7	-176.8	0	0	0	0	0	116.2	T152	G113-T152 WeakPolarHBondContact CA-O 3.3Å; G113-T152 PolarHBondContact N-O 2.85Å
114	T	98.1	Very high	98.6	Very high	47 Å²	47	47.6 Å²	47.6	29%	0.288	25%	0.247	S	C	.	.	S	Bend	trans	-82.6	169.6	176	67.8	0	0	0	0	113.1	L111 P112 G116 S117 L118	L111-T114 HydrophobicContact CB-CG2 3.81Å; L111-T114 HydrophobicContact CG-CG2 4.47Å; L111-T114 VanDerWaalsContact O-CB 3.3Å; L111-T114 WeakPolarHBondContact O-CB 3.47Å; L111-T114 VanDerWaalsContact O-CG2 3.28Å; L111-T114 WeakPolarHBondContact O-CG2 3.42Å; L111-T114 PolarHBondContact O-N 3.19Å; L111-T114 VanDerWaalsContact O-N 3.13Å; L111-T114 PolarHBondContact O-OG1 3.02Å; P112-T114 PolarHBondContact O-N 3.37Å; T114-G116 PolarHBondContact O-N 3.18Å; T114-G116 PolarHBondContact OG1-N 2.74Å; T114-S117 PolarHBondContact O-N 2.66Å; T114-S117 PolarHBondContact OG1-N 2.82Å; T114-L118 PolarHBondContact O-N 3.34Å; T114-L118 VanDerWaalsContact O-N 3.09Å
115	R	98.4	Very high	98.6	Very high	229 Å²	229	43.3 Å²	43.3	86%	0.864	23%	0.233	S	C	*	.	H	α-helix	trans	-62	-27.6	169.9	-69.4	-175.1	177.8	-177.4	-0.4	113.1	A119	R115-A119 WeakPolarHBondContact O-CB 3.47Å; R115-A119 PolarHBondContact O-N 2.83Å
116	G	98.6	Very high	98.6	Very high	11 Å²	11	44.3 Å²	44.3	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-70.5	-50.9	176.1	0	0	0	0	0	111.8	E109 T114 L118 A119 V120	E109-G116 WeakPolarHBondContact O-CA 3.35Å; T114-G116 PolarHBondContact O-N 3.18Å; T114-G116 PolarHBondContact OG1-N 2.74Å; G116-L118 VanDerWaalsContact C-N 3.31Å; G116-L118 PolarHBondContact O-N 2.97Å; G116-A119 PolarHBondContact O-N 2.88Å; G116-V120 WeakPolarHBondContact O-CG2 3.32Å; G116-V120 PolarHBondContact O-N 2.8Å
117	S	98.7	Very high	98.6	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-54	-47.8	173.3	171.6	0	0	0	0	110.8	R110 L111 T114 A119 V120 Q121 Y174	R110-S117 WeakPolarHBondContact O-CB 3.42Å; L111-S117 VanDerWaalsContact O-CB 3.24Å; L111-S117 WeakPolarHBondContact O-CB 3.27Å; T114-S117 PolarHBondContact O-N 2.66Å; T114-S117 PolarHBondContact OG1-N 2.82Å; S117-A119 VanDerWaalsContact C-N 3.34Å; S117-A119 PolarHBondContact O-N 3.02Å; S117-V120 PolarHBondContact O-N 2.7Å; S117-Q121 WeakPolarHBondContact O-CB 3.34Å; S117-Q121 PolarHBondContact O-N 3.33Å; S117-Y174 WeakPolarHBondContact OG-CE2 3.39Å; S117-Y174 PolarHBondContact OG-OH 2.77Å
118	L	98.8	Very high	98.6	Very high	81 Å²	81	44.1 Å²	44.1	42%	0.424	24%	0.241	S	C	.	.	H	α-helix	trans	-59.9	-37.5	176.2	-180	60.3	0	0	0	113.7	T114 G116 Q121 Q122	T114-L118 PolarHBondContact O-N 3.34Å; T114-L118 VanDerWaalsContact O-N 3.09Å; G116-L118 VanDerWaalsContact C-N 3.31Å; G116-L118 PolarHBondContact O-N 2.97Å; L118-Q121 VanDerWaalsContact CD1-OE1 3.24Å; L118-Q122 HydrophobicContact CD1-CG 4.35Å; L118-Q122 WeakPolarHBondContact O-CB 3.3Å; L118-Q122 WeakPolarHBondContact O-CG 3.42Å; L118-Q122 PolarHBondContact O-N 3.28Å
119	A	98.9	Very high	98.6	Very high	44 Å²	44	44.6 Å²	44.6	36%	0.364	25%	0.251	S	S	.	.	H	α-helix	trans	-70	-41.6	177.8	0	0	0	0	0	112	I108 R115 G116 S117 Q122 H123	I108-A119 HydrophobicContact CD1-CB 4.2Å; R115-A119 WeakPolarHBondContact O-CB 3.47Å; R115-A119 PolarHBondContact O-N 2.83Å; G116-A119 PolarHBondContact O-N 2.88Å; S117-A119 VanDerWaalsContact C-N 3.34Å; S117-A119 PolarHBondContact O-N 3.02Å; A119-Q122 PolarHBondContact O-N 3.29Å; A119-H123 WeakPolarHBondContact O-CB 3.42Å; A119-H123 PolarHBondContact O-N 3.38Å
120	V	98.9	Very high	98.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67	-45.3	176.2	174.1	0	0	0	0	111.2	I106 I108 R110 G116 S117 Q122 H123 I124 Y174	I106-V120 HydrophobicContact CB-CG1 4.44Å; I106-V120 HydrophobicContact CD1-CG1 4.48Å; I106-V120 HydrophobicContact CG1-CG1 4.14Å; I106-V120 HydrophobicContact CG2-CG1 3.87Å; I106-V120 HydrophobicContact CG2-CG2 4.3Å; I108-V120 HydrophobicContact CD1-CG2 4.09Å; I108-V120 HydrophobicContact CG1-CG2 4.05Å; R110-V120 HydrophobicContact CB-CG2 4.13Å; G116-V120 WeakPolarHBondContact O-CG2 3.32Å; G116-V120 PolarHBondContact O-N 2.8Å; S117-V120 PolarHBondContact O-N 2.7Å; V120-Q122 VanDerWaalsContact C-N 3.31Å; V120-Q122 PolarHBondContact O-N 2.88Å; V120-H123 WeakPolarHBondContact O-CB 3.22Å; V120-H123 PolarHBondContact O-N 3.18Å; V120-H123 VanDerWaalsContact O-N 3.11Å; V120-I124 HydrophobicContact CG1-CD1 3.72Å; V120-I124 HydrophobicContact CG1-CG1 4.37Å; V120-I124 WeakPolarHBondContact O-CG1 3.26Å; V120-I124 PolarHBondContact O-N 2.8Å; V120-Y174 HydrophobicContact CB-CD2 4.05Å; V120-Y174 HydrophobicContact CB-CE2 4.46Å; V120-Y174 HydrophobicContact CG1-CD2 3.54Å; V120-Y174 HydrophobicContact CG1-CE2 4.37Å; V120-Y174 HydrophobicContact CG1-CG 4.19Å
121	Q	98.7	Very high	98.6	Very high	19 Å²	19	45.6 Å²	45.6	9%	0.089	27%	0.266	C	S	.	.	H	α-helix	trans	-52.9	-47.7	172.4	-174.3	-158.1	13.4	0	0	111.5	S117 L118 A125 L139 V156 Y174	S117-Q121 WeakPolarHBondContact O-CB 3.34Å; S117-Q121 PolarHBondContact O-N 3.33Å; L118-Q121 VanDerWaalsContact CD1-OE1 3.24Å; Q121-A125 VanDerWaalsContact O-CB 3.26Å; Q121-A125 WeakPolarHBondContact O-CB 3.35Å; Q121-A125 PolarHBondContact O-N 2.58Å; Q121-L139 HydrophobicContact CG-CD2 4.43Å; Q121-V156 HydrophobicContact CB-CG2 4.43Å; Q121-V156 HydrophobicContact CG-CG2 3.67Å; Q121-Y174 HydrophobicContact CB-CE2 4.23Å
122	Q	98.9	Very high	98.6	Very high	113 Å²	113	47 Å²	47	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-65.8	-39.5	176.4	-75.1	174.2	15.8	0	0	112.5	L118 A119 V120 S126	L118-Q122 HydrophobicContact CD1-CG 4.35Å; L118-Q122 WeakPolarHBondContact O-CB 3.3Å; L118-Q122 WeakPolarHBondContact O-CG 3.42Å; L118-Q122 PolarHBondContact O-N 3.28Å; A119-Q122 PolarHBondContact O-N 3.29Å; V120-Q122 VanDerWaalsContact C-N 3.31Å; V120-Q122 PolarHBondContact O-N 2.88Å; Q122-S126 WeakPolarHBondContact O-CB 3.28Å; Q122-S126 PolarHBondContact O-N 2.83Å; Q122-S126 PolarHBondContact O-OG 3.12Å
123	H	98.9	Very high	98.6	Very high	33 Å²	33	46.7 Å²	46.7	15%	0.153	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-49.8	175.8	173.6	61.8	0	0	0	111.8	T101 A119 V120 S126 T127	T101-H123 PolarHBondContact O-CE1 3.01Å; T101-H123 PolarHBondContact O-NE2 3.13Å; A119-H123 WeakPolarHBondContact O-CB 3.42Å; A119-H123 PolarHBondContact O-N 3.38Å; V120-H123 WeakPolarHBondContact O-CB 3.22Å; V120-H123 PolarHBondContact O-N 3.18Å; V120-H123 VanDerWaalsContact O-N 3.11Å; H123-S126 PolarHBondContact O-OG 3.34Å; H123-T127 PolarHBondContact CE1-OG1 3.3Å; H123-T127 VanDerWaalsContact O-CB 3.25Å; H123-T127 WeakPolarHBondContact O-CB 3.47Å; H123-T127 PolarHBondContact O-N 3.29Å; H123-T127 PolarHBondContact O-OG1 3.5Å
124	I	98.9	Very high	98.7	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-53.9	177.6	-67	164.4	0	0	0	110.2	I106 V120 S126 T127 L128 V156 Y174 L204 F230	I106-I124 HydrophobicContact CD1-CG1 4.5Å; V120-I124 HydrophobicContact CG1-CD1 3.72Å; V120-I124 HydrophobicContact CG1-CG1 4.37Å; V120-I124 WeakPolarHBondContact O-CG1 3.26Å; V120-I124 PolarHBondContact O-N 2.8Å; I124-S126 PolarHBondContact O-N 2.88Å; I124-T127 PolarHBondContact O-N 3.21Å; I124-L128 HydrophobicContact CG2-CD1 3.94Å; I124-L128 WeakPolarHBondContact O-CG 3.49Å; I124-L128 PolarHBondContact O-N 2.84Å; I124-L128 VanDerWaalsContact O-N 3.07Å; I124-V156 HydrophobicContact CG2-CB 4.24Å; I124-V156 HydrophobicContact CG2-CG1 3.93Å; I124-V156 HydrophobicContact CG2-CG2 4.49Å; I124-Y174 HydrophobicContact CD1-CD1 4.42Å; I124-Y174 HydrophobicContact CD1-CD2 4.44Å; I124-Y174 HydrophobicContact CD1-CG 3.97Å; I124-L204 HydrophobicContact CG1-CD1 4.28Å; I124-L204 HydrophobicContact CG2-CD2 4.32Å; I124-F230 HydrophobicContact CD1-CB 4.11Å; I124-F230 HydrophobicContact CD1-CD1 3.76Å; I124-F230 HydrophobicContact CD1-CE1 4.39Å; I124-F230 HydrophobicContact CD1-CG 4.01Å; I124-F230 HydrophobicContact CG1-CD1 4.27Å; I124-F230 HydrophobicContact CG1-CE1 4.43Å; I124-F230 HydrophobicContact CG2-CB 4.43Å; I124-F230 HydrophobicContact CG2-CD1 3.99Å; I124-F230 HydrophobicContact CG2-CD2 3.5Å; I124-F230 VanDerWaalsContact CG2-CD2 3.5Å; I124-F230 HydrophobicContact CG2-CE1 4.05Å; I124-F230 HydrophobicContact CG2-CE2 3.61Å; I124-F230 HydrophobicContact CG2-CG 3.71Å; I124-F230 HydrophobicContact CG2-CZ 3.87Å
125	A	98.9	Very high	98.7	Very high	15 Å²	15	44.7 Å²	44.7	12%	0.124	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-41.6	-174.8	0	0	0	0	0	112.7	Q121 S129 V137 V156	Q121-A125 VanDerWaalsContact O-CB 3.26Å; Q121-A125 WeakPolarHBondContact O-CB 3.35Å; Q121-A125 PolarHBondContact O-N 2.58Å; A125-S129 VanDerWaalsContact O-CB 3.25Å; A125-S129 WeakPolarHBondContact O-CB 3.24Å; A125-S129 PolarHBondContact O-N 2.94Å; A125-S129 PolarHBondContact O-OG 3.25Å; A125-V137 HydrophobicContact CB-CG1 3.97Å; A125-V156 HydrophobicContact CB-CG1 4.22Å
126	S	98.8	Very high	98.7	Very high	71 Å²	71	35.8 Å²	35.8	50%	0.497	23%	0.232	S	C	.	.	H	α-helix	trans	-69.8	-38.7	177.7	60.8	0	0	0	0	112.5	Q122 H123 I124 S129 S130	Q122-S126 WeakPolarHBondContact O-CB 3.28Å; Q122-S126 PolarHBondContact O-N 2.83Å; Q122-S126 PolarHBondContact O-OG 3.12Å; H123-S126 PolarHBondContact O-OG 3.34Å; I124-S126 PolarHBondContact O-N 2.88Å; S126-S129 PolarHBondContact O-N 3.46Å; S126-S130 WeakPolarHBondContact O-CB 3.33Å; S126-S130 PolarHBondContact O-N 3.38Å
127	T	98.9	Very high	98.7	Very high	18 Å²	18	36.9 Å²	36.9	11%	0.11	24%	0.236	C	C	.	.	H	α-helix	trans	-57	-55	174	-62.1	0	0	0	0	110.1	H123 I124 S129 S130 L204	H123-T127 PolarHBondContact CE1-OG1 3.3Å; H123-T127 VanDerWaalsContact O-CB 3.25Å; H123-T127 WeakPolarHBondContact O-CB 3.47Å; H123-T127 PolarHBondContact O-N 3.29Å; H123-T127 PolarHBondContact O-OG1 3.5Å; I124-T127 PolarHBondContact O-N 3.21Å; T127-S129 VanDerWaalsContact C-N 3.34Å; T127-S129 PolarHBondContact O-N 3.12Å; T127-S130 WeakPolarHBondContact O-CB 3.23Å; T127-S130 PolarHBondContact O-N 3.28Å; T127-S130 VanDerWaalsContact O-N 3.11Å; T127-S130 PolarHBondContact O-OG 2.93Å; T127-L204 HydrophobicContact CG2-CD2 4.03Å
128	L	98.9	Very high	98.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.3	-35.5	-178.2	-65.3	169.7	0	0	0	113.1	I124 S130 L131 V137 A158 L204 A207 L228 F230	I124-L128 HydrophobicContact CG2-CD1 3.94Å; I124-L128 WeakPolarHBondContact O-CG 3.49Å; I124-L128 PolarHBondContact O-N 2.84Å; I124-L128 VanDerWaalsContact O-N 3.07Å; L128-S130 VanDerWaalsContact C-N 3.26Å; L128-S130 PolarHBondContact O-N 3.42Å; L128-L131 HydrophobicContact CD2-CD1 4.09Å; L128-L131 PolarHBondContact O-N 3.46Å; L128-V137 HydrophobicContact CB-CG2 3.97Å; L128-A158 HydrophobicContact CD1-CB 3.81Å; L128-L204 HydrophobicContact CD1-CD2 4.23Å; L128-L204 HydrophobicContact CD2-CD2 3.99Å; L128-L204 HydrophobicContact CG-CD2 3.87Å; L128-A207 HydrophobicContact CD2-CB 3.78Å; L128-L228 HydrophobicContact CD1-CD1 4.4Å; L128-L228 HydrophobicContact CD2-CD1 3.77Å; L128-F230 HydrophobicContact CD1-CE2 3.67Å; L128-F230 HydrophobicContact CD1-CZ 4.25Å
129	S	98.7	Very high	98.7	Very high	75 Å²	75	41.3 Å²	41.3	52%	0.524	26%	0.259	S	S	.	.	H	α-helix	trans	-68.9	-21.7	175.6	-58.7	0	0	0	0	113.5	A125 S126 T127	A125-S129 VanDerWaalsContact O-CB 3.25Å; A125-S129 WeakPolarHBondContact O-CB 3.24Å; A125-S129 PolarHBondContact O-N 2.94Å; A125-S129 PolarHBondContact O-OG 3.25Å; S126-S129 PolarHBondContact O-N 3.46Å; T127-S129 VanDerWaalsContact C-N 3.34Å; T127-S129 PolarHBondContact O-N 3.12Å
130	S	98.6	Very high	98.7	Very high	91 Å²	91	40.1 Å²	40.1	64%	0.636	25%	0.247	S	C	*	.	H	α-helix	trans	-81.8	-16.9	178.2	77.7	0	0	0	0	114.1	S126 T127 L128	S126-S130 WeakPolarHBondContact O-CB 3.33Å; S126-S130 PolarHBondContact O-N 3.38Å; T127-S130 WeakPolarHBondContact O-CB 3.23Å; T127-S130 PolarHBondContact O-N 3.28Å; T127-S130 VanDerWaalsContact O-N 3.11Å; T127-S130 PolarHBondContact O-OG 2.93Å; L128-S130 VanDerWaalsContact C-N 3.26Å; L128-S130 PolarHBondContact O-N 3.42Å
131	L	98.8	Very high	98.7	Very high	17 Å²	17	43.6 Å²	43.6	9%	0.089	27%	0.272	C	S	.	.	S	Bend	trans	-71.4	137.3	-175	-64.8	-178.3	0	0	0	112.2	L128 A133 G134 A207 T208 D211	L128-L131 HydrophobicContact CD2-CD1 4.09Å; L128-L131 PolarHBondContact O-N 3.46Å; L131-A133 PolarHBondContact O-N 3.07Å; L131-G134 PolarHBondContact O-N 2.87Å; L131-A207 HydrophobicContact CD1-CB 3.66Å; L131-T208 HydrophobicContact CD2-CG2 4.1Å; L131-D211 WeakPolarHBondContact CB-OD1 3.16Å; L131-D211 HydrophobicContact CD2-CB 4.45Å
132	S	98.5	Very high	98.7	Very high	54 Å²	54	43.9 Å²	43.9	38%	0.378	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.4	-170.1	89.9	0	0	0	0	114.7	G134 D211 R215	S132-G134 PolarHBondContact O-N 3.43Å; S132-D211 VanDerWaalsContact CB-OD2 3.24Å; S132-D211 WeakPolarHBondContact CB-OD2 3.2Å; S132-D211 VanDerWaalsContact N-CG 3.34Å; S132-D211 PolarHBondContact N-OD1 3.44Å; S132-D211 PolarHBondContact N-OD2 2.89Å; S132-D211 VanDerWaalsContact N-OD2 3.13Å; S132-D211 PolarHBondContact OG-OD2 2.93Å; S132-R215 VanDerWaalsContact O-CD 3.3Å; S132-R215 WeakPolarHBondContact O-CD 3.39Å; S132-R215 PolarHBondContact O-NE 3.16Å; S132-R215 WeakPolarHBondContact OG-CD 3.37Å; S132-R215 PolarHBondContact OG-NH1 3.12Å
133	A	98.4	Very high	98.7	Very high	5 Å²	5	44.8 Å²	44.8	4%	0.041	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19	162.8	0	0	0	0	0	113.2	L131 L160 D211 L214 R215 K218	L131-A133 PolarHBondContact O-N 3.07Å; A133-L160 HydrophobicContact CB-CD1 3.74Å; A133-D211 VanDerWaalsContact CB-OD1 3.28Å; A133-D211 WeakPolarHBondContact CB-OD1 3.32Å; A133-D211 PolarHBondContact N-OD1 2.85Å; A133-L214 HydrophobicContact CB-CB 4.14Å; A133-R215 HydrophobicContact CB-CB 4.01Å; A133-K218 VanDerWaalsContact O-CD 3.3Å; A133-K218 WeakPolarHBondContact O-CD 3.3Å; A133-K218 PolarHBondContact O-NZ 3.4Å
134	G	98.2	Very high	98.7	Very high	39 Å²	39	44.3 Å²	44.3	40%	0.402	28%	0.277	S	S	.	.			trans	64.4	65.9	171.4	0	0	0	0	0	112.9	L131 S132 K218	L131-G134 PolarHBondContact O-N 2.87Å; S132-G134 PolarHBondContact O-N 3.43Å; G134-K218 PolarHBondContact O-NZ 2.89Å
135	W	98.8	Very high	98.6	Very high	19 Å²	19	48.6 Å²	48.6	7%	0.072	31%	0.305	C	S	.	.			trans	-61.9	145.5	177.7	-66.4	84.7	0	0	0	112	V137 A158 L160 A207 L214 L226 L228	W135-V137 HydrophobicContact CB-CG2 3.93Å; W135-A158 HydrophobicContact CD2-CB 4.45Å; W135-A158 HydrophobicContact CE3-CB 3.84Å; W135-A158 HydrophobicContact CZ3-CB 4.4Å; W135-L160 HydrophobicContact CD2-CB 4.29Å; W135-L160 HydrophobicContact CD2-CD1 4.36Å; W135-L160 HydrophobicContact CE3-CB 3.84Å; W135-L160 VanDerWaalsContact CE3-N 3.3Å; W135-L160 HydrophobicContact CH2-CB 4.01Å; W135-L160 HydrophobicContact CZ2-CB 4.44Å; W135-L160 HydrophobicContact CZ3-CB 3.68Å; W135-A207 HydrophobicContact CZ2-CB 4.23Å; W135-L214 HydrophobicContact CZ2-CD1 4.05Å; W135-L226 HydrophobicContact CH2-CB 4.2Å; W135-L226 HydrophobicContact CH2-CD2 3.81Å; W135-L226 HydrophobicContact CH2-CG 3.87Å; W135-L226 HydrophobicContact CZ2-CD2 4.46Å; W135-L226 HydrophobicContact CZ3-CG 4.49Å; W135-L228 HydrophobicContact CH2-CD1 3.57Å; W135-L228 HydrophobicContact CH2-CD2 4.14Å; W135-L228 HydrophobicContact CH2-CG 3.56Å; W135-L228 HydrophobicContact CZ2-CD1 3.9Å; W135-L228 HydrophobicContact CZ2-CG 4.39Å; W135-L228 HydrophobicContact CZ3-CD1 3.96Å; W135-L228 HydrophobicContact CZ3-CG 3.71Å
136	S	98.6	Very high	98.5	Very high	42 Å²	42	48.7 Å²	48.7	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	123.5	155.8	-164.2	0	0	0	0	106.6	D138 A158 V159	S136-D138 PolarHBondContact OG-OD2 2.92Å; S136-A158 CarbonylContact O-C 3.49Å; S136-A158 WeakPolarHBondContact O-CA 3.1Å; S136-V159 PolarHBondContact N-O 2.78Å; S136-V159 PolarHBondContact O-N 3.33Å
137	V	98.8	Very high	98.5	Very high	34 Å²	34	48.5 Å²	48.5	21%	0.206	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	112.5	178.8	-176.4	0	0	0	0	107.9	A125 L128 W135 V156 A158	A125-V137 HydrophobicContact CB-CG1 3.97Å; L128-V137 HydrophobicContact CB-CG2 3.97Å; W135-V137 HydrophobicContact CB-CG2 3.93Å; V137-V156 HydrophobicContact CG1-CG1 4.06Å; V137-A158 HydrophobicContact CG2-CB 4.12Å
138	D	98.4	Very high	98.3	Very high	87 Å²	87	54.1 Å²	54.1	47%	0.465	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	148.4	-173.6	-65.2	-75.4	0	0	0	109.5	S136 V157	S136-D138 PolarHBondContact OG-OD2 2.92Å; D138-V157 PolarHBondContact N-O 2.9Å; D138-V157 PolarHBondContact O-N 2.74Å
139	L	98.7	Very high	98.1	Very high	91 Å²	91	55.8 Å²	55.8	48%	0.476	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.8	-176	-61.2	-179.5	0	0	0	109.7	Q121 S141 T154 V156	Q121-L139 HydrophobicContact CG-CD2 4.43Å; L139-S141 PolarHBondContact O-N 2.81Å; L139-T154 HydrophobicContact CB-CG2 3.83Å; L139-T154 HydrophobicContact CD2-CG2 4.41Å; L139-V156 HydrophobicContact CD2-CB 4.33Å; L139-V156 HydrophobicContact CD2-CG1 4.07Å; L139-V156 HydrophobicContact CD2-CG2 3.96Å
140	D	98.7	Very high	98.1	Very high	19 Å²	19	58 Å²	58	10%	0.102	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	78.7	179.5	174.3	41.1	0	0	0	110	T154 N155 H251 L252 L255	D140-T154 WeakPolarHBondContact O-CA 3.46Å; D140-N155 HydrophobicContact CB-CB 4.13Å; D140-N155 PolarHBondContact N-O 2.8Å; D140-N155 PolarHBondContact O-N 2.99Å; D140-N155 VanDerWaalsContact O-N 3.16Å; D140-N155 PolarHBondContact OD2-ND2 3.41Å; D140-H251 IonicContact OD1-CE1 3.05Å; D140-H251 PolarHBondContact OD1-CE1 3.16Å; D140-H251 IonicContact OD1-ND1 3.48Å; D140-H251 PolarHBondContact OD1-ND1 2.99Å; D140-H251 VanDerWaalsContact OD1-ND1 3.13Å; D140-H251 IonicContact OD2-CE1 3.71Å; D140-H251 IonicContact OD2-ND1 3.23Å; D140-H251 PolarHBondContact OD2-ND1 2.98Å; D140-L252 HydrophobicContact CB-CD1 4.43Å; D140-L255 VanDerWaalsContact OD1-CD2 3.27Å; D140-L255 WeakPolarHBondContact OD1-CD2 3.45Å
141	S	98.7	Very high	98.1	Very high	74 Å²	74	54.7 Å²	54.7	52%	0.517	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	125.2	-179.3	-62.9	0	0	0	0	112.7	L139 F153 T154	L139-S141 PolarHBondContact O-N 2.81Å; S141-F153 WeakPolarHBondContact CA-O 3.3Å; S141-T154 WeakPolarHBondContact CA-OG1 3.45Å; S141-T154 WeakPolarHBondContact CB-OG1 3.29Å; S141-T154 WeakPolarHBondContact OG-CG2 3.43Å; S141-T154 PolarHBondContact OG-OG1 3.36Å
142	F	98.8	Very high	98.1	Very high	24 Å²	24	56.8 Å²	56.8	11%	0.105	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	168.4	176.8	66	-81.4	0	0	0	111.6	T152 F153 Y247 H251	F142-T152 CarbonylContact O-C 3.59Å; F142-T152 WeakPolarHBondContact O-CA 3.27Å; F142-F153 HydrophobicContact CD1-CB 4.25Å; F142-F153 HydrophobicContact CD2-CB 4.46Å; F142-F153 HydrophobicContact CD2-CD2 4.48Å; F142-F153 HydrophobicContact CE1-CB 3.64Å; F142-F153 HydrophobicContact CE2-CB 3.89Å; F142-F153 AromaticContact CE2-CD2 3.9Å; F142-F153 HydrophobicContact CE2-CD2 3.9Å; F142-F153 HydrophobicContact CE2-CG 4.09Å; F142-F153 HydrophobicContact CZ-CB 3.43Å; F142-F153 VanDerWaalsContact CZ-CB 3.43Å; F142-F153 HydrophobicContact CZ-CD2 4.23Å; F142-F153 AromaticContact CZ-CG 3.93Å; F142-F153 HydrophobicContact CZ-CG 3.93Å; F142-F153 PolarHBondContact N-O 2.69Å; F142-F153 PolarHBondContact O-N 3.3Å; F142-Y247 WeakPolarHBondContact CZ-O 3.43Å; F142-H251 HydrophobicContact CD1-CB 3.88Å; F142-H251 AromaticContact CD1-CD2 3.94Å; F142-H251 AromaticContact CD1-CE1 3.77Å; F142-H251 AromaticContact CD1-CG 3.43Å; F142-H251 VanDerWaalsContact CD1-CG 3.43Å; F142-H251 AromaticContact CD1-ND1 3.32Å; F142-H251 VanDerWaalsContact CD1-ND1 3.32Å; F142-H251 WeakPolarHBondContact CD1-ND1 3.25Å; F142-H251 HydrophobicContact CD2-CB 4.17Å; F142-H251 AromaticContact CD2-CD2 3.8Å; F142-H251 AromaticContact CD2-CG 3.91Å; F142-H251 HydrophobicContact CE1-CB 3.53Å; F142-H251 AromaticContact CE1-CG 3.65Å; F142-H251 AromaticContact CE1-ND1 3.8Å; F142-H251 HydrophobicContact CE2-CB 3.84Å; F142-H251 HydrophobicContact CG-CB 4.2Å; F142-H251 AromaticContact CG-CD2 3.6Å; F142-H251 AromaticContact CG-CE1 3.86Å; F142-H251 AromaticContact CG-CG 3.58Å; F142-H251 AromaticContact CG-ND1 3.76Å; F142-H251 AromaticContact CG-NE2 3.8Å; F142-H251 HydrophobicContact CZ-CB 3.51Å; F142-H251 AromaticContact CZ-CG 3.99Å
143	Q	98.5	Very high	98.1	Very high	132 Å²	132	54.2 Å²	54.2	62%	0.617	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.7	172.5	-67.7	-173.8	9.6	0	0	110.7	Q150 V151 T152	Q143-Q150 HydrophobicContact CB-CG 4.41Å; Q143-V151 CarbonylContact C-O 3.58Å; Q143-V151 VanDerWaalsContact CA-O 3.29Å; Q143-V151 WeakPolarHBondContact CA-O 3.35Å; Q143-T152 HydrophobicContact CG-CG2 4.46Å
144	S	98.3	Very high	98.1	Very high	23 Å²	23	54.5 Å²	54.5	16%	0.161	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.9	176.3	-130.2	0	0	0	0	111.5	Q150 V151	S144-Q150 PolarHBondContact O-NE2 2.95Å; S144-V151 PolarHBondContact N-O 2.86Å; S144-V151 PolarHBondContact O-N 2.83Å
145	P	97.9	Very high	98.2	Very high	91 Å²	91	52.7 Å²	52.7	59%	0.591	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	135	170.7	31.4	-33.2	0	0	0	110.4	Y247	P145-Y247 PolarHBondContact O-OH 3Å
146	T	97.7	Very high	98.2	Very high	16 Å²	16	51.8 Å²	51.8	10%	0.098	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	167.4	173.7	83.1	0	0	0	0	109.2	R148 G149 V151 F153 F237 Y247	T146-R148 PolarHBondContact O-N 2.98Å; T146-R148 VanDerWaalsContact O-N 3.17Å; T146-R148 PolarHBondContact OG1-N 2.94Å; T146-R148 VanDerWaalsContact OG1-N 3.11Å; T146-G149 PolarHBondContact N-O 3.13Å; T146-G149 PolarHBondContact O-N 2.8Å; T146-G149 PolarHBondContact OG1-N 3.48Å; T146-G149 PolarHBondContact OG1-O 2.8Å; T146-G149 VanDerWaalsContact OG1-O 3.1Å; T146-V151 HydrophobicContact CG2-CB 3.83Å; T146-V151 HydrophobicContact CG2-CG2 3.64Å; T146-F153 HydrophobicContact CG2-CE2 4.09Å; T146-F153 HydrophobicContact CG2-CZ 3.72Å; T146-F237 HydrophobicContact CG2-CD2 3.94Å; T146-F237 HydrophobicContact CG2-CE1 4.43Å; T146-F237 HydrophobicContact CG2-CE2 3.69Å; T146-F237 HydrophobicContact CG2-CG 4.43Å; T146-F237 HydrophobicContact CG2-CZ 3.96Å; T146-Y247 WeakPolarHBondContact CA-OH 3.37Å; T146-Y247 WeakPolarHBondContact CB-OH 3.49Å; T146-Y247 HydrophobicContact CG2-CE1 4.08Å; T146-Y247 HydrophobicContact CG2-CE2 4.48Å
147	P	96.9	Very high	98.2	Very high	67 Å²	67	50.6 Å²	50.6	44%	0.435	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-33.7	169.6	-28	36.3	0	0	0	113.2	G149 E238 D244	P147-G149 VanDerWaalsContact C-N 3.34Å; P147-G149 PolarHBondContact O-N 3.43Å; P147-E238 HydrophobicContact CB-CB 4.23Å; P147-E238 HydrophobicContact CB-CG 3.84Å; P147-E238 WeakPolarHBondContact CB-OE1 3.25Å; P147-E238 HydrophobicContact CG-CB 4.27Å; P147-E238 HydrophobicContact CG-CG 4.36Å; P147-D244 HydrophobicContact CG-CB 4.06Å
148	R	94.4	Very high	98.2	Very high	136 Å²	136	49 Å²	49	51%	0.513	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	10	179.3	-52.7	-168.9	-166.6	-173.2	6.3	114	T146 A178 F237	T146-R148 PolarHBondContact O-N 2.98Å; T146-R148 VanDerWaalsContact O-N 3.17Å; T146-R148 PolarHBondContact OG1-N 2.94Å; T146-R148 VanDerWaalsContact OG1-N 3.11Å; R148-A178 PolarHBondContact NH2-O 2.92Å; R148-F237 HydrophobicContact CB-CD1 4.45Å; R148-F237 HydrophobicContact CG-CB 4.28Å; R148-F237 HydrophobicContact CG-CD1 4.35Å; R148-F237 VanDerWaalsContact CZ-O 3.29Å; R148-F237 PolarHBondContact NE-O 3.3Å; R148-F237 VanDerWaalsContact NE-O 3.15Å; R148-F237 PolarHBondContact NH2-O 3.48Å
149	G	96.6	Very high	98.2	Very high	36 Å²	36	45.3 Å²	45.3	37%	0.371	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	109.7	-161.7	175.5	0	0	0	0	0	114.4	T146 P147 V151	T146-G149 PolarHBondContact N-O 3.13Å; T146-G149 PolarHBondContact O-N 2.8Å; T146-G149 PolarHBondContact OG1-N 3.48Å; T146-G149 PolarHBondContact OG1-O 2.8Å; T146-G149 VanDerWaalsContact OG1-O 3.1Å; P147-G149 VanDerWaalsContact C-N 3.34Å; P147-G149 PolarHBondContact O-N 3.43Å; G149-V151 PolarHBondContact O-N 3.03Å
150	Q	98.1	Very high	98.2	Very high	121 Å²	121	41 Å²	41	57%	0.565	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	121.3	179.8	-165.5	76.5	52.3	0	0	110.3	Q143 S144	Q143-Q150 HydrophobicContact CB-CG 4.41Å; S144-Q150 PolarHBondContact O-NE2 2.95Å
151	V	98.5	Very high	98.2	Very high	21 Å²	21	41.4 Å²	41.4	13%	0.127	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.5	178.4	178.7	0	0	0	0	110.2	P112 Q143 S144 T146 G149 F153 F237	P112-V151 HydrophobicContact CB-CG1 4.02Å; Q143-V151 CarbonylContact C-O 3.58Å; Q143-V151 VanDerWaalsContact CA-O 3.29Å; Q143-V151 WeakPolarHBondContact CA-O 3.35Å; S144-V151 PolarHBondContact N-O 2.86Å; S144-V151 PolarHBondContact O-N 2.83Å; T146-V151 HydrophobicContact CG2-CB 3.83Å; T146-V151 HydrophobicContact CG2-CG2 3.64Å; G149-V151 PolarHBondContact O-N 3.03Å; V151-F153 HydrophobicContact CB-CD2 4.43Å; V151-F153 HydrophobicContact CB-CE2 3.71Å; V151-F153 HydrophobicContact CB-CZ 3.96Å; V151-F153 HydrophobicContact CG1-CD2 4.28Å; V151-F153 HydrophobicContact CG1-CE1 4.33Å; V151-F153 HydrophobicContact CG1-CE2 3.87Å; V151-F153 HydrophobicContact CG1-CZ 3.91Å; V151-F237 HydrophobicContact CB-CZ 4.49Å; V151-F237 HydrophobicContact CG1-CZ 4.19Å; V151-F237 HydrophobicContact CG2-CE1 4.12Å; V151-F237 HydrophobicContact CG2-CZ 4.17Å
152	T	98.6	Very high	98.1	Very high	62 Å²	62	41 Å²	41	38%	0.38	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.1	168.6	-55.1	0	0	0	0	108.6	G113 F142 Q143	G113-T152 WeakPolarHBondContact CA-O 3.3Å; G113-T152 PolarHBondContact N-O 2.85Å; F142-T152 CarbonylContact O-C 3.59Å; F142-T152 WeakPolarHBondContact O-CA 3.27Å; Q143-T152 HydrophobicContact CG-CG2 4.46Å
153	F	98.9	Very high	97.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	154.1	175.2	-59.8	-96.5	0	0	0	109	P112 S141 F142 T146 V151 D232 F237 Y247	P112-F153 HydrophobicContact CB-CD1 3.57Å; P112-F153 HydrophobicContact CB-CE1 3.59Å; P112-F153 HydrophobicContact CB-CG 4.47Å; P112-F153 HydrophobicContact CB-CZ 4.49Å; P112-F153 HydrophobicContact CG-CD1 4.02Å; P112-F153 HydrophobicContact CG-CE1 3.81Å; S141-F153 WeakPolarHBondContact CA-O 3.3Å; F142-F153 HydrophobicContact CD1-CB 4.25Å; F142-F153 HydrophobicContact CD2-CB 4.46Å; F142-F153 HydrophobicContact CD2-CD2 4.48Å; F142-F153 HydrophobicContact CE1-CB 3.64Å; F142-F153 HydrophobicContact CE2-CB 3.89Å; F142-F153 AromaticContact CE2-CD2 3.9Å; F142-F153 HydrophobicContact CE2-CD2 3.9Å; F142-F153 HydrophobicContact CE2-CG 4.09Å; F142-F153 HydrophobicContact CZ-CB 3.43Å; F142-F153 VanDerWaalsContact CZ-CB 3.43Å; F142-F153 HydrophobicContact CZ-CD2 4.23Å; F142-F153 AromaticContact CZ-CG 3.93Å; F142-F153 HydrophobicContact CZ-CG 3.93Å; F142-F153 PolarHBondContact N-O 2.69Å; F142-F153 PolarHBondContact O-N 3.3Å; T146-F153 HydrophobicContact CG2-CE2 4.09Å; T146-F153 HydrophobicContact CG2-CZ 3.72Å; V151-F153 HydrophobicContact CB-CD2 4.43Å; V151-F153 HydrophobicContact CB-CE2 3.71Å; V151-F153 HydrophobicContact CB-CZ 3.96Å; V151-F153 HydrophobicContact CG1-CD2 4.28Å; V151-F153 HydrophobicContact CG1-CE1 4.33Å; V151-F153 HydrophobicContact CG1-CE2 3.87Å; V151-F153 HydrophobicContact CG1-CZ 3.91Å; F153-D232 WeakPolarHBondContact CA-OD2 3.35Å; F153-D232 HydrophobicContact CB-CB 4.44Å; F153-F237 AromaticContact CE1-CE2 3.85Å; F153-F237 HydrophobicContact CE1-CE2 3.85Å; F153-F237 HydrophobicContact CE1-CZ 4.03Å; F153-F237 AromaticContact CZ-CE2 3.73Å; F153-F237 HydrophobicContact CZ-CE2 3.73Å; F153-F237 AromaticContact CZ-CZ 3.95Å; F153-F237 HydrophobicContact CZ-CZ 3.95Å; F153-Y247 HydrophobicContact CD1-CG 4.27Å; F153-Y247 HydrophobicContact CE1-CD1 4.2Å; F153-Y247 AromaticContact CE1-CD2 3.75Å; F153-Y247 HydrophobicContact CE1-CD2 3.75Å; F153-Y247 HydrophobicContact CE1-CE2 4.47Å; F153-Y247 AromaticContact CE1-CG 3.58Å; F153-Y247 HydrophobicContact CE1-CG 3.58Å; F153-Y247 AromaticContact CE2-CD1 3.85Å; F153-Y247 HydrophobicContact CE2-CD1 3.85Å; F153-Y247 HydrophobicContact CE2-CE1 4.33Å; F153-Y247 HydrophobicContact CE2-CG 4.07Å; F153-Y247 AromaticContact CZ-CD1 3.6Å; F153-Y247 HydrophobicContact CZ-CD1 3.6Å; F153-Y247 AromaticContact CZ-CD2 3.76Å; F153-Y247 HydrophobicContact CZ-CD2 3.76Å; F153-Y247 HydrophobicContact CZ-CE1 4.01Å; F153-Y247 HydrophobicContact CZ-CE2 4.15Å; F153-Y247 AromaticContact CZ-CG 3.46Å; F153-Y247 HydrophobicContact CZ-CG 3.46Å; F153-Y247 VanDerWaalsContact CZ-CG 3.46Å
154	T	98.9	Very high	97.8	Very high	11 Å²	11	37.2 Å²	37.2	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	105.8	170.7	-58.4	0	0	0	0	114	L139 D140 S141 Y174 D232	L139-T154 HydrophobicContact CB-CG2 3.83Å; L139-T154 HydrophobicContact CD2-CG2 4.41Å; D140-T154 WeakPolarHBondContact O-CA 3.46Å; S141-T154 WeakPolarHBondContact CA-OG1 3.45Å; S141-T154 WeakPolarHBondContact CB-OG1 3.29Å; S141-T154 WeakPolarHBondContact OG-CG2 3.43Å; S141-T154 PolarHBondContact OG-OG1 3.36Å; T154-Y174 WeakPolarHBondContact O-CE1 3.46Å; T154-Y174 PolarHBondContact O-OH 2.96Å; T154-Y174 VanDerWaalsContact O-OH 3.09Å; T154-D232 PolarHBondContact N-OD2 3.15Å
155	N	98.9	Very high	97.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	138.4	170.5	-49.3	-63.4	0	0	0	110.3	D140 V157 F230 F231 D232 G248	D140-N155 HydrophobicContact CB-CB 4.13Å; D140-N155 PolarHBondContact N-O 2.8Å; D140-N155 PolarHBondContact O-N 2.99Å; D140-N155 VanDerWaalsContact O-N 3.16Å; D140-N155 PolarHBondContact OD2-ND2 3.41Å; N155-V157 HydrophobicContact CB-CG2 4.45Å; N155-F230 WeakPolarHBondContact CA-O 3.36Å; N155-F231 VanDerWaalsContact OD1-CA 3.31Å; N155-F231 WeakPolarHBondContact OD1-CA 3.39Å; N155-D232 PolarHBondContact OD1-N 3.47Å; N155-D232 VanDerWaalsContact OD1-N 3.12Å; N155-G248 PolarHBondContact ND2-O 3.4Å; N155-G248 WeakPolarHBondContact OD1-CA 3.47Å
156	V	98.9	Very high	97.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	118.3	169.1	-172.4	0	0	0	0	108.6	Q121 I124 A125 V137 L139 Y174 V229 F230	Q121-V156 HydrophobicContact CB-CG2 4.43Å; Q121-V156 HydrophobicContact CG-CG2 3.67Å; I124-V156 HydrophobicContact CG2-CB 4.24Å; I124-V156 HydrophobicContact CG2-CG1 3.93Å; I124-V156 HydrophobicContact CG2-CG2 4.49Å; A125-V156 HydrophobicContact CB-CG1 4.22Å; V137-V156 HydrophobicContact CG1-CG1 4.06Å; L139-V156 HydrophobicContact CD2-CB 4.33Å; L139-V156 HydrophobicContact CD2-CG1 4.07Å; L139-V156 HydrophobicContact CD2-CG2 3.96Å; V156-Y174 HydrophobicContact CG2-CE1 4.28Å; V156-V229 WeakPolarHBondContact O-CA 3.09Å; V156-F230 HydrophobicContact CB-CB 4.23Å; V156-F230 HydrophobicContact CB-CD2 4.43Å; V156-F230 PolarHBondContact N-O 3.04Å; V156-F230 PolarHBondContact O-N 2.78Å
157	V	98.9	Very high	97.7	Very high	17 Å²	17	33.9 Å²	33.9	10%	0.103	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.4	-177.1	179.6	0	0	0	0	109.1	D138 N155 V159 Q227 V229 L252	D138-V157 PolarHBondContact N-O 2.9Å; D138-V157 PolarHBondContact O-N 2.74Å; N155-V157 HydrophobicContact CB-CG2 4.45Å; V157-V159 HydrophobicContact CG1-CG2 4.28Å; V157-Q227 HydrophobicContact CG1-CG 4.45Å; V157-V229 HydrophobicContact CG2-CG1 4.37Å; V157-V229 HydrophobicContact CG2-CG2 4.42Å; V157-L252 HydrophobicContact CG2-CD1 4.09Å; V157-L252 HydrophobicContact CG2-CD2 3.76Å
158	A	98.9	Very high	97.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125	177.2	0	0	0	0	0	111.3	L128 W135 S136 V137 Q227 L228	L128-A158 HydrophobicContact CD1-CB 3.81Å; W135-A158 HydrophobicContact CD2-CB 4.45Å; W135-A158 HydrophobicContact CE3-CB 3.84Å; W135-A158 HydrophobicContact CZ3-CB 4.4Å; S136-A158 CarbonylContact O-C 3.49Å; S136-A158 WeakPolarHBondContact O-CA 3.1Å; V137-A158 HydrophobicContact CG2-CB 4.12Å; A158-Q227 CarbonylContact O-C 3.47Å; A158-Q227 VanDerWaalsContact O-CA 3.31Å; A158-Q227 WeakPolarHBondContact O-CA 3.08Å; A158-L228 HydrophobicContact CB-CB 4.3Å; A158-L228 PolarHBondContact N-O 3.01Å; A158-L228 PolarHBondContact O-N 3.35Å
159	V	98.8	Very high	98	Very high	11 Å²	11	24.2 Å²	24.2	7%	0.067	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123.7	179.4	-172.7	0	0	0	0	110.1	S136 V157 P162 T225 Q227	S136-V159 PolarHBondContact N-O 2.78Å; S136-V159 PolarHBondContact O-N 3.33Å; V157-V159 HydrophobicContact CG1-CG2 4.28Å; V159-P162 HydrophobicContact CB-CG 4.24Å; V159-P162 HydrophobicContact CG1-CG 4.23Å; V159-T225 HydrophobicContact CG1-CG2 4.15Å; V159-Q227 HydrophobicContact CG2-CB 4.28Å; V159-Q227 HydrophobicContact CG2-CG 4Å
160	L	98.7	Very high	98.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-69	-43.5	-175.4	176.4	59.7	0	0	0	111.8	A133 W135 L214 F217 K218 L226	A133-L160 HydrophobicContact CB-CD1 3.74Å; W135-L160 HydrophobicContact CD2-CB 4.29Å; W135-L160 HydrophobicContact CD2-CD1 4.36Å; W135-L160 HydrophobicContact CE3-CB 3.84Å; W135-L160 VanDerWaalsContact CE3-N 3.3Å; W135-L160 HydrophobicContact CH2-CB 4.01Å; W135-L160 HydrophobicContact CZ2-CB 4.44Å; W135-L160 HydrophobicContact CZ3-CB 3.68Å; L160-L214 HydrophobicContact CD1-CB 4.44Å; L160-L214 HydrophobicContact CD2-CB 3.92Å; L160-L214 HydrophobicContact CD2-CD2 3.94Å; L160-L214 HydrophobicContact CD2-CG 4.44Å; L160-F217 HydrophobicContact CD2-CD1 3.77Å; L160-F217 HydrophobicContact CD2-CE1 3.97Å; L160-K218 HydrophobicContact CD1-CB 4.36Å; L160-K218 HydrophobicContact CD1-CD 3.92Å; L160-K218 HydrophobicContact CG-CB 4.36Å; L160-K218 HydrophobicContact CG-CD 4.35Å; L160-K218 VanDerWaalsContact O-CD 3.28Å; L160-K218 WeakPolarHBondContact O-CD 3.35Å; L160-K218 WeakPolarHBondContact O-CE 3.02Å; L160-K218 PolarHBondContact O-NZ 2.68Å; L160-L226 HydrophobicContact CB-CB 4.42Å; L160-L226 WeakPolarHBondContact CB-O 3.47Å; L160-L226 HydrophobicContact CD2-CB 4.37Å; L160-L226 PolarHBondContact N-O 3.07Å
161	D	97.9	Very high	98.1	Very high	28 Å²	28	16.9 Å²	16.9	15%	0.15	11%	0.108	C	C	.	.			trans	-136.3	96.3	171.2	-171.5	-5.1	0	0	0	110.7	A163 A164 K218 T225	D161-A163 PolarHBondContact O-N 3.44Å; D161-A163 VanDerWaalsContact O-N 3.08Å; D161-A163 WeakPolarHBondContact OD1-CB 3.32Å; D161-A163 PolarHBondContact OD1-N 3.49Å; D161-A164 HydrophobicContact CB-CB 4.45Å; D161-A164 WeakPolarHBondContact O-CB 3.28Å; D161-A164 PolarHBondContact O-N 2.91Å; D161-A164 VanDerWaalsContact O-N 3.12Å; D161-K218 HydrophobicContact CB-CG 4.39Å; D161-T225 PolarHBondContact N-OG1 3.2Å; D161-T225 WeakPolarHBondContact O-CG2 3.19Å
162	P	96.3	Very high	98.1	Very high	66 Å²	66	15.9 Å²	15.9	43%	0.429	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.1	177.2	-25.4	34.4	0	0	0	114.9	V159 H261	V159-P162 HydrophobicContact CB-CG 4.24Å; V159-P162 HydrophobicContact CG1-CG 4.23Å; P162-H261 PolarHBondContact O-CE1 2.67Å
163	A	94.9	Very high	98.2	Very high	71 Å²	71	13 Å²	13	59%	0.587	8%	0.084	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-7.5	178.8	0	0	0	0	0	113.8	D161 A263	D161-A163 PolarHBondContact O-N 3.44Å; D161-A163 VanDerWaalsContact O-N 3.08Å; D161-A163 WeakPolarHBondContact OD1-CB 3.32Å; D161-A163 PolarHBondContact OD1-N 3.49Å; A163-A263 WeakPolarHBondContact O-CB 3.35Å
164	A	96.4	Very high	98.2	Very high	5 Å²	5	13 Å²	13	4%	0.041	8%	0.084	C	C	.	.			trans	-72.2	138.9	-179.2	0	0	0	0	0	112.2	D161 R166 T225 H261	D161-A164 HydrophobicContact CB-CB 4.45Å; D161-A164 WeakPolarHBondContact O-CB 3.28Å; D161-A164 PolarHBondContact O-N 2.91Å; D161-A164 VanDerWaalsContact O-N 3.12Å; A164-R166 PolarHBondContact O-N 2.9Å; A164-T225 HydrophobicContact CB-CG2 3.8Å; A164-H261 PolarHBondContact O-NE2 2.99Å
165	P	96.4	Very high	98.2	Very high	28 Å²	28	12.5 Å²	12.5	18%	0.182	8%	0.081	C	C	.	.	S	Bend	trans	-65.8	-36.1	-179.8	19	-26.5	0	0	0	113.4	P223 A263 A264 A273	P165-P223 VanDerWaalsContact CD-O 3.28Å; P165-P223 WeakPolarHBondContact CD-O 3.3Å; P165-P223 HydrophobicContact CG-CB 3.95Å; P165-P223 VanDerWaalsContact CG-O 3.24Å; P165-P223 WeakPolarHBondContact CG-O 3.41Å; P165-A263 WeakPolarHBondContact CB-O 3.48Å; P165-A264 HydrophobicContact CB-CB 4.49Å; P165-A264 WeakPolarHBondContact O-CB 3.37Å; P165-A273 WeakPolarHBondContact O-CB 3.36Å
166	R	97.6	Very high	98.1	Very high	15 Å²	15	12.6 Å²	12.6	6%	0.057	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	158.1	-176.7	-69.5	161.5	51.3	-142.6	-15.2	111.2	L69 D72 A164 P223 V224 T225 A273 D275	L69-R166 HydrophobicContact CD2-CG 3.78Å; D72-R166 PolarHBondContact O-NH1 2.92Å; A164-R166 PolarHBondContact O-N 2.9Å; R166-P223 WeakPolarHBondContact CB-O 3.47Å; R166-P223 PolarHBondContact N-O 3.49Å; R166-V224 HydrophobicContact CB-CG2 4.16Å; R166-V224 VanDerWaalsContact NH2-CG2 3.32Å; R166-V224 CarbonylContact O-C 3.58Å; R166-V224 WeakPolarHBondContact O-CA 3.34Å; R166-T225 PolarHBondContact O-N 3.31Å; R166-A273 CarbonylContact C-O 3.55Å; R166-A273 WeakPolarHBondContact CA-O 3.37Å; R166-D275 WeakPolarHBondContact CB-OD2 3.24Å; R166-D275 IonicContact CZ-OD1 2.67Å; R166-D275 IonicContact CZ-OD2 3.15Å; R166-D275 VanDerWaalsContact CZ-OD2 3.23Å; R166-D275 VanDerWaalsContact NE-CG 3.3Å; R166-D275 IonicContact NE-OD1 3.59Å; R166-D275 PolarHBondContact NE-OD1 3.22Å; R166-D275 IonicContact NE-OD2 2.93Å; R166-D275 PolarHBondContact NE-OD2 3.32Å; R166-D275 VanDerWaalsContact NH2-CG 3.31Å; R166-D275 IonicContact NH2-OD1 2.78Å; R166-D275 PolarHBondContact NH2-OD1 2.89Å; R166-D275 IonicContact NH2-OD2 2.72Å; R166-D275 PolarHBondContact NH2-OD2 3.07Å
167	R	97.4	Very high	98.1	Very high	17 Å²	17	13.5 Å²	13.5	6%	0.064	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	136.7	179.6	68.2	-166.4	82	-177.3	3.2	112.9	T225 Q227 H261 A273 V274 D275	R167-T225 WeakPolarHBondContact CA-O 3.38Å; R167-T225 HydrophobicContact CB-CG2 3.82Å; R167-Q227 HydrophobicContact CB-CB 4.48Å; R167-Q227 HydrophobicContact CG-CB 4.49Å; R167-H261 PolarHBondContact NH2-CE1 3.18Å; R167-H261 PolarHBondContact NH2-ND1 2.67Å; R167-H261 PolarHBondContact NH2-NE2 2.9Å; R167-A273 PolarHBondContact N-O 2.89Å; R167-V274 HydrophobicContact CG-CG2 4.07Å; R167-D275 PolarHBondContact O-N 2.93Å
168	L	98.8	Very high	97.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	126.9	154.7	176.5	61.7	0	0	0	107.2	T225 L226 Q227 L276 V278 L388 Y391 L392	L168-T225 PolarHBondContact N-O 3.41Å; L168-L226 HydrophobicContact CB-CD1 4.21Å; L168-L226 HydrophobicContact CD2-CD1 4Å; L168-L226 HydrophobicContact CG-CD1 4.04Å; L168-Q227 PolarHBondContact O-N 3.42Å; L168-L276 HydrophobicContact CD1-CB 3.87Å; L168-L276 HydrophobicContact CD1-CD2 3.99Å; L168-L276 HydrophobicContact CD1-CG 4.2Å; L168-V278 HydrophobicContact CD1-CG2 3.86Å; L168-L388 HydrophobicContact CD2-CD2 3.54Å; L168-Y391 HydrophobicContact CB-CD1 4.05Å; L168-Y391 HydrophobicContact CB-CE1 3.82Å; L168-Y391 HydrophobicContact CD1-CD1 4.36Å; L168-Y391 HydrophobicContact CD1-CD2 4.35Å; L168-Y391 HydrophobicContact CD1-CE1 4.12Å; L168-Y391 HydrophobicContact CD1-CE2 4.08Å; L168-Y391 HydrophobicContact CD1-CG 4.48Å; L168-Y391 HydrophobicContact CD2-CD1 3.75Å; L168-Y391 HydrophobicContact CD2-CD2 4.41Å; L168-Y391 HydrophobicContact CD2-CE1 4.26Å; L168-Y391 HydrophobicContact CD2-CG 3.85Å; L168-Y391 HydrophobicContact CG-CD1 4.28Å; L168-Y391 HydrophobicContact CG-CE1 4.3Å; L168-L392 HydrophobicContact CB-CD2 4.42Å; L168-L392 HydrophobicContact CD2-CD2 4.48Å
169	L	98.9	Very high	97.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123.8	172.8	-169.4	155	0	0	0	108.1	A171 Q227 V229 V274 L276 F277 V278 F343	L169-A171 HydrophobicContact CD2-CB 3.83Å; L169-Q227 WeakPolarHBondContact CA-O 3.44Å; L169-Q227 HydrophobicContact CD1-CG 4.47Å; L169-Q227 HydrophobicContact CG-CG 4.33Å; L169-V229 HydrophobicContact CD1-CG2 4.12Å; L169-V229 HydrophobicContact CD2-CG2 4.24Å; L169-V229 HydrophobicContact CG-CG2 4.17Å; L169-V274 HydrophobicContact CB-CG1 3.83Å; L169-V274 HydrophobicContact CD1-CG2 4.12Å; L169-L276 PolarHBondContact N-O 3.02Å; L169-F277 HydrophobicContact CD2-CD1 4.37Å; L169-F277 HydrophobicContact CD2-CD2 3.48Å; L169-F277 VanDerWaalsContact CD2-CD2 3.48Å; L169-F277 HydrophobicContact CD2-CE2 3.72Å; L169-F277 HydrophobicContact CD2-CG 3.87Å; L169-F277 HydrophobicContact CD2-CZ 4.26Å; L169-F277 CarbonylContact O-C 3.45Å; L169-F277 WeakPolarHBondContact O-CA 3.43Å; L169-V278 PolarHBondContact O-N 3.16Å; L169-F343 HydrophobicContact CD1-CE1 4.27Å
170	L	98.9	Very high	97	Very high	2 Å²	2	20 Å²	20	1%	0.01	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.8	175.2	179.4	68.3	0	0	0	107.9	I203 L206 L226 Q227 L228 V229 V278 L280 M384 L388	L170-I203 HydrophobicContact CD2-CD1 4.48Å; L170-I203 HydrophobicContact CD2-CG1 4.05Å; L170-I203 HydrophobicContact CD2-CG2 4.33Å; L170-I203 HydrophobicContact CG-CD1 3.98Å; L170-I203 HydrophobicContact CG-CG1 4.07Å; L170-L206 HydrophobicContact CD2-CD1 4.23Å; L170-L226 HydrophobicContact CB-CD1 4.31Å; L170-Q227 PolarHBondContact N-O 2.98Å; L170-L228 HydrophobicContact CB-CD2 3.97Å; L170-L228 HydrophobicContact CD2-CD2 4.03Å; L170-L228 HydrophobicContact CG-CD2 4.4Å; L170-L228 CarbonylContact O-C 3.37Å; L170-L228 VanDerWaalsContact O-CA 3.25Å; L170-L228 WeakPolarHBondContact O-CA 3.28Å; L170-V229 PolarHBondContact O-N 3.46Å; L170-V278 CarbonylContact C-O 3.52Å; L170-V278 WeakPolarHBondContact CA-O 3.4Å; L170-V278 HydrophobicContact CD1-CB 3.87Å; L170-V278 HydrophobicContact CD1-CG1 3.88Å; L170-L280 HydrophobicContact CD1-CD1 3.54Å; L170-M384 HydrophobicContact CD1-CE 3.88Å; L170-L388 HydrophobicContact CD2-CD1 4.22Å; L170-L388 HydrophobicContact CD2-CD2 4.42Å
171	A	98.9	Very high	96.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	170.1	-174.9	0	0	0	0	0	114.6	L169 V229 F231 F277 V278 L279 L280	L169-A171 HydrophobicContact CD2-CB 3.83Å; A171-V229 WeakPolarHBondContact CA-O 3.39Å; A171-V229 HydrophobicContact CB-CB 3.83Å; A171-V229 WeakPolarHBondContact CB-O 3.45Å; A171-F231 HydrophobicContact CB-CD2 4.23Å; A171-F231 HydrophobicContact CB-CE2 3.63Å; A171-F231 HydrophobicContact CB-CZ 4.48Å; A171-F277 HydrophobicContact CB-CE2 3.83Å; A171-F277 HydrophobicContact CB-CZ 4.41Å; A171-V278 PolarHBondContact N-O 3.29Å; A171-L279 HydrophobicContact CB-CD1 4.39Å; A171-L279 WeakPolarHBondContact O-CA 3.43Å; A171-L279 VanDerWaalsContact O-CD1 3.3Å; A171-L279 WeakPolarHBondContact O-CD1 3.34Å; A171-L280 PolarHBondContact O-N 2.93Å
172	C	98.9	Very high	96	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	172.2	168.6	58.3	0	0	0	0	107.4	P199 C200 I203 V229 F230 F231 L280	C172-P199 HydrophobicContact CB-CB 3.57Å; C172-C200 PolarHBondContact SG-SG 2.93Å; C172-I203 HydrophobicContact CB-CD1 4.29Å; C172-V229 PolarHBondContact N-O 3.33Å; C172-F230 WeakPolarHBondContact O-CA 3.2Å; C172-F231 WeakPolarHBondContact O-CD2 3.38Å; C172-F231 PolarHBondContact O-N 3.19Å; C172-L280 VanDerWaalsContact CB-O 3.24Å; C172-L280 WeakPolarHBondContact CB-O 3.49Å
173	H	98.9	Very high	95.6	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.009	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	156.3	163.8	72.7	113.2	0	0	0	110.9	D175 D195 S196 C200 F231 E234 D281	H173-D175 IonicContact CG-OD1 3.84Å; H173-D175 IonicContact ND1-OD1 2.62Å; H173-D175 PolarHBondContact ND1-OD1 3Å; H173-D195 IonicContact CE1-OD1 2.59Å; H173-D195 IonicContact NE2-OD1 2.94Å; H173-S196 WeakPolarHBondContact CD2-CB 3.28Å; H173-S196 PolarHBondContact CD2-OG 3.49Å; H173-S196 WeakPolarHBondContact NE2-CB 3.35Å; H173-S196 PolarHBondContact NE2-OG 3.3Å; H173-S196 WeakPolarHBondContact O-CB 3.24Å; H173-C200 PolarHBondContact O-SG 2.95Å; H173-F231 CarbonylContact C-O 3.59Å; H173-F231 WeakPolarHBondContact CA-O 3.42Å; H173-F231 HydrophobicContact CB-CB 4.25Å; H173-E234 HydrophobicContact CB-CB 3.42Å; H173-E234 VanDerWaalsContact CB-CB 3.42Å; H173-E234 HydrophobicContact CB-CG 3.95Å; H173-E234 VanDerWaalsContact CG-CB 3.46Å; H173-D281 IonicContact NE2-OD1 3.89Å
174	Y	98.9	Very high	95.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.185	C	C	.	.			trans	-116.2	-5.1	177.3	82.8	-98.2	0	0	0	114	R110 S117 V120 Q121 I124 T154 V156 F230 F231 D232	R110-Y174 WeakPolarHBondContact CD-O 3.19Å; R110-Y174 PolarHBondContact NE-O 2.87Å; S117-Y174 WeakPolarHBondContact OG-CE2 3.39Å; S117-Y174 PolarHBondContact OG-OH 2.77Å; V120-Y174 HydrophobicContact CB-CD2 4.05Å; V120-Y174 HydrophobicContact CB-CE2 4.46Å; V120-Y174 HydrophobicContact CG1-CD2 3.54Å; V120-Y174 HydrophobicContact CG1-CE2 4.37Å; V120-Y174 HydrophobicContact CG1-CG 4.19Å; Q121-Y174 HydrophobicContact CB-CE2 4.23Å; I124-Y174 HydrophobicContact CD1-CD1 4.42Å; I124-Y174 HydrophobicContact CD1-CD2 4.44Å; I124-Y174 HydrophobicContact CD1-CG 3.97Å; T154-Y174 WeakPolarHBondContact O-CE1 3.46Å; T154-Y174 PolarHBondContact O-OH 2.96Å; T154-Y174 VanDerWaalsContact O-OH 3.09Å; V156-Y174 HydrophobicContact CG2-CE1 4.28Å; Y174-F230 HydrophobicContact CD1-CB 3.88Å; Y174-F230 HydrophobicContact CG-CB 4.49Å; Y174-F231 WeakPolarHBondContact CD1-O 3.46Å; Y174-F231 PolarHBondContact N-O 2.82Å; Y174-D232 HydrophobicContact CD1-CB 4.47Å; Y174-D232 HydrophobicContact CE1-CB 3.64Å; Y174-D232 PolarHBondContact OH-OD2 3.39Å
175	D	98.9	Very high	95.1	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.189	C	C	.	.			trans	-75.4	-167.5	174.8	66.8	-52.8	0	0	0	111.9	R110 P112 H173 G233 E234 E235	R110-D175 VanDerWaalsContact CZ-O 3.26Å; R110-D175 PolarHBondContact NE-O 3.44Å; R110-D175 PolarHBondContact NH2-O 3.2Å; P112-D175 HydrophobicContact CG-CB 4.01Å; H173-D175 IonicContact CG-OD1 3.84Å; H173-D175 IonicContact ND1-OD1 2.62Å; H173-D175 PolarHBondContact ND1-OD1 3Å; D175-G233 PolarHBondContact OD1-N 2.92Å; D175-G233 WeakPolarHBondContact OD2-CA 3.26Å; D175-G233 PolarHBondContact OD2-N 3.2Å; D175-E234 PolarHBondContact OD1-N 2.77Å; D175-E234 PolarHBondContact OD2-N 3.45Å; D175-E235 PolarHBondContact OD2-N 3.41Å
176	S	98.6	Very high	94.6	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	21%	0.209	C	C	.	.			trans	-152.7	143.6	-179.3	60.1	0	0	0	0	109.5	R110 L111	R110-S176 WeakPolarHBondContact CG-OG 3.46Å; R110-S176 PolarHBondContact N-OG 2.72Å; R110-S176 VanDerWaalsContact N-OG 3.07Å; L111-S176 WeakPolarHBondContact CD2-O 3.21Å
177	K	98	Very high	94.2	Very high	20 Å²	20	43.8 Å²	43.8	9%	0.087	24%	0.238	C	C	.	.			trans	-57.7	138.8	-179.8	-158.3	167	-156.6	55.5	0	114.6	L179 F190 E235 S236	K177-L179 VanDerWaalsContact C-N 3.29Å; K177-L179 HydrophobicContact CB-CD2 4.42Å; K177-L179 HydrophobicContact CB-CG 4.37Å; K177-L179 HydrophobicContact CD-CD2 3.71Å; K177-L179 HydrophobicContact CG-CD2 4.04Å; K177-L179 HydrophobicContact CG-CG 4.46Å; K177-L179 PolarHBondContact O-N 3.23Å; K177-F190 HydrophobicContact CB-CD1 3.7Å; K177-F190 HydrophobicContact CB-CE1 3.64Å; K177-F190 HydrophobicContact CB-CZ 4.48Å; K177-F190 WeakPolarHBondContact O-CD1 3.15Å; K177-E235 HydrophobicContact CB-CG 4.24Å; K177-E235 WeakPolarHBondContact CB-OE1 3.46Å; K177-E235 WeakPolarHBondContact CD-OE1 3.39Å; K177-E235 WeakPolarHBondContact CE-OE1 3.42Å; K177-E235 HydrophobicContact CG-CG 4.48Å; K177-E235 WeakPolarHBondContact CG-OE1 3.36Å; K177-E235 IonicContact NZ-OE1 3.13Å; K177-E235 PolarHBondContact NZ-OE1 2.97Å; K177-E235 IonicContact NZ-OE2 2.91Å; K177-E235 PolarHBondContact NZ-OE2 2.72Å; K177-S236 PolarHBondContact NZ-O 2.66Å; K177-S236 PolarHBondContact NZ-OG 3.46Å
178	A	92.9	Very high	93.9	Very high	12 Å²	12	47.5 Å²	47.5	10%	0.099	25%	0.252	C	S	.	.			trans	-81	64	172.7	0	0	0	0	0	113.1	L111 R148	L111-A178 HydrophobicContact CD1-CB 4.03Å; L111-A178 HydrophobicContact CD2-CB 3.98Å; R148-A178 PolarHBondContact NH2-O 2.92Å
179	L	93.1	Very high	93.8	Very high	43 Å²	43	50.2 Å²	50.2	23%	0.225	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-63.7	151.5	178	-66.6	-171.2	0	0	0	113.4	K177 F190 H363 L365	K177-L179 VanDerWaalsContact C-N 3.29Å; K177-L179 HydrophobicContact CB-CD2 4.42Å; K177-L179 HydrophobicContact CB-CG 4.37Å; K177-L179 HydrophobicContact CD-CD2 3.71Å; K177-L179 HydrophobicContact CG-CD2 4.04Å; K177-L179 HydrophobicContact CG-CG 4.46Å; K177-L179 PolarHBondContact O-N 3.23Å; L179-F190 HydrophobicContact CB-CB 4.18Å; L179-F190 HydrophobicContact CD1-CB 3.86Å; L179-F190 HydrophobicContact CD1-CD2 3.43Å; L179-F190 VanDerWaalsContact CD1-CD2 3.43Å; L179-F190 HydrophobicContact CD1-CE2 4.11Å; L179-F190 HydrophobicContact CD1-CG 3.74Å; L179-F190 HydrophobicContact CG-CB 3.96Å; L179-F190 HydrophobicContact CG-CD2 4.16Å; L179-F190 HydrophobicContact CG-CG 3.98Å; L179-H363 WeakPolarHBondContact CD1-O 3.12Å; L179-L365 HydrophobicContact CD1-CD2 4.23Å
180	P	88.4	Confident	93.7	Very high	108 Å²	108	50.4 Å²	50.4	70%	0.701	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-64.9	139.8	168.9	-19.5	32.7	0	0	0	112.1
181	P	86.2	Confident	93.7	Very high	95 Å²	95	52.1 Å²	52.1	62%	0.617	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-62.9	141.8	174.1	-22	33	0	0	0	112.6	P183	P181-P183 WeakPolarHBondContact O-CD 3.41Å
182	D	87.7	Confident	93.6	Very high	28 Å²	28	52.1 Å²	52.1	15%	0.15	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-74	120	170.7	-172	-27.5	0	0	0	109.9	R184 A185 L365	D182-R184 PolarHBondContact O-N 3.09Å; D182-R184 VanDerWaalsContact OD1-CB 3.26Å; D182-R184 WeakPolarHBondContact OD1-CB 3.15Å; D182-R184 WeakPolarHBondContact OD1-CG 3.41Å; D182-R184 IonicContact OD1-CZ 3.8Å; D182-R184 PolarHBondContact OD1-N 3.19Å; D182-R184 IonicContact OD1-NE 3.77Å; D182-R184 PolarHBondContact OD1-NE 3.36Å; D182-R184 IonicContact OD1-NH2 3.02Å; D182-R184 IonicContact OD2-CZ 2.97Å; D182-R184 IonicContact OD2-NE 3.84Å; D182-R184 PolarHBondContact OD2-NE 2.98Å; D182-R184 IonicContact OD2-NH2 3.26Å; D182-R184 PolarHBondContact OD2-NH2 2.77Å; D182-A185 CarbonylContact O-C 3.55Å; D182-A185 VanDerWaalsContact O-C 3.23Å; D182-A185 PolarHBondContact O-N 3.3Å; D182-L365 HydrophobicContact CB-CD1 3.9Å
183	P	89	Confident	93.6	Very high	126 Å²	126	52.1 Å²	52.1	82%	0.818	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-12.8	178.8	-24.1	35.4	0	0	0	114.9	P181	P181-P183 WeakPolarHBondContact O-CD 3.41Å
184	R	91.6	Very high	93.6	Very high	214 Å²	214	52 Å²	52	81%	0.808	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-16.3	178.8	-53	167.6	-65	174.1	5	113.2	D182	D182-R184 PolarHBondContact O-N 3.09Å; D182-R184 VanDerWaalsContact OD1-CB 3.26Å; D182-R184 WeakPolarHBondContact OD1-CB 3.15Å; D182-R184 WeakPolarHBondContact OD1-CG 3.41Å; D182-R184 IonicContact OD1-CZ 3.8Å; D182-R184 PolarHBondContact OD1-N 3.19Å; D182-R184 IonicContact OD1-NE 3.77Å; D182-R184 PolarHBondContact OD1-NE 3.36Å; D182-R184 IonicContact OD1-NH2 3.02Å; D182-R184 IonicContact OD2-CZ 2.97Å; D182-R184 IonicContact OD2-NE 3.84Å; D182-R184 PolarHBondContact OD2-NE 2.98Å; D182-R184 IonicContact OD2-NH2 3.26Å; D182-R184 PolarHBondContact OD2-NH2 2.77Å
185	A	88.8	Confident	93.6	Very high	15 Å²	15	52.1 Å²	52.1	12%	0.124	28%	0.278	C	S	.	.			trans	-150.1	63.1	-177.1	0	0	0	0	0	109.6	D182 E187 R188	D182-A185 CarbonylContact O-C 3.55Å; D182-A185 VanDerWaalsContact O-C 3.23Å; D182-A185 PolarHBondContact O-N 3.3Å; A185-E187 WeakPolarHBondContact CB-OE1 3.3Å; A185-E187 PolarHBondContact O-N 3.23Å; A185-E187 VanDerWaalsContact O-N 3.09Å; A185-R188 HydrophobicContact CB-CB 4.37Å; A185-R188 HydrophobicContact CB-CG 3.93Å; A185-R188 WeakPolarHBondContact O-CB 3.37Å; A185-R188 PolarHBondContact O-N 3.1Å
186	P	86.8	Confident	93.6	Very high	94 Å²	94	52.1 Å²	52.1	61%	0.61	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-11.8	-172	29	-37.7	0	0	0	114.1
187	E	88.3	Confident	93.6	Very high	142 Å²	142	52 Å²	52	66%	0.664	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-12.7	170.6	72.8	-65.1	153.8	0	0	114.3	A185	A185-E187 WeakPolarHBondContact CB-OE1 3.3Å; A185-E187 PolarHBondContact O-N 3.23Å; A185-E187 VanDerWaalsContact O-N 3.09Å
188	R	92.4	Very high	93.7	Very high	95 Å²	95	51.1 Å²	51.1	36%	0.358	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-82.2	116.1	173.7	-68.6	-174.1	70.3	-174.9	5.3	110.6	A185 L365 D366	A185-R188 HydrophobicContact CB-CB 4.37Å; A185-R188 HydrophobicContact CB-CG 3.93Å; A185-R188 WeakPolarHBondContact O-CB 3.37Å; A185-R188 PolarHBondContact O-N 3.1Å; R188-L365 HydrophobicContact CB-CD1 4.13Å; R188-L365 VanDerWaalsContact NH2-C 3.25Å; R188-L365 PolarHBondContact NH2-O 3.49Å; R188-D366 IonicContact CZ-OD1 3.73Å; R188-D366 IonicContact NH1-OD1 2.91Å; R188-D366 PolarHBondContact NH1-OD1 2.9Å; R188-D366 IonicContact NH2-OD1 3.23Å; R188-D366 PolarHBondContact NH2-OD1 3.46Å
189	V	95.1	Very high	94	Very high	57 Å²	57	50.5 Å²	50.5	35%	0.345	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-103.4	159.3	171.5	-67	0	0	0	0	110.7	E109 L191	E109-V189 HydrophobicContact CB-CB 4.03Å; E109-V189 HydrophobicContact CB-CG1 4.47Å; E109-V189 HydrophobicContact CB-CG2 3.89Å; E109-V189 HydrophobicContact CG-CB 4.48Å; V189-L191 HydrophobicContact CG2-CD2 3.98Å
190	F	97.6	Very high	94.2	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.018	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-72.5	130	172.3	-176.1	-114.1	0	0	0	109.9	K177 L179 G192 D195 T364 L365 D367	K177-F190 HydrophobicContact CB-CD1 3.7Å; K177-F190 HydrophobicContact CB-CE1 3.64Å; K177-F190 HydrophobicContact CB-CZ 4.48Å; K177-F190 WeakPolarHBondContact O-CD1 3.15Å; L179-F190 HydrophobicContact CB-CB 4.18Å; L179-F190 HydrophobicContact CD1-CB 3.86Å; L179-F190 HydrophobicContact CD1-CD2 3.43Å; L179-F190 VanDerWaalsContact CD1-CD2 3.43Å; L179-F190 HydrophobicContact CD1-CE2 4.11Å; L179-F190 HydrophobicContact CD1-CG 3.74Å; L179-F190 HydrophobicContact CG-CB 3.96Å; L179-F190 HydrophobicContact CG-CD2 4.16Å; L179-F190 HydrophobicContact CG-CG 3.98Å; F190-G192 VanDerWaalsContact CZ-CA 3.43Å; F190-D195 HydrophobicContact CZ-CB 4.41Å; F190-T364 VanDerWaalsContact CD2-O 3.23Å; F190-T364 WeakPolarHBondContact CD2-O 3.36Å; F190-T364 WeakPolarHBondContact CE2-O 3.44Å; F190-L365 HydrophobicContact CB-CD2 4.22Å; F190-D367 HydrophobicContact CE2-CB 3.98Å
191	L	98	Very high	94.7	Very high	37 Å²	37	43.3 Å²	43.3	19%	0.194	23%	0.225	C	C	.	.			trans	-106.9	-16.3	179.5	-62.2	-175.8	0	0	0	113.5	R110 V189 A193 T368	R110-L191 PolarHBondContact NH1-O 3.2Å; R110-L191 PolarHBondContact NH2-O 3.44Å; V189-L191 HydrophobicContact CG2-CD2 3.98Å; L191-A193 PolarHBondContact O-N 2.91Å; L191-T368 HydrophobicContact CD1-CG2 4.24Å
192	G	98.5	Very high	95.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.			trans	44.5	59.7	-179.8	0	0	0	0	0	112.5	R110 F190 D195 A197 D367	R110-G192 PolarHBondContact NH2-O 3.28Å; F190-G192 VanDerWaalsContact CZ-CA 3.43Å; G192-D195 CarbonylContact C-O 3.58Å; G192-D195 VanDerWaalsContact CA-O 3.25Å; G192-D195 WeakPolarHBondContact CA-O 3.32Å; G192-D195 CarbonylContact O-C 3.55Å; G192-D195 PolarHBondContact O-N 3.23Å; G192-D195 VanDerWaalsContact O-N 3.16Å; G192-A197 WeakPolarHBondContact O-CB 3.43Å; G192-A197 PolarHBondContact O-N 3.42Å; G192-D367 PolarHBondContact N-O 3.45Å
193	A	98.8	Very high	95.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-68.2	-41.2	-175.1	0	0	0	0	0	111.7	L107 L191 D195 V198 D367 M372	L107-A193 HydrophobicContact CD2-CB 3.55Å; L191-A193 PolarHBondContact O-N 2.91Å; A193-D195 VanDerWaalsContact C-N 3.28Å; A193-V198 WeakPolarHBondContact O-CB 3.17Å; A193-V198 VanDerWaalsContact O-CG2 3.28Å; A193-V198 WeakPolarHBondContact O-CG2 3.35Å; A193-V198 PolarHBondContact O-N 3.38Å; A193-D367 WeakPolarHBondContact CB-O 3.25Å; A193-D367 WeakPolarHBondContact CB-OD1 3.44Å; A193-D367 VanDerWaalsContact N-CG 3.3Å; A193-D367 PolarHBondContact N-O 3.49Å; A193-D367 VanDerWaalsContact N-O 3.14Å; A193-D367 PolarHBondContact N-OD1 2.89Å; A193-D367 PolarHBondContact N-OD2 3.43Å; A193-M372 HydrophobicContact CB-CE 3.89Å; A193-M372 HydrophobicContact CB-CG 3.85Å; A193-M372 HydrophobicContact CB-SD 3.84Å
194	S	98.8	Very high	96.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.	I	π-helix	trans	-79.1	-12.9	167.9	71	0	0	0	0	114.2	P199 L282 L283 D367	S194-P199 WeakPolarHBondContact O-CD 3.44Å; S194-L282 CarbonylContact O-C 3.2Å; S194-L282 VanDerWaalsContact O-CA 3.28Å; S194-L282 WeakPolarHBondContact O-CA 3.37Å; S194-L282 PolarHBondContact O-N 3.21Å; S194-L283 WeakPolarHBondContact CA-O 3.38Å; S194-L283 PolarHBondContact O-N 3.37Å; S194-D367 PolarHBondContact N-OD1 2.62Å; S194-D367 PolarHBondContact N-OD2 3.08Å; S194-D367 VanDerWaalsContact N-OD2 3.13Å; S194-D367 PolarHBondContact OG-OD1 3.08Å; S194-D367 PolarHBondContact OG-OD2 3.23Å
195	D	98.8	Very high	96.7	Very high	3 Å²	3	21.3 Å²	21.3	2%	0.016	11%	0.111	C	C	.	.	I	π-helix	trans	-136.9	71.7	-150.5	-178.5	-12.2	0	0	0	110.3	R110 H173 F190 G192 A193 L282 W362 H363 D367	R110-D195 PolarHBondContact NH2-O 3.14Å; H173-D195 IonicContact CE1-OD1 2.59Å; H173-D195 IonicContact NE2-OD1 2.94Å; F190-D195 HydrophobicContact CZ-CB 4.41Å; G192-D195 CarbonylContact C-O 3.58Å; G192-D195 VanDerWaalsContact CA-O 3.25Å; G192-D195 WeakPolarHBondContact CA-O 3.32Å; G192-D195 CarbonylContact O-C 3.55Å; G192-D195 PolarHBondContact O-N 3.23Å; G192-D195 VanDerWaalsContact O-N 3.16Å; A193-D195 VanDerWaalsContact C-N 3.28Å; D195-L282 HydrophobicContact CB-CD2 3.77Å; D195-W362 VanDerWaalsContact OD2-CD1 3.26Å; D195-H363 IonicContact OD2-CD2 3.88Å; D195-H363 PolarHBondContact OD2-CD2 3.44Å; D195-D367 VanDerWaalsContact CB-OD2 3.29Å; D195-D367 WeakPolarHBondContact CB-OD2 3.48Å
196	S	98.8	Very high	97.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	I	π-helix	cis	-118.4	41.1	-9	-96.8	0	0	0	0	112.1	H173 V198 P199 C200 D281	H173-S196 WeakPolarHBondContact CD2-CB 3.28Å; H173-S196 PolarHBondContact CD2-OG 3.49Å; H173-S196 WeakPolarHBondContact NE2-CB 3.35Å; H173-S196 PolarHBondContact NE2-OG 3.3Å; H173-S196 WeakPolarHBondContact O-CB 3.24Å; S196-V198 PolarHBondContact O-N 2.63Å; S196-P199 WeakPolarHBondContact O-CD 3.28Å; S196-C200 PolarHBondContact O-N 3.44Å; S196-C200 PolarHBondContact O-SG 2.91Å; S196-D281 PolarHBondContact OG-OD1 3.04Å; S196-D281 VanDerWaalsContact OG-OD1 3.08Å
197	A	98.9	Very high	97.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.078	C	C	.	.	I	π-helix	trans	-62.7	-41.1	-177.8	0	0	0	0	0	113.5	L103 I106 L107 G192 C200 A201	L103-A197 HydrophobicContact CD1-CB 3.78Å; I106-A197 HydrophobicContact CB-CB 4.27Å; I106-A197 HydrophobicContact CG2-CB 3.7Å; L107-A197 HydrophobicContact CD2-CB 3.85Å; G192-A197 WeakPolarHBondContact O-CB 3.43Å; G192-A197 PolarHBondContact O-N 3.42Å; A197-C200 WeakPolarHBondContact O-CB 3.41Å; A197-C200 PolarHBondContact O-N 3.46Å; A197-A201 WeakPolarHBondContact O-CB 3.09Å; A197-A201 PolarHBondContact O-N 2.77Å
198	V	98.9	Very high	98.3	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-65.9	-50	173.8	161.8	0	0	0	0	111.7	L103 A193 S196 C200 A201 M202 L283 M372 V377	L103-V198 HydrophobicContact CD1-CB 4.49Å; L103-V198 HydrophobicContact CD1-CG2 3.77Å; L103-V198 HydrophobicContact CD2-CG2 3.79Å; L103-V198 HydrophobicContact CG-CG2 4.45Å; A193-V198 WeakPolarHBondContact O-CB 3.17Å; A193-V198 VanDerWaalsContact O-CG2 3.28Å; A193-V198 WeakPolarHBondContact O-CG2 3.35Å; A193-V198 PolarHBondContact O-N 3.38Å; S196-V198 PolarHBondContact O-N 2.63Å; V198-C200 VanDerWaalsContact C-N 3.29Å; V198-C200 PolarHBondContact O-N 3.29Å; V198-A201 PolarHBondContact O-N 3.26Å; V198-A201 VanDerWaalsContact O-N 3.08Å; V198-M202 HydrophobicContact CG1-CG 4.16Å; V198-M202 HydrophobicContact CG1-SD 3.84Å; V198-M202 VanDerWaalsContact O-CG 3.26Å; V198-M202 WeakPolarHBondContact O-CG 3.21Å; V198-M202 PolarHBondContact O-N 2.97Å; V198-L283 WeakPolarHBondContact CB-O 3.24Å; V198-L283 HydrophobicContact CG1-CB 4.42Å; V198-L283 WeakPolarHBondContact CG1-O 3.22Å; V198-M372 HydrophobicContact CG2-CG 4.24Å; V198-M372 HydrophobicContact CG2-SD 3.93Å; V198-V377 HydrophobicContact CG1-CB 4.44Å; V198-V377 HydrophobicContact CG1-CG1 3.79Å; V198-V377 HydrophobicContact CG1-CG2 3.84Å; V198-V377 HydrophobicContact CG2-CG2 4.41Å
199	P	98.9	Very high	98.6	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-47.7	-46.1	168	-33.4	36.7	0	0	0	114.3	C172 S194 S196 A201 M202 I203 L280 L283	C172-P199 HydrophobicContact CB-CB 3.57Å; S194-P199 WeakPolarHBondContact O-CD 3.44Å; S196-P199 WeakPolarHBondContact O-CD 3.28Å; P199-A201 PolarHBondContact O-N 3.12Å; P199-M202 PolarHBondContact O-N 3.14Å; P199-I203 WeakPolarHBondContact O-CG1 3.36Å; P199-I203 PolarHBondContact O-N 3.11Å; P199-L280 HydrophobicContact CB-CB 3.95Å; P199-L280 WeakPolarHBondContact CB-O 3.36Å; P199-L283 HydrophobicContact CG-CB 4.11Å; P199-L283 HydrophobicContact CG-CG 4.33Å
200	C	99	Very high	98.8	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-57.4	-51	174.1	-71.6	0	0	0	0	112	I106 C172 H173 S196 A197 V198 M202 I203 L204 F230	I106-C200 HydrophobicContact CD1-CB 3.54Å; C172-C200 PolarHBondContact SG-SG 2.93Å; H173-C200 PolarHBondContact O-SG 2.95Å; S196-C200 PolarHBondContact O-N 3.44Å; S196-C200 PolarHBondContact O-SG 2.91Å; A197-C200 WeakPolarHBondContact O-CB 3.41Å; A197-C200 PolarHBondContact O-N 3.46Å; V198-C200 VanDerWaalsContact C-N 3.29Å; V198-C200 PolarHBondContact O-N 3.29Å; C200-M202 VanDerWaalsContact C-N 3.32Å; C200-M202 PolarHBondContact O-N 2.77Å; C200-I203 PolarHBondContact O-N 2.97Å; C200-L204 WeakPolarHBondContact O-CG 3.3Å; C200-L204 PolarHBondContact O-N 3.36Å; C200-F230 HydrophobicContact CB-CD1 4.27Å; C200-F230 HydrophobicContact CB-CE1 4.24Å
201	A	99	Very high	98.8	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-63.8	-36.2	-179	0	0	0	0	0	112.9	L98 H102 L103 A197 V198 P199 L204 E205	L98-A201 HydrophobicContact CD2-CB 4.08Å; H102-A201 HydrophobicContact CB-CB 3.99Å; L103-A201 HydrophobicContact CB-CB 3.69Å; L103-A201 HydrophobicContact CD1-CB 4.19Å; A197-A201 WeakPolarHBondContact O-CB 3.09Å; A197-A201 PolarHBondContact O-N 2.77Å; V198-A201 PolarHBondContact O-N 3.26Å; V198-A201 VanDerWaalsContact O-N 3.08Å; P199-A201 PolarHBondContact O-N 3.12Å; A201-L204 PolarHBondContact O-N 3.13Å; A201-E205 VanDerWaalsContact O-CB 3.3Å; A201-E205 WeakPolarHBondContact O-CB 3.28Å; A201-E205 PolarHBondContact O-N 2.76Å
202	M	98.9	Very high	98.8	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-62.3	-44.3	173.4	-70.1	175.2	57	0	0	111.2	V198 P199 C200 E205 L206 L280 L283 V377 L380 T381	V198-M202 HydrophobicContact CG1-CG 4.16Å; V198-M202 HydrophobicContact CG1-SD 3.84Å; V198-M202 VanDerWaalsContact O-CG 3.26Å; V198-M202 WeakPolarHBondContact O-CG 3.21Å; V198-M202 PolarHBondContact O-N 2.97Å; P199-M202 PolarHBondContact O-N 3.14Å; C200-M202 VanDerWaalsContact C-N 3.32Å; C200-M202 PolarHBondContact O-N 2.77Å; M202-E205 PolarHBondContact O-N 2.88Å; M202-L206 WeakPolarHBondContact O-CB 3.44Å; M202-L206 WeakPolarHBondContact O-CD1 3.44Å; M202-L206 WeakPolarHBondContact O-CG 3.46Å; M202-L206 PolarHBondContact O-N 2.94Å; M202-L280 HydrophobicContact CB-CD2 4.48Å; M202-L280 HydrophobicContact CE-CD2 3.88Å; M202-L283 HydrophobicContact CE-CD1 3.92Å; M202-L283 HydrophobicContact SD-CB 4.27Å; M202-L283 HydrophobicContact SD-CD1 3.93Å; M202-V377 HydrophobicContact CG-CG1 4.19Å; M202-L380 HydrophobicContact CE-CB 3.64Å; M202-T381 WeakPolarHBondContact CG-OG1 3.14Å
203	I	99	Very high	98.8	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-67	-42.5	178.4	-65.5	178.8	0	0	0	111.4	L170 C172 P199 C200 L206 A207 L228 F230 L280	L170-I203 HydrophobicContact CD2-CD1 4.48Å; L170-I203 HydrophobicContact CD2-CG1 4.05Å; L170-I203 HydrophobicContact CD2-CG2 4.33Å; L170-I203 HydrophobicContact CG-CD1 3.98Å; L170-I203 HydrophobicContact CG-CG1 4.07Å; C172-I203 HydrophobicContact CB-CD1 4.29Å; P199-I203 WeakPolarHBondContact O-CG1 3.36Å; P199-I203 PolarHBondContact O-N 3.11Å; C200-I203 PolarHBondContact O-N 2.97Å; I203-L206 PolarHBondContact O-N 3.46Å; I203-A207 PolarHBondContact O-N 3.1Å; I203-L228 HydrophobicContact CG2-CB 4.29Å; I203-L228 HydrophobicContact CG2-CD1 3.86Å; I203-L228 HydrophobicContact CG2-CD2 3.78Å; I203-L228 HydrophobicContact CG2-CG 4.17Å; I203-F230 HydrophobicContact CB-CE1 4.15Å; I203-F230 HydrophobicContact CB-CZ 4.02Å; I203-F230 HydrophobicContact CG2-CE1 4.15Å; I203-F230 HydrophobicContact CG2-CE2 4.24Å; I203-F230 HydrophobicContact CG2-CZ 3.54Å; I203-L280 HydrophobicContact CG1-CD2 4.39Å
204	L	98.9	Very high	98.8	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-62.8	-41.2	175.4	-68.4	177.1	0	0	0	112.1	H102 I106 I124 T127 L128 C200 A201 A207 T208 F230	H102-L204 HydrophobicContact CB-CB 3.99Å; H102-L204 HydrophobicContact CB-CD1 4.19Å; I106-L204 HydrophobicContact CD1-CD1 4.22Å; I124-L204 HydrophobicContact CG1-CD1 4.28Å; I124-L204 HydrophobicContact CG2-CD2 4.32Å; T127-L204 HydrophobicContact CG2-CD2 4.03Å; L128-L204 HydrophobicContact CD1-CD2 4.23Å; L128-L204 HydrophobicContact CD2-CD2 3.99Å; L128-L204 HydrophobicContact CG-CD2 3.87Å; C200-L204 WeakPolarHBondContact O-CG 3.3Å; C200-L204 PolarHBondContact O-N 3.36Å; A201-L204 PolarHBondContact O-N 3.13Å; L204-A207 PolarHBondContact O-N 3.32Å; L204-T208 WeakPolarHBondContact O-CB 3.33Å; L204-T208 PolarHBondContact O-N 3.3Å; L204-T208 PolarHBondContact O-OG1 2.95Å; L204-F230 HydrophobicContact CD2-CE1 4.42Å; L204-F230 HydrophobicContact CD2-CZ 3.93Å; L204-F230 HydrophobicContact CG-CE1 4.29Å; L204-F230 HydrophobicContact CG-CZ 4.22Å
205	E	98.9	Very high	98.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-68	-37.4	175.7	173.8	53.5	-162.7	0	0	112.3	V93 D94 R97 L98 H102 A201 M202 T208 S209 T381	V93-E205 VanDerWaalsContact CA-OE1 3.3Å; V93-E205 WeakPolarHBondContact CA-OE1 3.29Å; V93-E205 HydrophobicContact CG1-CG 4.35Å; D94-E205 PolarHBondContact N-OE1 3.42Å; R97-E205 IonicContact CZ-OE1 3.72Å; R97-E205 IonicContact CZ-OE2 2.68Å; R97-E205 VanDerWaalsContact CZ-OE2 3.26Å; R97-E205 IonicContact NE-OE1 3.89Å; R97-E205 IonicContact NE-OE2 3.4Å; R97-E205 PolarHBondContact NE-OE2 3.46Å; R97-E205 VanDerWaalsContact NH2-CD 3.26Å; R97-E205 IonicContact NH2-OE1 3.48Å; R97-E205 PolarHBondContact NH2-OE1 3.28Å; R97-E205 IonicContact NH2-OE2 3.32Å; R97-E205 PolarHBondContact NH2-OE2 3.29Å; L98-E205 HydrophobicContact CB-CB 4.16Å; L98-E205 HydrophobicContact CB-CG 4Å; L98-E205 HydrophobicContact CD1-CB 4.37Å; L98-E205 HydrophobicContact CD1-CG 4.14Å; L98-E205 HydrophobicContact CG-CB 3.99Å; L98-E205 HydrophobicContact CG-CG 4.13Å; H102-E205 IonicContact CD2-OE2 3.81Å; H102-E205 IonicContact NE2-OE2 3.77Å; A201-E205 VanDerWaalsContact O-CB 3.3Å; A201-E205 WeakPolarHBondContact O-CB 3.28Å; A201-E205 PolarHBondContact O-N 2.76Å; M202-E205 PolarHBondContact O-N 2.88Å; E205-T208 PolarHBondContact O-N 2.9Å; E205-S209 VanDerWaalsContact O-CB 3.22Å; E205-S209 WeakPolarHBondContact O-CB 3.4Å; E205-S209 PolarHBondContact O-N 2.91Å; E205-S209 PolarHBondContact O-OG 3.43Å; E205-S209 WeakPolarHBondContact OE1-CB 3.41Å; E205-T381 HydrophobicContact CB-CG2 4.41Å; E205-T381 HydrophobicContact CG-CG2 3.9Å
206	L	98.9	Very high	98.8	Very high	3 Å²	3	16 Å²	16	2%	0.016	9%	0.092	C	C	.	.	H	α-helix	trans	-63.4	-41.3	173.7	-73.5	164.4	0	0	0	111.9	L170 M202 I203 L210 T381 M384 A385 L388	L170-L206 HydrophobicContact CD2-CD1 4.23Å; M202-L206 WeakPolarHBondContact O-CB 3.44Å; M202-L206 WeakPolarHBondContact O-CD1 3.44Å; M202-L206 WeakPolarHBondContact O-CG 3.46Å; M202-L206 PolarHBondContact O-N 2.94Å; I203-L206 PolarHBondContact O-N 3.46Å; L206-L210 VanDerWaalsContact O-CB 3.28Å; L206-L210 WeakPolarHBondContact O-CB 3.3Å; L206-L210 WeakPolarHBondContact O-CG 3.38Å; L206-L210 PolarHBondContact O-N 2.61Å; L206-T381 HydrophobicContact CD2-CG2 4.19Å; L206-T381 HydrophobicContact CG-CG2 4.17Å; L206-M384 HydrophobicContact CD1-CB 3.63Å; L206-M384 HydrophobicContact CD1-CG 4.46Å; L206-M384 HydrophobicContact CD2-CB 3.95Å; L206-M384 HydrophobicContact CG-CB 4.42Å; L206-A385 HydrophobicContact CD2-CB 3.77Å; L206-A385 VanDerWaalsContact CD2-N 3.34Å; L206-L388 HydrophobicContact CB-CD1 4.13Å; L206-L388 HydrophobicContact CD1-CD1 4.26Å; L206-L388 HydrophobicContact CD2-CD1 4.21Å; L206-L388 HydrophobicContact CG-CD1 4.44Å
207	A	98.9	Very high	98.7	Very high	3 Å²	3	16.3 Å²	16.3	3%	0.025	9%	0.094	C	C	.	.	H	α-helix	trans	-65.7	-40	175.3	0	0	0	0	0	111.9	L128 L131 W135 I203 L204 D211 L228	L128-A207 HydrophobicContact CD2-CB 3.78Å; L131-A207 HydrophobicContact CD1-CB 3.66Å; W135-A207 HydrophobicContact CZ2-CB 4.23Å; I203-A207 PolarHBondContact O-N 3.1Å; L204-A207 PolarHBondContact O-N 3.32Å; A207-D211 PolarHBondContact O-N 3.32Å; A207-L228 HydrophobicContact CB-CD1 4.08Å
208	T	98.9	Very high	98.6	Very high	34 Å²	34	19 Å²	19	21%	0.209	11%	0.106	C	C	.	.	H	α-helix	trans	-76.9	-48.8	-176	-54.2	0	0	0	0	112.6	H102 L131 L204 E205 L210 D211	H102-T208 PolarHBondContact NE2-OG1 2.91Å; L131-T208 HydrophobicContact CD2-CG2 4.1Å; L204-T208 WeakPolarHBondContact O-CB 3.33Å; L204-T208 PolarHBondContact O-N 3.3Å; L204-T208 PolarHBondContact O-OG1 2.95Å; E205-T208 PolarHBondContact O-N 2.9Å; T208-L210 PolarHBondContact O-N 3.22Å; T208-D211 WeakPolarHBondContact O-CB 3.29Å; T208-D211 PolarHBondContact O-N 3.14Å
209	S	98.7	Very high	98.5	Very high	9 Å²	9	25.5 Å²	25.5	6%	0.063	14%	0.136	C	C	.	.	H	α-helix	trans	-63.3	-27.2	178	58.9	0	0	0	0	113.7	L92 E205	L92-S209 WeakPolarHBondContact O-CB 3.28Å; E205-S209 VanDerWaalsContact O-CB 3.22Å; E205-S209 WeakPolarHBondContact O-CB 3.4Å; E205-S209 PolarHBondContact O-N 2.91Å; E205-S209 PolarHBondContact O-OG 3.43Å; E205-S209 WeakPolarHBondContact OE1-CB 3.41Å
210	L	98.8	Very high	98.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	5	179.4	-56.3	177.5	0	0	0	113.6	L89 L206 T208 A212 Q213 L214 L388 L394	L89-L210 HydrophobicContact CD2-CD2 3.64Å; L206-L210 VanDerWaalsContact O-CB 3.28Å; L206-L210 WeakPolarHBondContact O-CB 3.3Å; L206-L210 WeakPolarHBondContact O-CG 3.38Å; L206-L210 PolarHBondContact O-N 2.61Å; T208-L210 PolarHBondContact O-N 3.22Å; L210-A212 VanDerWaalsContact C-N 3.34Å; L210-A212 PolarHBondContact O-N 3.32Å; L210-Q213 CarbonylContact O-C 3.52Å; L210-Q213 WeakPolarHBondContact O-CA 3.42Å; L210-Q213 WeakPolarHBondContact O-CB 3.41Å; L210-Q213 PolarHBondContact O-N 3.19Å; L210-L214 HydrophobicContact CB-CD1 3.97Å; L210-L214 HydrophobicContact CB-CG 3.99Å; L210-L214 WeakPolarHBondContact O-CG 3.33Å; L210-L214 PolarHBondContact O-N 3.03Å; L210-L388 HydrophobicContact CD1-CB 4.37Å; L210-L388 HydrophobicContact CD1-CD1 4.28Å; L210-L394 HydrophobicContact CD1-CD1 4.11Å
211	D	98.8	Very high	98	Very high	25 Å²	25	38.8 Å²	38.8	13%	0.134	20%	0.195	C	C	.	.	H	α-helix	trans	-49.1	-49.5	-172.8	178.6	58.2	0	0	0	113.5	L131 S132 A133 A207 T208 Q213 L214 R215	L131-D211 WeakPolarHBondContact CB-OD1 3.16Å; L131-D211 HydrophobicContact CD2-CB 4.45Å; S132-D211 VanDerWaalsContact CB-OD2 3.24Å; S132-D211 WeakPolarHBondContact CB-OD2 3.2Å; S132-D211 VanDerWaalsContact N-CG 3.34Å; S132-D211 PolarHBondContact N-OD1 3.44Å; S132-D211 PolarHBondContact N-OD2 2.89Å; S132-D211 VanDerWaalsContact N-OD2 3.13Å; S132-D211 PolarHBondContact OG-OD2 2.93Å; A133-D211 VanDerWaalsContact CB-OD1 3.28Å; A133-D211 WeakPolarHBondContact CB-OD1 3.32Å; A133-D211 PolarHBondContact N-OD1 2.85Å; A207-D211 PolarHBondContact O-N 3.32Å; T208-D211 WeakPolarHBondContact O-CB 3.29Å; T208-D211 PolarHBondContact O-N 3.14Å; D211-Q213 VanDerWaalsContact C-N 3.3Å; D211-Q213 PolarHBondContact O-N 2.91Å; D211-L214 PolarHBondContact O-N 2.78Å; D211-R215 VanDerWaalsContact O-CB 3.23Å; D211-R215 WeakPolarHBondContact O-CB 3.33Å; D211-R215 PolarHBondContact O-N 3.33Å
212	A	98.4	Very high	97.8	Very high	65 Å²	65	42 Å²	42	54%	0.537	21%	0.212	S	C	.	.	H	α-helix	trans	-63.2	-33.8	178.8	0	0	0	0	0	113.2	L210 S216	L210-A212 VanDerWaalsContact C-N 3.34Å; L210-A212 PolarHBondContact O-N 3.32Å; A212-S216 PolarHBondContact O-N 2.8Å
213	Q	98.3	Very high	97.5	Very high	14 Å²	14	45.5 Å²	45.5	7%	0.065	24%	0.235	C	C	.	.	H	α-helix	trans	-72.3	-48.3	174.3	-76.7	83.7	-84.2	0	0	111	L210 D211 R215 S216 F217 L394	L210-Q213 CarbonylContact O-C 3.52Å; L210-Q213 WeakPolarHBondContact O-CA 3.42Å; L210-Q213 WeakPolarHBondContact O-CB 3.41Å; L210-Q213 PolarHBondContact O-N 3.19Å; D211-Q213 VanDerWaalsContact C-N 3.3Å; D211-Q213 PolarHBondContact O-N 2.91Å; Q213-R215 VanDerWaalsContact C-N 3.29Å; Q213-R215 PolarHBondContact O-N 2.91Å; Q213-S216 PolarHBondContact O-N 2.87Å; Q213-S216 VanDerWaalsContact O-N 3.12Å; Q213-F217 VanDerWaalsContact O-CB 3.26Å; Q213-F217 WeakPolarHBondContact O-CB 3.41Å; Q213-F217 PolarHBondContact O-N 2.88Å; Q213-L394 HydrophobicContact CB-CB 4.15Å; Q213-L394 HydrophobicContact CB-CD1 4.42Å; Q213-L394 HydrophobicContact CB-CD2 4.47Å; Q213-L394 HydrophobicContact CG-CB 4.37Å
214	L	98.6	Very high	97.4	Very high	1 Å²	1	46 Å²	46	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-36.9	180	-66.2	172.9	0	0	0	111.5	A133 W135 L160 L210 D211 K218 L226 L392 L394	A133-L214 HydrophobicContact CB-CB 4.14Å; W135-L214 HydrophobicContact CZ2-CD1 4.05Å; L160-L214 HydrophobicContact CD1-CB 4.44Å; L160-L214 HydrophobicContact CD2-CB 3.92Å; L160-L214 HydrophobicContact CD2-CD2 3.94Å; L160-L214 HydrophobicContact CD2-CG 4.44Å; L210-L214 HydrophobicContact CB-CD1 3.97Å; L210-L214 HydrophobicContact CB-CG 3.99Å; L210-L214 WeakPolarHBondContact O-CG 3.33Å; L210-L214 PolarHBondContact O-N 3.03Å; D211-L214 PolarHBondContact O-N 2.78Å; L214-K218 VanDerWaalsContact O-CB 3.3Å; L214-K218 WeakPolarHBondContact O-CB 3.36Å; L214-K218 PolarHBondContact O-N 3.48Å; L214-L226 HydrophobicContact CD2-CD2 4.2Å; L214-L392 HydrophobicContact CD2-CD1 4.25Å; L214-L394 HydrophobicContact CD2-CD1 3.97Å; L214-L394 HydrophobicContact CD2-CD2 4.31Å
215	R	98.4	Very high	97.4	Very high	118 Å²	118	46.1 Å²	46.1	45%	0.445	24%	0.239	S	C	.	.	H	α-helix	trans	-61.5	-46.7	171	-174.9	177.9	-179.3	164	-0.3	112.6	S132 A133 D211 Q213 Q219	S132-R215 VanDerWaalsContact O-CD 3.3Å; S132-R215 WeakPolarHBondContact O-CD 3.39Å; S132-R215 PolarHBondContact O-NE 3.16Å; S132-R215 WeakPolarHBondContact OG-CD 3.37Å; S132-R215 PolarHBondContact OG-NH1 3.12Å; A133-R215 HydrophobicContact CB-CB 4.01Å; D211-R215 VanDerWaalsContact O-CB 3.23Å; D211-R215 WeakPolarHBondContact O-CB 3.33Å; D211-R215 PolarHBondContact O-N 3.33Å; Q213-R215 VanDerWaalsContact C-N 3.29Å; Q213-R215 PolarHBondContact O-N 2.91Å; R215-Q219 WeakPolarHBondContact O-CG 3.41Å; R215-Q219 PolarHBondContact O-N 2.83Å
216	S	97.8	Very high	97.4	Very high	62 Å²	62	46.2 Å²	46.2	43%	0.434	24%	0.239	S	C	.	.	H	α-helix	trans	-67.7	-40.2	177.8	-176.4	0	0	0	0	112	A212 Q213 Q219 Q220	A212-S216 PolarHBondContact O-N 2.8Å; Q213-S216 PolarHBondContact O-N 2.87Å; Q213-S216 VanDerWaalsContact O-N 3.12Å; S216-Q219 WeakPolarHBondContact O-CB 3.25Å; S216-Q219 PolarHBondContact O-N 3.45Å; S216-Q220 PolarHBondContact O-N 3.36Å; S216-Q220 PolarHBondContact O-NE2 3.16Å
217	F	97.3	Very high	97.4	Very high	7 Å²	7	46.1 Å²	46.1	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-60.4	-48.1	174	165.6	-97.6	0	0	0	112.1	L160 Q213 Q219 Q220 L222 V224 L392 L394	L160-F217 HydrophobicContact CD2-CD1 3.77Å; L160-F217 HydrophobicContact CD2-CE1 3.97Å; Q213-F217 VanDerWaalsContact O-CB 3.26Å; Q213-F217 WeakPolarHBondContact O-CB 3.41Å; Q213-F217 PolarHBondContact O-N 2.88Å; F217-Q219 VanDerWaalsContact C-N 3.27Å; F217-Q219 PolarHBondContact O-N 3.34Å; F217-Q220 WeakPolarHBondContact O-CB 3.18Å; F217-Q220 PolarHBondContact O-N 3.43Å; F217-L222 HydrophobicContact CD2-CD1 3.87Å; F217-L222 HydrophobicContact CE2-CB 4.42Å; F217-L222 HydrophobicContact CE2-CD1 3.77Å; F217-V224 WeakPolarHBondContact CZ-O 3.27Å; F217-L392 HydrophobicContact CD2-CB 4.3Å; F217-L392 HydrophobicContact CE1-CD2 4.42Å; F217-L392 HydrophobicContact CE2-CB 3.75Å; F217-L392 HydrophobicContact CE2-CD2 4.39Å; F217-L392 VanDerWaalsContact CE2-O 3.27Å; F217-L392 WeakPolarHBondContact CE2-O 3.29Å; F217-L392 HydrophobicContact CZ-CB 3.94Å; F217-L392 HydrophobicContact CZ-CD2 3.78Å; F217-L392 HydrophobicContact CZ-CG 4.3Å; F217-L394 HydrophobicContact CB-CD2 3.6Å; F217-L394 HydrophobicContact CD1-CD2 4.47Å; F217-L394 HydrophobicContact CD2-CD2 3.83Å; F217-L394 HydrophobicContact CG-CD2 3.73Å
218	K	97.1	Very high	97.4	Very high	57 Å²	57	46.1 Å²	46.1	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-57.1	-38.8	174.3	178.4	174.5	-178.2	161.9	0	112.6	A133 G134 L160 D161 L214 Q220 K221	A133-K218 VanDerWaalsContact O-CD 3.3Å; A133-K218 WeakPolarHBondContact O-CD 3.3Å; A133-K218 PolarHBondContact O-NZ 3.4Å; G134-K218 PolarHBondContact O-NZ 2.89Å; L160-K218 HydrophobicContact CD1-CB 4.36Å; L160-K218 HydrophobicContact CD1-CD 3.92Å; L160-K218 HydrophobicContact CG-CB 4.36Å; L160-K218 HydrophobicContact CG-CD 4.35Å; L160-K218 VanDerWaalsContact O-CD 3.28Å; L160-K218 WeakPolarHBondContact O-CD 3.35Å; L160-K218 WeakPolarHBondContact O-CE 3.02Å; L160-K218 PolarHBondContact O-NZ 2.68Å; D161-K218 HydrophobicContact CB-CG 4.39Å; L214-K218 VanDerWaalsContact O-CB 3.3Å; L214-K218 WeakPolarHBondContact O-CB 3.36Å; L214-K218 PolarHBondContact O-N 3.48Å; K218-Q220 PolarHBondContact O-N 2.74Å; K218-K221 PolarHBondContact O-N 3.08Å; K218-K221 VanDerWaalsContact O-N 3.12Å
219	Q	96.5	Very high	97.4	Very high	136 Å²	136	44.5 Å²	44.5	64%	0.636	23%	0.228	S	C	*	.	H	α-helix	trans	-64.9	-23.6	176.9	-71.9	170.3	-2.2	0	0	113.5	R215 S216 F217 K221	R215-Q219 WeakPolarHBondContact O-CG 3.41Å; R215-Q219 PolarHBondContact O-N 2.83Å; S216-Q219 WeakPolarHBondContact O-CB 3.25Å; S216-Q219 PolarHBondContact O-N 3.45Å; F217-Q219 VanDerWaalsContact C-N 3.27Å; F217-Q219 PolarHBondContact O-N 3.34Å; Q219-K221 VanDerWaalsContact C-N 3.31Å
220	Q	95.4	Very high	97.4	Very high	109 Å²	109	44 Å²	44	51%	0.509	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.7	175.2	-63.1	170.2	58.1	0	0	113.4	S216 F217 K218 L222	S216-Q220 PolarHBondContact O-N 3.36Å; S216-Q220 PolarHBondContact O-NE2 3.16Å; F217-Q220 WeakPolarHBondContact O-CB 3.18Å; F217-Q220 PolarHBondContact O-N 3.43Å; K218-Q220 PolarHBondContact O-N 2.74Å; Q220-L222 VanDerWaalsContact C-N 3.31Å; Q220-L222 HydrophobicContact CB-CD1 4.37Å; Q220-L222 HydrophobicContact CB-CD2 4.4Å; Q220-L222 HydrophobicContact CB-CG 3.93Å; Q220-L222 PolarHBondContact O-N 2.97Å
221	K	93.1	Very high	97.4	Very high	171 Å²	171	44 Å²	44	74%	0.743	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	47	-180	-59.6	-175.2	176.7	-173.8	0	113.2	K218 Q219	K218-K221 PolarHBondContact O-N 3.08Å; K218-K221 VanDerWaalsContact O-N 3.12Å; Q219-K221 VanDerWaalsContact C-N 3.31Å
222	L	93.3	Very high	97.4	Very high	66 Å²	66	43 Å²	43	35%	0.346	22%	0.219	S	C	.	.			trans	-69.1	155.2	-179.7	-65.9	174.9	0	0	0	111.4	F217 Q220 V224	F217-L222 HydrophobicContact CD2-CD1 3.87Å; F217-L222 HydrophobicContact CE2-CB 4.42Å; F217-L222 HydrophobicContact CE2-CD1 3.77Å; Q220-L222 VanDerWaalsContact C-N 3.31Å; Q220-L222 HydrophobicContact CB-CD1 4.37Å; Q220-L222 HydrophobicContact CB-CD2 4.4Å; Q220-L222 HydrophobicContact CB-CG 3.93Å; Q220-L222 PolarHBondContact O-N 2.97Å; L222-V224 PolarHBondContact O-N 2.82Å; L222-V224 VanDerWaalsContact O-N 3.07Å
223	P	93.6	Very high	97.4	Very high	76 Å²	76	39.9 Å²	39.9	49%	0.494	19%	0.194	S	C	.	.	S	Bend	trans	-64.4	-14.7	-176.1	-24.5	35.5	0	0	0	115.4	P165 R166	P165-P223 VanDerWaalsContact CD-O 3.28Å; P165-P223 WeakPolarHBondContact CD-O 3.3Å; P165-P223 HydrophobicContact CG-CB 3.95Å; P165-P223 VanDerWaalsContact CG-O 3.24Å; P165-P223 WeakPolarHBondContact CG-O 3.41Å; R166-P223 WeakPolarHBondContact CB-O 3.47Å; R166-P223 PolarHBondContact N-O 3.49Å
224	V	97.5	Very high	97.5	Very high	10 Å²	10	39.8 Å²	39.8	6%	0.061	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.5	178.3	-176.7	0	0	0	0	108.1	R166 F217 L222 Y391 L392	R166-V224 HydrophobicContact CB-CG2 4.16Å; R166-V224 VanDerWaalsContact NH2-CG2 3.32Å; R166-V224 CarbonylContact O-C 3.58Å; R166-V224 WeakPolarHBondContact O-CA 3.34Å; F217-V224 WeakPolarHBondContact CZ-O 3.27Å; L222-V224 PolarHBondContact O-N 2.82Å; L222-V224 VanDerWaalsContact O-N 3.07Å; V224-Y391 HydrophobicContact CG1-CE1 4.17Å; V224-L392 HydrophobicContact CG1-CD2 4.25Å
225	T	98.3	Very high	97.5	Very high	3 Å²	3	40 Å²	40	2%	0.018	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	179.6	169.8	-160.4	0	0	0	0	111.9	V159 D161 A164 R166 R167 L168	V159-T225 HydrophobicContact CG1-CG2 4.15Å; D161-T225 PolarHBondContact N-OG1 3.2Å; D161-T225 WeakPolarHBondContact O-CG2 3.19Å; A164-T225 HydrophobicContact CB-CG2 3.8Å; R166-T225 PolarHBondContact O-N 3.31Å; R167-T225 WeakPolarHBondContact CA-O 3.38Å; R167-T225 HydrophobicContact CB-CG2 3.82Å; L168-T225 PolarHBondContact N-O 3.41Å
226	L	98.8	Very high	97.4	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.8	169.3	-174.7	58	0	0	0	109.8	W135 L160 L168 L170 L214 L228 L388 L392	W135-L226 HydrophobicContact CH2-CB 4.2Å; W135-L226 HydrophobicContact CH2-CD2 3.81Å; W135-L226 HydrophobicContact CH2-CG 3.87Å; W135-L226 HydrophobicContact CZ2-CD2 4.46Å; W135-L226 HydrophobicContact CZ3-CG 4.49Å; L160-L226 HydrophobicContact CB-CB 4.42Å; L160-L226 WeakPolarHBondContact CB-O 3.47Å; L160-L226 HydrophobicContact CD2-CB 4.37Å; L160-L226 PolarHBondContact N-O 3.07Å; L168-L226 HydrophobicContact CB-CD1 4.21Å; L168-L226 HydrophobicContact CD2-CD1 4Å; L168-L226 HydrophobicContact CG-CD1 4.04Å; L170-L226 HydrophobicContact CB-CD1 4.31Å; L214-L226 HydrophobicContact CD2-CD2 4.2Å; L226-L228 HydrophobicContact CD1-CD2 4.22Å; L226-L228 HydrophobicContact CD2-CD2 4.13Å; L226-L228 HydrophobicContact CG-CD2 3.99Å; L226-L388 HydrophobicContact CD1-CD2 4.24Å; L226-L388 HydrophobicContact CD2-CD1 4.49Å; L226-L392 HydrophobicContact CB-CD1 4.14Å; L226-L392 HydrophobicContact CD2-CD1 4.18Å
227	Q	98.9	Very high	97.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.3	164.3	171.8	172.2	-25.6	0	0	108.6	V157 A158 V159 R167 L168 L169 L170 V229	V157-Q227 HydrophobicContact CG1-CG 4.45Å; A158-Q227 CarbonylContact O-C 3.47Å; A158-Q227 VanDerWaalsContact O-CA 3.31Å; A158-Q227 WeakPolarHBondContact O-CA 3.08Å; V159-Q227 HydrophobicContact CG2-CB 4.28Å; V159-Q227 HydrophobicContact CG2-CG 4Å; R167-Q227 HydrophobicContact CB-CB 4.48Å; R167-Q227 HydrophobicContact CG-CB 4.49Å; L168-Q227 PolarHBondContact O-N 3.42Å; L169-Q227 WeakPolarHBondContact CA-O 3.44Å; L169-Q227 HydrophobicContact CD1-CG 4.47Å; L169-Q227 HydrophobicContact CG-CG 4.33Å; L170-Q227 PolarHBondContact N-O 2.98Å; Q227-V229 HydrophobicContact CG-CG2 4.1Å
228	L	98.9	Very high	97.3	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	142.8	167.9	-48.4	177.7	0	0	0	108.6	L128 W135 A158 L170 I203 A207 L226 F230	L128-L228 HydrophobicContact CD1-CD1 4.4Å; L128-L228 HydrophobicContact CD2-CD1 3.77Å; W135-L228 HydrophobicContact CH2-CD1 3.57Å; W135-L228 HydrophobicContact CH2-CD2 4.14Å; W135-L228 HydrophobicContact CH2-CG 3.56Å; W135-L228 HydrophobicContact CZ2-CD1 3.9Å; W135-L228 HydrophobicContact CZ2-CG 4.39Å; W135-L228 HydrophobicContact CZ3-CD1 3.96Å; W135-L228 HydrophobicContact CZ3-CG 3.71Å; A158-L228 HydrophobicContact CB-CB 4.3Å; A158-L228 PolarHBondContact N-O 3.01Å; A158-L228 PolarHBondContact O-N 3.35Å; L170-L228 HydrophobicContact CB-CD2 3.97Å; L170-L228 HydrophobicContact CD2-CD2 4.03Å; L170-L228 HydrophobicContact CG-CD2 4.4Å; L170-L228 CarbonylContact O-C 3.37Å; L170-L228 VanDerWaalsContact O-CA 3.25Å; L170-L228 WeakPolarHBondContact O-CA 3.28Å; I203-L228 HydrophobicContact CG2-CB 4.29Å; I203-L228 HydrophobicContact CG2-CD1 3.86Å; I203-L228 HydrophobicContact CG2-CD2 3.78Å; I203-L228 HydrophobicContact CG2-CG 4.17Å; A207-L228 HydrophobicContact CB-CD1 4.08Å; L226-L228 HydrophobicContact CD1-CD2 4.22Å; L226-L228 HydrophobicContact CD2-CD2 4.13Å; L226-L228 HydrophobicContact CG-CD2 3.99Å; L228-F230 HydrophobicContact CB-CE2 4.01Å
229	V	98.9	Very high	97.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.5	168.6	-176.5	0	0	0	0	109.3	V156 V157 L169 L170 A171 C172 Q227 F231 L252	V156-V229 WeakPolarHBondContact O-CA 3.09Å; V157-V229 HydrophobicContact CG2-CG1 4.37Å; V157-V229 HydrophobicContact CG2-CG2 4.42Å; L169-V229 HydrophobicContact CD1-CG2 4.12Å; L169-V229 HydrophobicContact CD2-CG2 4.24Å; L169-V229 HydrophobicContact CG-CG2 4.17Å; L170-V229 PolarHBondContact O-N 3.46Å; A171-V229 WeakPolarHBondContact CA-O 3.39Å; A171-V229 HydrophobicContact CB-CB 3.83Å; A171-V229 WeakPolarHBondContact CB-O 3.45Å; C172-V229 PolarHBondContact N-O 3.33Å; Q227-V229 HydrophobicContact CG-CG2 4.1Å; V229-F231 HydrophobicContact CB-CE2 4.27Å; V229-F231 HydrophobicContact CB-CZ 4.22Å; V229-F231 HydrophobicContact CG1-CD1 3.72Å; V229-F231 HydrophobicContact CG1-CD2 4.05Å; V229-F231 HydrophobicContact CG1-CE1 3.6Å; V229-F231 HydrophobicContact CG1-CE2 3.92Å; V229-F231 HydrophobicContact CG1-CG 3.95Å; V229-F231 HydrophobicContact CG1-CZ 3.71Å; V229-L252 HydrophobicContact CB-CD2 4.49Å; V229-L252 HydrophobicContact CG1-CD2 3.6Å; V229-L252 HydrophobicContact CG2-CD2 4.03Å
230	F	98.9	Very high	97.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	105.8	168.7	-55.7	-104.2	0	0	0	105.7	I124 L128 N155 V156 C172 Y174 C200 I203 L204 L228	I124-F230 HydrophobicContact CD1-CB 4.11Å; I124-F230 HydrophobicContact CD1-CD1 3.76Å; I124-F230 HydrophobicContact CD1-CE1 4.39Å; I124-F230 HydrophobicContact CD1-CG 4.01Å; I124-F230 HydrophobicContact CG1-CD1 4.27Å; I124-F230 HydrophobicContact CG1-CE1 4.43Å; I124-F230 HydrophobicContact CG2-CB 4.43Å; I124-F230 HydrophobicContact CG2-CD1 3.99Å; I124-F230 HydrophobicContact CG2-CD2 3.5Å; I124-F230 VanDerWaalsContact CG2-CD2 3.5Å; I124-F230 HydrophobicContact CG2-CE1 4.05Å; I124-F230 HydrophobicContact CG2-CE2 3.61Å; I124-F230 HydrophobicContact CG2-CG 3.71Å; I124-F230 HydrophobicContact CG2-CZ 3.87Å; L128-F230 HydrophobicContact CD1-CE2 3.67Å; L128-F230 HydrophobicContact CD1-CZ 4.25Å; N155-F230 WeakPolarHBondContact CA-O 3.36Å; V156-F230 HydrophobicContact CB-CB 4.23Å; V156-F230 HydrophobicContact CB-CD2 4.43Å; V156-F230 PolarHBondContact N-O 3.04Å; V156-F230 PolarHBondContact O-N 2.78Å; C172-F230 WeakPolarHBondContact O-CA 3.2Å; Y174-F230 HydrophobicContact CD1-CB 3.88Å; Y174-F230 HydrophobicContact CG-CB 4.49Å; C200-F230 HydrophobicContact CB-CD1 4.27Å; C200-F230 HydrophobicContact CB-CE1 4.24Å; I203-F230 HydrophobicContact CB-CE1 4.15Å; I203-F230 HydrophobicContact CB-CZ 4.02Å; I203-F230 HydrophobicContact CG2-CE1 4.15Å; I203-F230 HydrophobicContact CG2-CE2 4.24Å; I203-F230 HydrophobicContact CG2-CZ 3.54Å; L204-F230 HydrophobicContact CD2-CE1 4.42Å; L204-F230 HydrophobicContact CD2-CZ 3.93Å; L204-F230 HydrophobicContact CG-CE1 4.29Å; L204-F230 HydrophobicContact CG-CZ 4.22Å; L228-F230 HydrophobicContact CB-CE2 4.01Å
231	F	99	Very high	97.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	151.7	-176.6	-62.6	-79.2	0	0	0	111.7	N155 A171 C172 H173 Y174 V229 L252 F277 D339 F343	N155-F231 VanDerWaalsContact OD1-CA 3.31Å; N155-F231 WeakPolarHBondContact OD1-CA 3.39Å; A171-F231 HydrophobicContact CB-CD2 4.23Å; A171-F231 HydrophobicContact CB-CE2 3.63Å; A171-F231 HydrophobicContact CB-CZ 4.48Å; C172-F231 WeakPolarHBondContact O-CD2 3.38Å; C172-F231 PolarHBondContact O-N 3.19Å; H173-F231 CarbonylContact C-O 3.59Å; H173-F231 WeakPolarHBondContact CA-O 3.42Å; H173-F231 HydrophobicContact CB-CB 4.25Å; Y174-F231 WeakPolarHBondContact CD1-O 3.46Å; Y174-F231 PolarHBondContact N-O 2.82Å; V229-F231 HydrophobicContact CB-CE2 4.27Å; V229-F231 HydrophobicContact CB-CZ 4.22Å; V229-F231 HydrophobicContact CG1-CD1 3.72Å; V229-F231 HydrophobicContact CG1-CD2 4.05Å; V229-F231 HydrophobicContact CG1-CE1 3.6Å; V229-F231 HydrophobicContact CG1-CE2 3.92Å; V229-F231 HydrophobicContact CG1-CG 3.95Å; V229-F231 HydrophobicContact CG1-CZ 3.71Å; F231-L252 HydrophobicContact CD1-CD2 4.4Å; F231-L252 HydrophobicContact CE1-CB 4.22Å; F231-L252 HydrophobicContact CE1-CD2 3.78Å; F231-F277 HydrophobicContact CE2-CE2 4.37Å; F231-F277 AromaticContact CE2-CZ 3.72Å; F231-F277 HydrophobicContact CE2-CZ 3.72Å; F231-F277 HydrophobicContact CZ-CE1 4.35Å; F231-F277 AromaticContact CZ-CZ 3.9Å; F231-F277 HydrophobicContact CZ-CZ 3.9Å; F231-D339 WeakPolarHBondContact CB-OD2 3.22Å; F231-D339 HydrophobicContact CD2-CB 3.84Å; F231-D339 WeakPolarHBondContact CD2-OD2 3.5Å; F231-D339 HydrophobicContact CE2-CB 3.95Å; F231-D339 HydrophobicContact CG-CB 4.39Å; F231-D339 WeakPolarHBondContact CG-OD2 3.28Å; F231-F343 AromaticContact CE1-CE2 3.82Å; F231-F343 HydrophobicContact CE1-CE2 3.82Å; F231-F343 AromaticContact CE1-CZ 3.94Å; F231-F343 HydrophobicContact CE1-CZ 3.94Å; F231-F343 AromaticContact CZ-CE2 3.69Å; F231-F343 HydrophobicContact CZ-CE2 3.69Å; F231-F343 AromaticContact CZ-CZ 3.84Å; F231-F343 HydrophobicContact CZ-CZ 3.84Å
232	D	98.9	Very high	97.4	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.011	18%	0.183	C	C	.	.	S	Bend	trans	-116.7	131.6	175.2	-169.9	23.8	0	0	0	110.1	P112 F153 T154 N155 Y174 G248	P112-D232 WeakPolarHBondContact CB-OD1 3.46Å; F153-D232 WeakPolarHBondContact CA-OD2 3.35Å; F153-D232 HydrophobicContact CB-CB 4.44Å; T154-D232 PolarHBondContact N-OD2 3.15Å; N155-D232 PolarHBondContact OD1-N 3.47Å; N155-D232 VanDerWaalsContact OD1-N 3.12Å; Y174-D232 HydrophobicContact CD1-CB 4.47Å; Y174-D232 HydrophobicContact CE1-CB 3.64Å; Y174-D232 PolarHBondContact OH-OD2 3.39Å; D232-G248 WeakPolarHBondContact O-CA 3.46Å; D232-G248 PolarHBondContact O-N 3.41Å
233	G	98.8	Very high	97.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.195	C	C	.	.			trans	69.3	47.4	-175.8	0	0	0	0	0	113.2	D175 L246 Y247	D175-G233 PolarHBondContact OD1-N 2.92Å; D175-G233 WeakPolarHBondContact OD2-CA 3.26Å; D175-G233 PolarHBondContact OD2-N 3.2Å; G233-L246 CarbonylContact O-C 3.59Å; G233-L246 PolarHBondContact O-N 2.72Å; G233-Y247 VanDerWaalsContact O-CB 3.32Å; G233-Y247 WeakPolarHBondContact O-CB 3.46Å; G233-Y247 WeakPolarHBondContact O-CD2 3.42Å; G233-Y247 PolarHBondContact O-N 3.28Å
234	E	98.9	Very high	97.7	Very high	12 Å²	12	31.9 Å²	31.9	6%	0.056	17%	0.173	C	C	.	.			trans	-57.2	-40.2	157.6	-165	-73.1	161.2	0	0	108.6	H173 D175 W240 S245 L246 D338	H173-E234 HydrophobicContact CB-CB 3.42Å; H173-E234 VanDerWaalsContact CB-CB 3.42Å; H173-E234 HydrophobicContact CB-CG 3.95Å; H173-E234 VanDerWaalsContact CG-CB 3.46Å; D175-E234 PolarHBondContact OD1-N 2.77Å; D175-E234 PolarHBondContact OD2-N 3.45Å; E234-W240 WeakPolarHBondContact OE1-CH2 3.47Å; E234-S245 CarbonylContact O-C 3.46Å; E234-S245 WeakPolarHBondContact O-CA 3.43Å; E234-L246 HydrophobicContact CG-CD2 3.92Å; E234-L246 PolarHBondContact O-N 2.69Å; E234-L246 WeakPolarHBondContact OE1-CD2 3.34Å; E234-D338 WeakPolarHBondContact OE1-CA 3.29Å
235	E	98.6	Very high	97.8	Very high	7 Å²	7	31.5 Å²	31.5	3%	0.033	17%	0.171	C	C	.	.	S	Bend	trans	-82.2	152.2	-162.9	-91	-75.5	-116.4	0	0	116.2	D175 K177 H363	D175-E235 PolarHBondContact OD2-N 3.41Å; K177-E235 HydrophobicContact CB-CG 4.24Å; K177-E235 WeakPolarHBondContact CB-OE1 3.46Å; K177-E235 WeakPolarHBondContact CD-OE1 3.39Å; K177-E235 WeakPolarHBondContact CE-OE1 3.42Å; K177-E235 HydrophobicContact CG-CG 4.48Å; K177-E235 WeakPolarHBondContact CG-OE1 3.36Å; K177-E235 IonicContact NZ-OE1 3.13Å; K177-E235 PolarHBondContact NZ-OE1 2.97Å; K177-E235 IonicContact NZ-OE2 2.91Å; K177-E235 PolarHBondContact NZ-OE2 2.72Å; E235-H363 IonicContact OE1-CD2 2.74Å; E235-H363 IonicContact OE1-NE2 2.7Å; E235-H363 IonicContact OE2-NE2 3.61Å
236	S	97.5	Very high	97.8	Very high	7 Å²	7	31.8 Å²	31.8	5%	0.049	17%	0.172	C	C	.	.			trans	-75.2	133.2	171.9	81.8	0	0	0	0	111.5	K177 W240 D244	K177-S236 PolarHBondContact NZ-O 2.66Å; K177-S236 PolarHBondContact NZ-OG 3.46Å; S236-W240 PolarHBondContact OG-N 3.29Å; S236-D244 WeakPolarHBondContact CB-O 3.45Å
237	F	96.4	Very high	97.8	Very high	18 Å²	18	31.9 Å²	31.9	8%	0.079	17%	0.172	C	C	.	.	S	Bend	trans	-74.9	-29.6	173.7	-74.6	-102.7	0	0	0	112	P112 T146 R148 V151 F153 D244 Y247	P112-F237 HydrophobicContact CB-CZ 4.13Å; P112-F237 HydrophobicContact CG-CE2 4.47Å; P112-F237 HydrophobicContact CG-CZ 3.98Å; T146-F237 HydrophobicContact CG2-CD2 3.94Å; T146-F237 HydrophobicContact CG2-CE1 4.43Å; T146-F237 HydrophobicContact CG2-CE2 3.69Å; T146-F237 HydrophobicContact CG2-CG 4.43Å; T146-F237 HydrophobicContact CG2-CZ 3.96Å; R148-F237 HydrophobicContact CB-CD1 4.45Å; R148-F237 HydrophobicContact CG-CB 4.28Å; R148-F237 HydrophobicContact CG-CD1 4.35Å; R148-F237 VanDerWaalsContact CZ-O 3.29Å; R148-F237 PolarHBondContact NE-O 3.3Å; R148-F237 VanDerWaalsContact NE-O 3.15Å; R148-F237 PolarHBondContact NH2-O 3.48Å; V151-F237 HydrophobicContact CB-CZ 4.49Å; V151-F237 HydrophobicContact CG1-CZ 4.19Å; V151-F237 HydrophobicContact CG2-CE1 4.12Å; V151-F237 HydrophobicContact CG2-CZ 4.17Å; F153-F237 AromaticContact CE1-CE2 3.85Å; F153-F237 HydrophobicContact CE1-CE2 3.85Å; F153-F237 HydrophobicContact CE1-CZ 4.03Å; F153-F237 AromaticContact CZ-CE2 3.73Å; F153-F237 HydrophobicContact CZ-CE2 3.73Å; F153-F237 AromaticContact CZ-CZ 3.95Å; F153-F237 HydrophobicContact CZ-CZ 3.95Å; F237-D244 WeakPolarHBondContact CB-OD1 3.43Å; F237-D244 PolarHBondContact N-OD1 3.22Å; F237-D244 PolarHBondContact N-OD2 2.77Å; F237-Y247 AromaticContact CD2-CE2 3.8Å; F237-Y247 HydrophobicContact CD2-CE2 3.8Å; F237-Y247 HydrophobicContact CE2-CD2 4.22Å; F237-Y247 AromaticContact CE2-CE2 3.79Å; F237-Y247 HydrophobicContact CE2-CE2 3.79Å
238	E	95	Very high	97.8	Very high	123 Å²	123	31.9 Å²	31.9	58%	0.575	17%	0.172	S	C	*	.	S	Bend	trans	-135.8	-63.6	176.3	-68.5	-179.4	-160.3	0	0	111.4	P147 D244	P147-E238 HydrophobicContact CB-CB 4.23Å; P147-E238 HydrophobicContact CB-CG 3.84Å; P147-E238 WeakPolarHBondContact CB-OE1 3.25Å; P147-E238 HydrophobicContact CG-CB 4.27Å; P147-E238 HydrophobicContact CG-CG 4.36Å; E238-D244 PolarHBondContact N-OD2 2.79Å
239	E	94.4	Very high	97.8	Very high	150 Å²	150	31.7 Å²	31.7	70%	0.701	17%	0.172	S	C	*	.	S	Bend	trans	-135.2	130.4	-176.1	-71.3	-168	169.2	0	0	111.4	T241 D244	E239-T241 WeakPolarHBondContact O-CG2 3.35Å; E239-T241 PolarHBondContact O-N 2.88Å; E239-T241 PolarHBondContact O-OG1 3.18Å; E239-D244 PolarHBondContact N-OD2 3.42Å; E239-D244 WeakPolarHBondContact O-CB 3.31Å
240	W	97.1	Very high	97.8	Very high	85 Å²	85	35.4 Å²	35.4	32%	0.322	19%	0.185	S	C	.	.			trans	-59.6	107	179.2	-174.6	-81.9	0	0	0	111.7	E234 S236 L246 Q337	E234-W240 WeakPolarHBondContact OE1-CH2 3.47Å; S236-W240 PolarHBondContact OG-N 3.29Å; W240-L246 HydrophobicContact CH2-CD2 3.56Å; W240-L246 HydrophobicContact CH2-CG 3.89Å; W240-L246 HydrophobicContact CZ2-CD1 4.2Å; W240-L246 HydrophobicContact CZ2-CD2 4.06Å; W240-L246 HydrophobicContact CZ2-CG 3.95Å; W240-Q337 HydrophobicContact CZ2-CB 3.74Å
241	T	97.3	Very high	97.8	Very high	56 Å²	56	38.3 Å²	38.3	34%	0.344	20%	0.199	S	C	.	.			trans	-141.2	166.8	-179.6	60.9	0	0	0	0	110.7	E239 T243 D244 S245	E239-T241 WeakPolarHBondContact O-CG2 3.35Å; E239-T241 PolarHBondContact O-N 2.88Å; E239-T241 PolarHBondContact O-OG1 3.18Å; T241-T243 PolarHBondContact O-N 2.82Å; T241-D244 PolarHBondContact N-O 2.94Å; T241-D244 CarbonylContact O-C 3.41Å; T241-D244 PolarHBondContact O-N 3.12Å; T241-D244 WeakPolarHBondContact OG1-CB 3.35Å; T241-D244 PolarHBondContact OG1-N 3.08Å; T241-S245 PolarHBondContact O-OG 3.45Å
242	A	95.6	Very high	97.8	Very high	89 Å²	89	38.5 Å²	38.5	74%	0.736	20%	0.2	S	C	*	.	S	Bend	trans	-61.5	-2.6	177.5	0	0	0	0	0	115.2
243	T	96.4	Very high	97.8	Very high	97 Å²	97	38.4 Å²	38.4	60%	0.595	20%	0.2	S	C	*	.	S	Bend	trans	-125.6	-26.9	176.5	45.5	0	0	0	0	114	T241 Y247 R250	T241-T243 PolarHBondContact O-N 2.82Å; T243-Y247 WeakPolarHBondContact O-CE1 3.22Å; T243-Y247 PolarHBondContact O-OH 2.99Å; T243-Y247 VanDerWaalsContact O-OH 3.09Å; T243-R250 PolarHBondContact O-NH2 3.06Å; T243-R250 VanDerWaalsContact O-NH2 3.11Å
244	D	98.2	Very high	97.8	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.027	22%	0.22	C	C	.	.	S	Bend	trans	-109.6	67.9	172.1	-174.6	36.8	0	0	0	110.1	P147 S236 F237 E238 E239 T241 Y247	P147-D244 HydrophobicContact CG-CB 4.06Å; S236-D244 WeakPolarHBondContact CB-O 3.45Å; F237-D244 WeakPolarHBondContact CB-OD1 3.43Å; F237-D244 PolarHBondContact N-OD1 3.22Å; F237-D244 PolarHBondContact N-OD2 2.77Å; E238-D244 PolarHBondContact N-OD2 2.79Å; E239-D244 PolarHBondContact N-OD2 3.42Å; E239-D244 WeakPolarHBondContact O-CB 3.31Å; T241-D244 PolarHBondContact N-O 2.94Å; T241-D244 CarbonylContact O-C 3.41Å; T241-D244 PolarHBondContact O-N 3.12Å; T241-D244 WeakPolarHBondContact OG1-CB 3.35Å; T241-D244 PolarHBondContact OG1-N 3.08Å; D244-Y247 PolarHBondContact OD1-OH 2.88Å
245	S	98.6	Very high	97.8	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.021	24%	0.235	C	C	.	.	S	Bend	trans	178.8	166.2	169.4	60.3	0	0	0	0	108.4	E234 T241 Y247 R250	E234-S245 CarbonylContact O-C 3.46Å; E234-S245 WeakPolarHBondContact O-CA 3.43Å; T241-S245 PolarHBondContact O-OG 3.45Å; S245-Y247 PolarHBondContact O-N 3.5Å; S245-R250 PolarHBondContact O-NE 3.36Å; S245-R250 PolarHBondContact O-NH2 3.05Å
246	L	98.8	Very high	97.8	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.042	24%	0.236	C	C	.	.			trans	54.3	32.7	166.3	-52.9	-170.3	0	0	0	114.5	G233 E234 W240 S249 R250 D338 I341 P342	G233-L246 CarbonylContact O-C 3.59Å; G233-L246 PolarHBondContact O-N 2.72Å; E234-L246 HydrophobicContact CG-CD2 3.92Å; E234-L246 PolarHBondContact O-N 2.69Å; E234-L246 WeakPolarHBondContact OE1-CD2 3.34Å; W240-L246 HydrophobicContact CH2-CD2 3.56Å; W240-L246 HydrophobicContact CH2-CG 3.89Å; W240-L246 HydrophobicContact CZ2-CD1 4.2Å; W240-L246 HydrophobicContact CZ2-CD2 4.06Å; W240-L246 HydrophobicContact CZ2-CG 3.95Å; L246-S249 PolarHBondContact O-OG 2.95Å; L246-R250 HydrophobicContact CB-CG 4.08Å; L246-R250 WeakPolarHBondContact O-CB 3.29Å; L246-R250 WeakPolarHBondContact O-CG 3.46Å; L246-R250 PolarHBondContact O-N 3.11Å; L246-R250 PolarHBondContact O-NE 3.4Å; L246-R250 VanDerWaalsContact O-NE 3.1Å; L246-D338 WeakPolarHBondContact CD1-O 3.33Å; L246-D338 VanDerWaalsContact CD2-C 3.43Å; L246-I341 HydrophobicContact CD1-CB 4.13Å; L246-P342 HydrophobicContact CD1-CG 4.47Å
247	Y	98.9	Very high	97.8	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-56.9	-53.2	-177.8	-71.1	-86.3	0	0	0	111.2	F142 P145 T146 F153 G233 F237 T243 D244 S245 H251	F142-Y247 WeakPolarHBondContact CZ-O 3.43Å; P145-Y247 PolarHBondContact O-OH 3Å; T146-Y247 WeakPolarHBondContact CA-OH 3.37Å; T146-Y247 WeakPolarHBondContact CB-OH 3.49Å; T146-Y247 HydrophobicContact CG2-CE1 4.08Å; T146-Y247 HydrophobicContact CG2-CE2 4.48Å; F153-Y247 HydrophobicContact CD1-CG 4.27Å; F153-Y247 HydrophobicContact CE1-CD1 4.2Å; F153-Y247 AromaticContact CE1-CD2 3.75Å; F153-Y247 HydrophobicContact CE1-CD2 3.75Å; F153-Y247 HydrophobicContact CE1-CE2 4.47Å; F153-Y247 AromaticContact CE1-CG 3.58Å; F153-Y247 HydrophobicContact CE1-CG 3.58Å; F153-Y247 AromaticContact CE2-CD1 3.85Å; F153-Y247 HydrophobicContact CE2-CD1 3.85Å; F153-Y247 HydrophobicContact CE2-CE1 4.33Å; F153-Y247 HydrophobicContact CE2-CG 4.07Å; F153-Y247 AromaticContact CZ-CD1 3.6Å; F153-Y247 HydrophobicContact CZ-CD1 3.6Å; F153-Y247 AromaticContact CZ-CD2 3.76Å; F153-Y247 HydrophobicContact CZ-CD2 3.76Å; F153-Y247 HydrophobicContact CZ-CE1 4.01Å; F153-Y247 HydrophobicContact CZ-CE2 4.15Å; F153-Y247 AromaticContact CZ-CG 3.46Å; F153-Y247 HydrophobicContact CZ-CG 3.46Å; F153-Y247 VanDerWaalsContact CZ-CG 3.46Å; G233-Y247 VanDerWaalsContact O-CB 3.32Å; G233-Y247 WeakPolarHBondContact O-CB 3.46Å; G233-Y247 WeakPolarHBondContact O-CD2 3.42Å; G233-Y247 PolarHBondContact O-N 3.28Å; F237-Y247 AromaticContact CD2-CE2 3.8Å; F237-Y247 HydrophobicContact CD2-CE2 3.8Å; F237-Y247 HydrophobicContact CE2-CD2 4.22Å; F237-Y247 AromaticContact CE2-CE2 3.79Å; F237-Y247 HydrophobicContact CE2-CE2 3.79Å; T243-Y247 WeakPolarHBondContact O-CE1 3.22Å; T243-Y247 PolarHBondContact O-OH 2.99Å; T243-Y247 VanDerWaalsContact O-OH 3.09Å; D244-Y247 PolarHBondContact OD1-OH 2.88Å; S245-Y247 PolarHBondContact O-N 3.5Å; Y247-H251 PolarHBondContact O-N 3.38Å; Y247-H251 VanDerWaalsContact O-N 3.11Å
248	G	98.9	Very high	97.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.6	-53	-179.2	0	0	0	0	0	113.4	N155 D232 H251 L252	N155-G248 PolarHBondContact ND2-O 3.4Å; N155-G248 WeakPolarHBondContact OD1-CA 3.47Å; D232-G248 WeakPolarHBondContact O-CA 3.46Å; D232-G248 PolarHBondContact O-N 3.41Å; G248-H251 PolarHBondContact O-N 2.87Å; G248-L252 WeakPolarHBondContact O-CB 3.4Å; G248-L252 PolarHBondContact O-N 3.35Å
249	S	98.9	Very high	98	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-70.5	-35.6	-179.6	58	0	0	0	0	114.1	L246 H251 L252 A253 D339	L246-S249 PolarHBondContact O-OG 2.95Å; S249-H251 VanDerWaalsContact C-N 3.31Å; S249-H251 PolarHBondContact O-N 3.49Å; S249-L252 PolarHBondContact O-N 3.4Å; S249-A253 WeakPolarHBondContact O-CB 3.5Å; S249-A253 PolarHBondContact O-N 3.07Å; S249-D339 VanDerWaalsContact CB-O 3.29Å; S249-D339 WeakPolarHBondContact CB-O 3.12Å; S249-D339 WeakPolarHBondContact CB-OD1 3.43Å; S249-D339 WeakPolarHBondContact OG-CA 3Å; S249-D339 PolarHBondContact OG-OD1 3.34Å
250	R	98.9	Very high	98.2	Very high	77 Å²	77	45.4 Å²	45.4	29%	0.291	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-43	172.4	-75.1	-179.1	-64.9	121.4	-6.9	110.8	T243 S245 L246 E254 P342	T243-R250 PolarHBondContact O-NH2 3.06Å; T243-R250 VanDerWaalsContact O-NH2 3.11Å; S245-R250 PolarHBondContact O-NE 3.36Å; S245-R250 PolarHBondContact O-NH2 3.05Å; L246-R250 HydrophobicContact CB-CG 4.08Å; L246-R250 WeakPolarHBondContact O-CB 3.29Å; L246-R250 WeakPolarHBondContact O-CG 3.46Å; L246-R250 PolarHBondContact O-N 3.11Å; L246-R250 PolarHBondContact O-NE 3.4Å; L246-R250 VanDerWaalsContact O-NE 3.1Å; R250-E254 PolarHBondContact O-N 3Å; R250-P342 HydrophobicContact CB-CG 4.4Å; R250-P342 HydrophobicContact CG-CB 4.41Å; R250-P342 HydrophobicContact CG-CG 3.69Å
251	H	98.9	Very high	98.1	Very high	62 Å²	62	42.3 Å²	42.3	29%	0.287	24%	0.243	S	C	.	.	H	α-helix	trans	-65.6	-55.4	175.7	-171.3	-99.8	0	0	0	111.7	D140 F142 Y247 G248 S249 A253 E254 L255	D140-H251 IonicContact OD1-CE1 3.05Å; D140-H251 PolarHBondContact OD1-CE1 3.16Å; D140-H251 IonicContact OD1-ND1 3.48Å; D140-H251 PolarHBondContact OD1-ND1 2.99Å; D140-H251 VanDerWaalsContact OD1-ND1 3.13Å; D140-H251 IonicContact OD2-CE1 3.71Å; D140-H251 IonicContact OD2-ND1 3.23Å; D140-H251 PolarHBondContact OD2-ND1 2.98Å; F142-H251 HydrophobicContact CD1-CB 3.88Å; F142-H251 AromaticContact CD1-CD2 3.94Å; F142-H251 AromaticContact CD1-CE1 3.77Å; F142-H251 AromaticContact CD1-CG 3.43Å; F142-H251 VanDerWaalsContact CD1-CG 3.43Å; F142-H251 AromaticContact CD1-ND1 3.32Å; F142-H251 VanDerWaalsContact CD1-ND1 3.32Å; F142-H251 WeakPolarHBondContact CD1-ND1 3.25Å; F142-H251 HydrophobicContact CD2-CB 4.17Å; F142-H251 AromaticContact CD2-CD2 3.8Å; F142-H251 AromaticContact CD2-CG 3.91Å; F142-H251 HydrophobicContact CE1-CB 3.53Å; F142-H251 AromaticContact CE1-CG 3.65Å; F142-H251 AromaticContact CE1-ND1 3.8Å; F142-H251 HydrophobicContact CE2-CB 3.84Å; F142-H251 HydrophobicContact CG-CB 4.2Å; F142-H251 AromaticContact CG-CD2 3.6Å; F142-H251 AromaticContact CG-CE1 3.86Å; F142-H251 AromaticContact CG-CG 3.58Å; F142-H251 AromaticContact CG-ND1 3.76Å; F142-H251 AromaticContact CG-NE2 3.8Å; F142-H251 HydrophobicContact CZ-CB 3.51Å; F142-H251 AromaticContact CZ-CG 3.99Å; Y247-H251 PolarHBondContact O-N 3.38Å; Y247-H251 VanDerWaalsContact O-N 3.11Å; G248-H251 PolarHBondContact O-N 2.87Å; S249-H251 VanDerWaalsContact C-N 3.31Å; S249-H251 PolarHBondContact O-N 3.49Å; H251-A253 VanDerWaalsContact C-N 3.35Å; H251-A253 PolarHBondContact O-N 3.43Å; H251-E254 PolarHBondContact O-N 3.03Å; H251-E254 VanDerWaalsContact O-N 3.08Å; H251-L255 PolarHBondContact O-N 3.34Å
252	L	98.9	Very high	97.7	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-34.8	-173.2	-172	62.5	0	0	0	112.7	D140 V157 V229 F231 G248 S249 E254 L255 L256 F343	D140-L252 HydrophobicContact CB-CD1 4.43Å; V157-L252 HydrophobicContact CG2-CD1 4.09Å; V157-L252 HydrophobicContact CG2-CD2 3.76Å; V229-L252 HydrophobicContact CB-CD2 4.49Å; V229-L252 HydrophobicContact CG1-CD2 3.6Å; V229-L252 HydrophobicContact CG2-CD2 4.03Å; F231-L252 HydrophobicContact CD1-CD2 4.4Å; F231-L252 HydrophobicContact CE1-CB 4.22Å; F231-L252 HydrophobicContact CE1-CD2 3.78Å; G248-L252 WeakPolarHBondContact O-CB 3.4Å; G248-L252 PolarHBondContact O-N 3.35Å; S249-L252 PolarHBondContact O-N 3.4Å; L252-E254 VanDerWaalsContact C-N 3.29Å; L252-E254 PolarHBondContact O-N 2.99Å; L252-L255 HydrophobicContact CD1-CD2 4.18Å; L252-L255 PolarHBondContact O-N 2.94Å; L252-L256 HydrophobicContact CD1-CD1 4.15Å; L252-L256 HydrophobicContact CD1-CD2 4.5Å; L252-L256 HydrophobicContact CD1-CG 3.97Å; L252-L256 HydrophobicContact CD2-CD1 4.31Å; L252-L256 HydrophobicContact CG-CD1 3.79Å; L252-L256 HydrophobicContact CG-CG 4.09Å; L252-L256 VanDerWaalsContact O-CB 3.28Å; L252-L256 WeakPolarHBondContact O-CB 3.49Å; L252-L256 WeakPolarHBondContact O-CG 3.45Å; L252-L256 PolarHBondContact O-N 2.9Å; L252-F343 HydrophobicContact CB-CZ 4.46Å; L252-F343 HydrophobicContact CD2-CZ 4.45Å; L252-F343 HydrophobicContact CG-CZ 4.38Å
253	A	98.9	Very high	97.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-31.5	174.7	0	0	0	0	0	112.6	S249 H251 A257 P342 F343 K346	S249-A253 WeakPolarHBondContact O-CB 3.5Å; S249-A253 PolarHBondContact O-N 3.07Å; H251-A253 VanDerWaalsContact C-N 3.35Å; H251-A253 PolarHBondContact O-N 3.43Å; A253-A257 VanDerWaalsContact O-CB 3.25Å; A253-A257 WeakPolarHBondContact O-CB 3.41Å; A253-A257 PolarHBondContact O-N 3.01Å; A253-P342 HydrophobicContact CB-CB 3.62Å; A253-F343 HydrophobicContact CB-CD1 4.45Å; A253-F343 HydrophobicContact CB-CD2 3.72Å; A253-F343 HydrophobicContact CB-CE1 4.43Å; A253-F343 HydrophobicContact CB-CE2 3.71Å; A253-F343 HydrophobicContact CB-CG 4.1Å; A253-F343 HydrophobicContact CB-CZ 4.07Å; A253-K346 HydrophobicContact CB-CD 4.21Å; A253-K346 WeakPolarHBondContact O-CD 3.35Å; A253-K346 WeakPolarHBondContact O-CE 3.45Å
254	E	98.8	Very high	96.7	Very high	92 Å²	92	37.8 Å²	37.8	43%	0.43	21%	0.213	S	C	.	.	H	α-helix	trans	-78.2	-42.9	173.7	-166	60.1	-129.7	0	0	111.3	R250 H251 L252 A257 N258 K346	R250-E254 PolarHBondContact O-N 3Å; H251-E254 PolarHBondContact O-N 3.03Å; H251-E254 VanDerWaalsContact O-N 3.08Å; L252-E254 VanDerWaalsContact C-N 3.29Å; L252-E254 PolarHBondContact O-N 2.99Å; E254-A257 WeakPolarHBondContact O-CB 3.31Å; E254-A257 PolarHBondContact O-N 3.02Å; E254-A257 VanDerWaalsContact O-N 3.17Å; E254-N258 PolarHBondContact O-N 2.88Å; E254-N258 VanDerWaalsContact O-N 3.11Å; E254-N258 PolarHBondContact O-ND2 3.36Å; E254-N258 PolarHBondContact OE1-ND2 3.41Å; E254-K346 IonicContact OE1-NZ 3.36Å; E254-K346 IonicContact OE2-NZ 2.69Å; E254-K346 PolarHBondContact OE2-NZ 3.23Å
255	L	98.8	Very high	96.2	Very high	69 Å²	69	39.2 Å²	39.2	36%	0.361	22%	0.223	S	C	.	.	H	α-helix	trans	-57.2	-53	174.9	178.3	59.2	0	0	0	111	D140 H251 L252 A257 N258 T259	D140-L255 VanDerWaalsContact OD1-CD2 3.27Å; D140-L255 WeakPolarHBondContact OD1-CD2 3.45Å; H251-L255 PolarHBondContact O-N 3.34Å; L252-L255 HydrophobicContact CD1-CD2 4.18Å; L252-L255 PolarHBondContact O-N 2.94Å; L255-A257 PolarHBondContact O-N 2.68Å; L255-N258 CarbonylContact O-C 3.59Å; L255-N258 PolarHBondContact O-N 3.32Å; L255-T259 PolarHBondContact O-N 3.16Å; L255-T259 PolarHBondContact O-OG1 3.5Å
256	L	98.5	Very high	95.7	Very high	13 Å²	13	44.1 Å²	44.1	7%	0.068	26%	0.255	C	S	.	.	H	α-helix	trans	-64.1	-27.5	177.9	-67	172.8	0	0	0	112.9	L252 N258 A270 L271 F343	L252-L256 HydrophobicContact CD1-CD1 4.15Å; L252-L256 HydrophobicContact CD1-CD2 4.5Å; L252-L256 HydrophobicContact CD1-CG 3.97Å; L252-L256 HydrophobicContact CD2-CD1 4.31Å; L252-L256 HydrophobicContact CG-CD1 3.79Å; L252-L256 HydrophobicContact CG-CG 4.09Å; L252-L256 VanDerWaalsContact O-CB 3.28Å; L252-L256 WeakPolarHBondContact O-CB 3.49Å; L252-L256 WeakPolarHBondContact O-CG 3.45Å; L252-L256 PolarHBondContact O-N 2.9Å; L256-N258 VanDerWaalsContact C-N 3.32Å; L256-A270 HydrophobicContact CB-CB 4.31Å; L256-A270 HydrophobicContact CD2-CB 3.6Å; L256-A270 PolarHBondContact O-N 3.48Å; L256-L271 HydrophobicContact CB-CB 3.93Å; L256-L271 HydrophobicContact CB-CD1 4.22Å; L256-L271 WeakPolarHBondContact O-CB 3.37Å; L256-L271 PolarHBondContact O-N 3.08Å; L256-F343 HydrophobicContact CD1-CE1 3.84Å; L256-F343 HydrophobicContact CD1-CZ 4.25Å
257	A	98.4	Very high	95.2	Very high	23 Å²	23	52 Å²	52	19%	0.19	29%	0.291	C	S	.	.	H	α-helix	trans	-69.5	-30.4	173.5	0	0	0	0	0	112.4	A253 E254 L255 T269 L271 K346	A253-A257 VanDerWaalsContact O-CB 3.25Å; A253-A257 WeakPolarHBondContact O-CB 3.41Å; A253-A257 PolarHBondContact O-N 3.01Å; E254-A257 WeakPolarHBondContact O-CB 3.31Å; E254-A257 PolarHBondContact O-N 3.02Å; E254-A257 VanDerWaalsContact O-N 3.17Å; L255-A257 PolarHBondContact O-N 2.68Å; A257-T269 WeakPolarHBondContact O-CB 3.31Å; A257-T269 WeakPolarHBondContact O-CG2 3.34Å; A257-L271 HydrophobicContact CB-CD2 4.03Å; A257-K346 HydrophobicContact CB-CD 4.23Å
258	N	98.1	Very high	94.9	Very high	111 Å²	111	52 Å²	52	59%	0.594	29%	0.292	S	S	*	.	H	α-helix	trans	-99.7	-18.3	-177.8	-67.4	-72.5	0	0	0	113.7	E254 L255 L256 P260	E254-N258 PolarHBondContact O-N 2.88Å; E254-N258 VanDerWaalsContact O-N 3.11Å; E254-N258 PolarHBondContact O-ND2 3.36Å; E254-N258 PolarHBondContact OE1-ND2 3.41Å; L255-N258 CarbonylContact O-C 3.59Å; L255-N258 PolarHBondContact O-N 3.32Å; L256-N258 VanDerWaalsContact C-N 3.32Å; N258-P260 WeakPolarHBondContact O-CD 3.48Å
259	T	97.8	Very high	94.8	Very high	56 Å²	56	53.4 Å²	53.4	34%	0.344	30%	0.301	S	S	.	.	S	Bend	trans	-73.3	120.1	174.5	-58.1	0	0	0	0	111.4	L255 T269 A270	L255-T259 PolarHBondContact O-N 3.16Å; L255-T259 PolarHBondContact O-OG1 3.5Å; T259-T269 CarbonylContact O-C 3.23Å; T259-T269 VanDerWaalsContact O-CA 3.24Å; T259-T269 WeakPolarHBondContact O-CA 3.45Å; T259-T269 WeakPolarHBondContact O-CB 3.22Å; T259-A270 HydrophobicContact CG2-CB 4.16Å; T259-A270 PolarHBondContact O-N 3.37Å
260	P	96.8	Very high	94.7	Very high	100 Å²	100	53.6 Å²	53.6	65%	0.649	30%	0.302	S	S	*	.	B	Isolated β-bridge	trans	-68.1	137.9	174	-18.5	32.8	0	0	0	111.9	N258 P262	N258-P260 WeakPolarHBondContact O-CD 3.48Å; P260-P262 WeakPolarHBondContact O-CD 3.35Å
261	H	95.1	Very high	94.6	Very high	20 Å²	20	50.4 Å²	50.4	9%	0.093	29%	0.291	C	S	.	.			trans	-122.8	74	175.1	-163.9	57.2	0	0	0	110.5	P162 A164 R167 A263 A264 A268 A270	P162-H261 PolarHBondContact O-CE1 2.67Å; A164-H261 PolarHBondContact O-NE2 2.99Å; R167-H261 PolarHBondContact NH2-CE1 3.18Å; R167-H261 PolarHBondContact NH2-ND1 2.67Å; R167-H261 PolarHBondContact NH2-NE2 2.9Å; H261-A263 PolarHBondContact O-N 2.98Å; H261-A264 WeakPolarHBondContact O-CB 3.16Å; H261-A264 PolarHBondContact O-N 3Å; H261-A268 PolarHBondContact N-O 3.4Å; H261-A270 HydrophobicContact CB-CB 4.35Å
262	P	90.4	Very high	94.5	Very high	99 Å²	99	52.3 Å²	52.3	64%	0.643	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.6	-171	26.6	-35.8	0	0	0	114	P260 A264	P260-P262 WeakPolarHBondContact O-CD 3.35Å; P262-A264 VanDerWaalsContact C-N 3.28Å; P262-A264 PolarHBondContact O-N 3.48Å
263	A	87.9	Confident	94.4	Very high	46 Å²	46	52.1 Å²	52.1	38%	0.38	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-37.7	170	0	0	0	0	0	112	A163 P165 H261	A163-A263 WeakPolarHBondContact O-CB 3.35Å; P165-A263 WeakPolarHBondContact CB-O 3.48Å; H261-A263 PolarHBondContact O-N 2.98Å
264	A	82.8	Confident	94.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-53.9	175.7	0	0	0	0	0	112.2	V67 L69 P165 H261 P262 A268	V67-A264 VanDerWaalsContact CB-O 3.29Å; V67-A264 WeakPolarHBondContact CB-O 3.47Å; L69-A264 HydrophobicContact CD1-CB 3.89Å; L69-A264 HydrophobicContact CD2-CB 3.76Å; L69-A264 HydrophobicContact CG-CB 4.41Å; P165-A264 HydrophobicContact CB-CB 4.49Å; P165-A264 WeakPolarHBondContact O-CB 3.37Å; H261-A264 WeakPolarHBondContact O-CB 3.16Å; H261-A264 PolarHBondContact O-N 3Å; P262-A264 VanDerWaalsContact C-N 3.28Å; P262-A264 PolarHBondContact O-N 3.48Å; A264-A268 HydrophobicContact CB-CB 3.66Å
265	S	87	Confident	94.3	Very high	35 Å²	35	48 Å²	48	25%	0.245	28%	0.28	C	S	.	.			trans	-169.9	153.2	179.8	176.5	0	0	0	0	108.7	H267 A268	S265-H267 PolarHBondContact O-N 2.7Å; S265-A268 PolarHBondContact O-N 3.13Å
266	P	87.3	Confident	94.3	Very high	107 Å²	107	44.7 Å²	44.7	70%	0.695	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.9	-176	-29	36.8	0	0	0	116.7
267	H	88.9	Confident	94.3	Very high	174 Å²	174	44.1 Å²	44.1	81%	0.806	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.4	11.3	176.9	-54.3	-46.4	0	0	0	113.1	S265	S265-H267 PolarHBondContact O-N 2.7Å
268	A	92.8	Very high	94.3	Very high	4 Å²	4	43 Å²	43	3%	0.033	25%	0.25	C	S	.	.			trans	-79.8	152	178.2	0	0	0	0	0	112.1	L69 H261 A264 S265 Q272	L69-A268 HydrophobicContact CD1-CB 3.84Å; H261-A268 PolarHBondContact N-O 3.4Å; A264-A268 HydrophobicContact CB-CB 3.66Å; S265-A268 PolarHBondContact O-N 3.13Å; A268-Q272 VanDerWaalsContact CA-OE1 3.3Å
269	T	96.7	Very high	94.4	Very high	29 Å²	29	37.7 Å²	37.7	18%	0.178	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-107.5	161.3	176.5	71.3	0	0	0	0	110.9	A257 T259 L271 Q272 A273	A257-T269 WeakPolarHBondContact O-CB 3.31Å; A257-T269 WeakPolarHBondContact O-CG2 3.34Å; T259-T269 CarbonylContact O-C 3.23Å; T259-T269 VanDerWaalsContact O-CA 3.24Å; T259-T269 WeakPolarHBondContact O-CA 3.45Å; T259-T269 WeakPolarHBondContact O-CB 3.22Å; T269-L271 PolarHBondContact O-N 3.25Å; T269-Q272 PolarHBondContact O-N 2.92Å; T269-Q272 WeakPolarHBondContact OG1-CG 3.45Å; T269-A273 PolarHBondContact O-N 3.37Å
270	A	97.1	Very high	94.4	Very high	4 Å²	4	35 Å²	35	3%	0.033	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.1	-178.5	0	0	0	0	0	112.5	L256 T259 H261 A273	L256-A270 HydrophobicContact CB-CB 4.31Å; L256-A270 HydrophobicContact CD2-CB 3.6Å; L256-A270 PolarHBondContact O-N 3.48Å; T259-A270 HydrophobicContact CG2-CB 4.16Å; T259-A270 PolarHBondContact O-N 3.37Å; H261-A270 HydrophobicContact CB-CB 4.35Å; A270-A273 WeakPolarHBondContact O-CB 3.36Å
271	L	97.6	Very high	94.5	Very high	9 Å²	9	30.8 Å²	30.8	5%	0.047	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-40.6	171.8	-169.4	72.1	0	0	0	112.7	L256 A257 T269 A273 V274 F343 K346 V348	L256-L271 HydrophobicContact CB-CB 3.93Å; L256-L271 HydrophobicContact CB-CD1 4.22Å; L256-L271 WeakPolarHBondContact O-CB 3.37Å; L256-L271 PolarHBondContact O-N 3.08Å; A257-L271 HydrophobicContact CB-CD2 4.03Å; T269-L271 PolarHBondContact O-N 3.25Å; L271-A273 PolarHBondContact O-N 3.48Å; L271-V274 WeakPolarHBondContact O-CB 3.29Å; L271-V274 WeakPolarHBondContact O-CG2 3.43Å; L271-V274 PolarHBondContact O-N 3.47Å; L271-F343 HydrophobicContact CD1-CD1 3.44Å; L271-F343 VanDerWaalsContact CD1-CD1 3.44Å; L271-F343 HydrophobicContact CD1-CE1 3.79Å; L271-F343 HydrophobicContact CD1-CG 4.35Å; L271-K346 HydrophobicContact CD2-CB 3.53Å; L271-K346 HydrophobicContact CD2-CD 3.49Å; L271-K346 VanDerWaalsContact CD2-CD 3.49Å; L271-K346 HydrophobicContact CD2-CG 4.13Å; L271-V348 HydrophobicContact CD1-CG2 3.67Å; L271-V348 HydrophobicContact CD2-CG2 4.41Å; L271-V348 HydrophobicContact CG-CG2 3.81Å
272	Q	96.1	Very high	94.7	Very high	103 Å²	103	30 Å²	30	48%	0.481	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.2	178.2	-70.4	173.6	-14.8	0	0	113	L69 A268 T269 V274	L69-Q272 HydrophobicContact CD1-CB 4.49Å; A268-Q272 VanDerWaalsContact CA-OE1 3.3Å; T269-Q272 PolarHBondContact O-N 2.92Å; T269-Q272 WeakPolarHBondContact OG1-CG 3.45Å; Q272-V274 PolarHBondContact O-N 3.14Å
273	A	96.1	Very high	95.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.3	170.7	0	0	0	0	0	113.6	P165 R166 R167 T269 A270 L271 D275	P165-A273 WeakPolarHBondContact O-CB 3.36Å; R166-A273 CarbonylContact C-O 3.55Å; R166-A273 WeakPolarHBondContact CA-O 3.37Å; R167-A273 PolarHBondContact N-O 2.89Å; T269-A273 PolarHBondContact O-N 3.37Å; A270-A273 WeakPolarHBondContact O-CB 3.36Å; L271-A273 PolarHBondContact O-N 3.48Å; A273-D275 PolarHBondContact O-N 2.87Å
274	V	97.9	Very high	95.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	114.3	-179.5	-174.9	0	0	0	0	110.6	R73 R167 L169 L271 Q272 F277 V348	R73-V274 PolarHBondContact NH1-O 2.76Å; R167-V274 HydrophobicContact CG-CG2 4.07Å; L169-V274 HydrophobicContact CB-CG1 3.83Å; L169-V274 HydrophobicContact CD1-CG2 4.12Å; L271-V274 WeakPolarHBondContact O-CB 3.29Å; L271-V274 WeakPolarHBondContact O-CG2 3.43Å; L271-V274 PolarHBondContact O-N 3.47Å; Q272-V274 PolarHBondContact O-N 3.14Å; V274-F277 HydrophobicContact CG1-CB 4.47Å; V274-V348 HydrophobicContact CB-CG1 4.05Å; V274-V348 HydrophobicContact CG1-CG1 3.59Å
275	D	97.9	Very high	96.3	Very high	5 Å²	5	23.4 Å²	23.4	3%	0.027	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-38.8	177.7	-80.7	-31.3	0	0	0	112.8	R73 R166 R167 A273 Y391	R73-D275 WeakPolarHBondContact CB-OD1 3.46Å; R73-D275 VanDerWaalsContact CD-CA 3.47Å; R73-D275 VanDerWaalsContact CD-O 3.25Å; R73-D275 WeakPolarHBondContact CD-O 3.01Å; R73-D275 HydrophobicContact CG-CB 4.1Å; R73-D275 WeakPolarHBondContact CG-O 3.28Å; R166-D275 WeakPolarHBondContact CB-OD2 3.24Å; R166-D275 IonicContact CZ-OD1 2.67Å; R166-D275 IonicContact CZ-OD2 3.15Å; R166-D275 VanDerWaalsContact CZ-OD2 3.23Å; R166-D275 VanDerWaalsContact NE-CG 3.3Å; R166-D275 IonicContact NE-OD1 3.59Å; R166-D275 PolarHBondContact NE-OD1 3.22Å; R166-D275 IonicContact NE-OD2 2.93Å; R166-D275 PolarHBondContact NE-OD2 3.32Å; R166-D275 VanDerWaalsContact NH2-CG 3.31Å; R166-D275 IonicContact NH2-OD1 2.78Å; R166-D275 PolarHBondContact NH2-OD1 2.89Å; R166-D275 IonicContact NH2-OD2 2.72Å; R166-D275 PolarHBondContact NH2-OD2 3.07Å; R167-D275 PolarHBondContact O-N 2.93Å; A273-D275 PolarHBondContact O-N 2.87Å; D275-Y391 WeakPolarHBondContact CB-OH 3.4Å
276	L	98.8	Very high	96.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	130.2	-175.8	-177.7	67.3	0	0	0	107	L168 L169 V278 T297 W300 P349 L351 F387 Y391	L168-L276 HydrophobicContact CD1-CB 3.87Å; L168-L276 HydrophobicContact CD1-CD2 3.99Å; L168-L276 HydrophobicContact CD1-CG 4.2Å; L169-L276 PolarHBondContact N-O 3.02Å; L276-V278 HydrophobicContact CD2-CG2 3.63Å; L276-V278 HydrophobicContact CG-CG2 3.84Å; L276-T297 HydrophobicContact CD1-CG2 3.47Å; L276-T297 VanDerWaalsContact CD1-CG2 3.47Å; L276-W300 HydrophobicContact CD2-CB 4.19Å; L276-W300 HydrophobicContact CD2-CD2 4.41Å; L276-W300 HydrophobicContact CD2-CG 3.87Å; L276-P349 HydrophobicContact CD1-CB 4.37Å; L276-L351 HydrophobicContact CD1-CB 4.02Å; L276-L351 HydrophobicContact CD2-CB 4.49Å; L276-L351 HydrophobicContact CD2-CD2 4.29Å; L276-L351 HydrophobicContact CG-CB 4.46Å; L276-F387 HydrophobicContact CD2-CZ 4.07Å; L276-Y391 HydrophobicContact CB-CE2 4.3Å; L276-Y391 HydrophobicContact CD2-CD2 4.37Å; L276-Y391 HydrophobicContact CD2-CE2 3.69Å
277	F	98.9	Very high	97.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	114.3	164.5	-176.7	169.2	0	0	0	106.8	L169 A171 F231 V274 L279 H340 F343 V348 P349 V350 L351	L169-F277 HydrophobicContact CD2-CD1 4.37Å; L169-F277 HydrophobicContact CD2-CD2 3.48Å; L169-F277 VanDerWaalsContact CD2-CD2 3.48Å; L169-F277 HydrophobicContact CD2-CE2 3.72Å; L169-F277 HydrophobicContact CD2-CG 3.87Å; L169-F277 HydrophobicContact CD2-CZ 4.26Å; L169-F277 CarbonylContact O-C 3.45Å; L169-F277 WeakPolarHBondContact O-CA 3.43Å; A171-F277 HydrophobicContact CB-CE2 3.83Å; A171-F277 HydrophobicContact CB-CZ 4.41Å; F231-F277 HydrophobicContact CE2-CE2 4.37Å; F231-F277 AromaticContact CE2-CZ 3.72Å; F231-F277 HydrophobicContact CE2-CZ 3.72Å; F231-F277 HydrophobicContact CZ-CE1 4.35Å; F231-F277 AromaticContact CZ-CZ 3.9Å; F231-F277 HydrophobicContact CZ-CZ 3.9Å; V274-F277 HydrophobicContact CG1-CB 4.47Å; F277-L279 HydrophobicContact CD2-CB 4.11Å; F277-L279 HydrophobicContact CE2-CB 3.6Å; F277-L279 HydrophobicContact CE2-CD1 4Å; F277-L279 HydrophobicContact CE2-CD2 3.8Å; F277-L279 HydrophobicContact CE2-CG 4.02Å; F277-L279 HydrophobicContact CZ-CB 4.33Å; F277-L279 HydrophobicContact CZ-CD1 4.34Å; F277-L279 HydrophobicContact CZ-CD2 3.68Å; F277-L279 HydrophobicContact CZ-CG 4.37Å; F277-H340 HydrophobicContact CD1-CB 4.48Å; F277-H340 HydrophobicContact CE1-CB 4.19Å; F277-H340 HydrophobicContact CZ-CB 4.44Å; F277-F343 HydrophobicContact CD1-CB 3.65Å; F277-F343 AromaticContact CD1-CD1 3.88Å; F277-F343 HydrophobicContact CD1-CD1 3.88Å; F277-F343 HydrophobicContact CD1-CD2 4.07Å; F277-F343 AromaticContact CD1-CG 3.62Å; F277-F343 HydrophobicContact CD1-CG 3.62Å; F277-F343 HydrophobicContact CE1-CB 3.89Å; F277-F343 HydrophobicContact CE1-CD1 4.03Å; F277-F343 AromaticContact CE1-CD2 3.48Å; F277-F343 HydrophobicContact CE1-CD2 3.48Å; F277-F343 VanDerWaalsContact CE1-CD2 3.48Å; F277-F343 HydrophobicContact CE1-CE1 4.43Å; F277-F343 AromaticContact CE1-CE2 3.93Å; F277-F343 HydrophobicContact CE1-CE2 3.93Å; F277-F343 AromaticContact CE1-CG 3.54Å; F277-F343 HydrophobicContact CE1-CG 3.54Å; F277-F343 HydrophobicContact CE1-CZ 4.4Å; F277-V348 HydrophobicContact CB-CG1 3.84Å; F277-P349 PolarHBondContact N-O 3.25Å; F277-V350 HydrophobicContact CB-CG2 4.49Å; F277-V350 CarbonylContact O-C 3.46Å; F277-V350 WeakPolarHBondContact O-CA 3.45Å; F277-L351 PolarHBondContact O-N 2.59Å
278	V	98.9	Very high	97.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.9	168.1	-171.6	0	0	0	0	108.2	L168 L169 L170 A171 L276 L280 L351 I353 M384 F387	L168-V278 HydrophobicContact CD1-CG2 3.86Å; L169-V278 PolarHBondContact O-N 3.16Å; L170-V278 CarbonylContact C-O 3.52Å; L170-V278 WeakPolarHBondContact CA-O 3.4Å; L170-V278 HydrophobicContact CD1-CB 3.87Å; L170-V278 HydrophobicContact CD1-CG1 3.88Å; A171-V278 PolarHBondContact N-O 3.29Å; L276-V278 HydrophobicContact CD2-CG2 3.63Å; L276-V278 HydrophobicContact CG-CG2 3.84Å; V278-L280 HydrophobicContact CG1-CD1 3.9Å; V278-L351 WeakPolarHBondContact CA-O 3.39Å; V278-L351 HydrophobicContact CG1-CD2 4.37Å; V278-L351 HydrophobicContact CG2-CB 4.3Å; V278-L351 HydrophobicContact CG2-CD2 4.15Å; V278-I353 HydrophobicContact CG1-CD1 3.43Å; V278-I353 VanDerWaalsContact CG1-CD1 3.43Å; V278-I353 HydrophobicContact CG1-CG1 4.04Å; V278-M384 HydrophobicContact CG1-CE 4.09Å; V278-F387 HydrophobicContact CG2-CE1 4.06Å; V278-F387 HydrophobicContact CG2-CZ 4.3Å
279	L	98.9	Very high	97.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.7	-177.7	-172.7	39	0	0	0	109.2	A171 F277 D338 D339 H340 L351 I353	A171-L279 HydrophobicContact CB-CD1 4.39Å; A171-L279 WeakPolarHBondContact O-CA 3.43Å; A171-L279 VanDerWaalsContact O-CD1 3.3Å; A171-L279 WeakPolarHBondContact O-CD1 3.34Å; F277-L279 HydrophobicContact CD2-CB 4.11Å; F277-L279 HydrophobicContact CE2-CB 3.6Å; F277-L279 HydrophobicContact CE2-CD1 4Å; F277-L279 HydrophobicContact CE2-CD2 3.8Å; F277-L279 HydrophobicContact CE2-CG 4.02Å; F277-L279 HydrophobicContact CZ-CB 4.33Å; F277-L279 HydrophobicContact CZ-CD1 4.34Å; F277-L279 HydrophobicContact CZ-CD2 3.68Å; F277-L279 HydrophobicContact CZ-CG 4.37Å; L279-D338 VanDerWaalsContact CD2-OD1 3.24Å; L279-D338 WeakPolarHBondContact CD2-OD1 3.3Å; L279-D338 WeakPolarHBondContact CD2-OD2 3.44Å; L279-D339 HydrophobicContact CD2-CB 3.95Å; L279-H340 HydrophobicContact CD2-CB 3.65Å; L279-L351 PolarHBondContact N-O 3.31Å; L279-L351 VanDerWaalsContact N-O 3.14Å; L279-I353 WeakPolarHBondContact O-CA 3.44Å; L279-I353 WeakPolarHBondContact O-CB 3.1Å; L279-I353 PolarHBondContact O-N 3.49Å
280	L	98.9	Very high	97.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.5	178	-80.2	61.2	0	0	0	108.5	L170 A171 C172 P199 M202 I203 V278 L283 I353 M384	L170-L280 HydrophobicContact CD1-CD1 3.54Å; A171-L280 PolarHBondContact O-N 2.93Å; C172-L280 VanDerWaalsContact CB-O 3.24Å; C172-L280 WeakPolarHBondContact CB-O 3.49Å; P199-L280 HydrophobicContact CB-CB 3.95Å; P199-L280 WeakPolarHBondContact CB-O 3.36Å; M202-L280 HydrophobicContact CB-CD2 4.48Å; M202-L280 HydrophobicContact CE-CD2 3.88Å; I203-L280 HydrophobicContact CG1-CD2 4.39Å; V278-L280 HydrophobicContact CG1-CD1 3.9Å; L280-L283 HydrophobicContact CB-CD1 3.94Å; L280-L283 HydrophobicContact CD2-CD1 4.13Å; L280-L283 HydrophobicContact CG-CD1 3.88Å; L280-I353 HydrophobicContact CD1-CB 4.33Å; L280-I353 HydrophobicContact CD1-CD1 4.07Å; L280-I353 HydrophobicContact CG-CB 4.39Å; L280-M384 HydrophobicContact CD1-CE 4.24Å
281	D	98.8	Very high	97.8	Very high	10 Å²	10	17.1 Å²	17.1	5%	0.053	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	152.9	-177.4	-179.2	34.3	0	0	0	111.4	H173 S196 L283 I353 I354	H173-D281 IonicContact NE2-OD1 3.89Å; S196-D281 PolarHBondContact OG-OD1 3.04Å; S196-D281 VanDerWaalsContact OG-OD1 3.08Å; D281-L283 WeakPolarHBondContact O-CD2 3.22Å; D281-L283 WeakPolarHBondContact O-CG 3.31Å; D281-L283 PolarHBondContact O-N 3.47Å; D281-L283 VanDerWaalsContact O-N 3.12Å; D281-I353 PolarHBondContact N-O 3.09Å; D281-I353 VanDerWaalsContact N-O 3.13Å; D281-I354 HydrophobicContact CB-CB 4.41Å; D281-I354 HydrophobicContact CB-CD1 4.38Å; D281-I354 HydrophobicContact CB-CG1 4.24Å; D281-I354 WeakPolarHBondContact O-CA 3.38Å; D281-I354 WeakPolarHBondContact OD2-CD1 3.45Å
282	L	98.7	Very high	97.7	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.016	10%	0.096	C	C	.	.	S	Bend	trans	47.1	38.4	-179.1	-52.6	-170.3	0	0	0	114.8	S194 D195 I354 A355 F358 P359 W362	S194-L282 CarbonylContact O-C 3.2Å; S194-L282 VanDerWaalsContact O-CA 3.28Å; S194-L282 WeakPolarHBondContact O-CA 3.37Å; S194-L282 PolarHBondContact O-N 3.21Å; D195-L282 HydrophobicContact CB-CD2 3.77Å; L282-I354 HydrophobicContact CB-CG1 4.14Å; L282-I354 HydrophobicContact CD1-CD1 4.14Å; L282-I354 HydrophobicContact CD1-CG1 4.32Å; L282-I354 HydrophobicContact CG-CD1 4.28Å; L282-I354 HydrophobicContact CG-CG1 4.22Å; L282-A355 VanDerWaalsContact O-CB 3.3Å; L282-A355 WeakPolarHBondContact O-CB 3.49Å; L282-F358 HydrophobicContact CD1-CB 3.83Å; L282-F358 HydrophobicContact CD1-CD1 3.51Å; L282-F358 HydrophobicContact CD1-CD2 3.78Å; L282-F358 HydrophobicContact CD1-CE1 3.88Å; L282-F358 HydrophobicContact CD1-CE2 4.12Å; L282-F358 HydrophobicContact CD1-CG 3.44Å; L282-F358 VanDerWaalsContact CD1-CG 3.44Å; L282-F358 HydrophobicContact CD1-CZ 4.16Å; L282-P359 HydrophobicContact CB-CG 4.13Å; L282-W362 HydrophobicContact CD1-CG 4.25Å; L282-W362 VanDerWaalsContact CD2-CD1 3.45Å
283	L	98.8	Very high	97.7	Very high	1 Å²	1	14 Å²	14	1%	0.005	8%	0.08	C	C	.	.			trans	-97.4	129.9	-179.6	-55.3	-175.6	0	0	0	110.3	S194 V198 P199 M202 L280 D281 I290 I353 L380	S194-L283 WeakPolarHBondContact CA-O 3.38Å; S194-L283 PolarHBondContact O-N 3.37Å; V198-L283 WeakPolarHBondContact CB-O 3.24Å; V198-L283 HydrophobicContact CG1-CB 4.42Å; V198-L283 WeakPolarHBondContact CG1-O 3.22Å; P199-L283 HydrophobicContact CG-CB 4.11Å; P199-L283 HydrophobicContact CG-CG 4.33Å; M202-L283 HydrophobicContact CE-CD1 3.92Å; M202-L283 HydrophobicContact SD-CB 4.27Å; M202-L283 HydrophobicContact SD-CD1 3.93Å; L280-L283 HydrophobicContact CB-CD1 3.94Å; L280-L283 HydrophobicContact CD2-CD1 4.13Å; L280-L283 HydrophobicContact CG-CD1 3.88Å; D281-L283 WeakPolarHBondContact O-CD2 3.22Å; D281-L283 WeakPolarHBondContact O-CG 3.31Å; D281-L283 PolarHBondContact O-N 3.47Å; D281-L283 VanDerWaalsContact O-N 3.12Å; L283-I290 HydrophobicContact CD2-CD1 4.14Å; L283-I353 HydrophobicContact CD1-CG2 4.23Å; L283-I353 HydrophobicContact CD2-CG2 4.47Å; L283-L380 HydrophobicContact CB-CD1 4.39Å; L283-L380 HydrophobicContact CD1-CD1 4.37Å; L283-L380 HydrophobicContact CD2-CD1 4.25Å
284	G	97.8	Very high	97.7	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.088	C	C	.	.			trans	157.7	-31.5	174.5	0	0	0	0	0	114.8	H373	G284-H373 PolarHBondContact O-N 2.85Å
285	G	97.8	Very high	97.5	Very high	7 Å²	7	22.9 Å²	22.9	7%	0.072	13%	0.126	C	C	.	.	S	Bend	trans	-64.8	167.2	176.5	0	0	0	0	0	114.5	T376	G285-T376 WeakPolarHBondContact O-CB 3.47Å; G285-T376 WeakPolarHBondContact O-CG2 3.3Å; G285-T376 PolarHBondContact O-OG1 2.72Å
286	P	97.2	Very high	97.4	Very high	77 Å²	77	27.7 Å²	27.7	50%	0.5	15%	0.151	S	C	.	.	S	Bend	trans	-67.1	146.5	170.2	30	-34.4	0	0	0	111.2	P288 H373	P286-P288 VanDerWaalsContact C-CD 3.47Å; P286-H373 HydrophobicContact CB-CB 4.03Å
287	D	95.1	Very high	97.3	Very high	87 Å²	87	27.8 Å²	27.8	47%	0.465	15%	0.152	S	C	.	.	S	Bend	trans	41.5	51.6	171.2	-57.7	-33	0	0	0	117.1	L289 T325	D287-L289 PolarHBondContact O-N 3.04Å; D287-T325 HydrophobicContact CB-CG2 4.47Å
288	P	97.4	Very high	97.2	Very high	11 Å²	11	28.1 Å²	28.1	7%	0.071	16%	0.155	C	C	.	.			trans	-65.9	129.8	-178.6	28.2	-35.9	0	0	0	111.6	P286 Y326 A355 T376 L380	P286-P288 VanDerWaalsContact C-CD 3.47Å; P288-Y326 HydrophobicContact CG-CD1 4.02Å; P288-Y326 HydrophobicContact CG-CE1 4.46Å; P288-Y326 VanDerWaalsContact O-CA 3.29Å; P288-Y326 WeakPolarHBondContact O-CA 3.42Å; P288-A355 HydrophobicContact CB-CB 3.74Å; P288-T376 HydrophobicContact CG-CG2 3.71Å; P288-L380 HydrophobicContact CG-CD1 4.28Å
289	L	97.1	Very high	97.1	Very high	46 Å²	46	32 Å²	32	24%	0.241	17%	0.169	C	C	.	.			trans	-80.2	116.8	168.2	175	57.8	0	0	0	108.8	D287 R328 V331 A355 T356	D287-L289 PolarHBondContact O-N 3.04Å; L289-R328 HydrophobicContact CD1-CB 3.57Å; L289-R328 HydrophobicContact CD1-CG 3.39Å; L289-V331 HydrophobicContact CD1-CG2 4.45Å; L289-A355 CarbonylContact O-C 3.56Å; L289-A355 WeakPolarHBondContact O-CA 3.16Å; L289-T356 WeakPolarHBondContact CB-O 3.16Å; L289-T356 WeakPolarHBondContact CD2-O 3.39Å; L289-T356 VanDerWaalsContact CG-O 3.27Å; L289-T356 WeakPolarHBondContact CG-O 3.45Å; L289-T356 PolarHBondContact O-N 3.28Å
290	I	98	Very high	97.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.1	177.4	-57.6	170.9	0	0	0	107.8	L283 F301 Y326 F327 R328 I353 L380	L283-I290 HydrophobicContact CD2-CD1 4.14Å; I290-F301 HydrophobicContact CG2-CE2 4.28Å; I290-F301 WeakPolarHBondContact O-CZ 3.37Å; I290-Y326 PolarHBondContact N-O 2.9Å; I290-F327 HydrophobicContact CB-CD1 4.04Å; I290-F327 HydrophobicContact CB-CE1 4.15Å; I290-F327 HydrophobicContact CD1-CD1 4.39Å; I290-F327 HydrophobicContact CD1-CE1 3.77Å; I290-F327 HydrophobicContact CD1-CE2 4.48Å; I290-F327 HydrophobicContact CD1-CZ 3.82Å; I290-F327 HydrophobicContact CG2-CD1 3.9Å; I290-F327 HydrophobicContact CG2-CE1 3.83Å; I290-R328 PolarHBondContact O-N 2.83Å; I290-I353 HydrophobicContact CD1-CG2 4.01Å; I290-I353 HydrophobicContact CG2-CG2 4.22Å; I290-L380 HydrophobicContact CD1-CD2 4.1Å
291	A	96.8	Very high	97.1	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	157.6	-172.8	0	0	0	0	0	113.4	H293 F301 R328 L333	A291-H293 PolarHBondContact O-CD2 3.24Å; A291-H293 VanDerWaalsContact O-CD2 3.23Å; A291-H293 PolarHBondContact O-N 3.16Å; A291-F301 VanDerWaalsContact C-CE2 3.46Å; A291-F301 WeakPolarHBondContact O-CE2 3.49Å; A291-R328 WeakPolarHBondContact CA-O 3.47Å; A291-L333 HydrophobicContact CB-CD1 3.89Å; A291-L333 HydrophobicContact CB-CG 4.28Å
292	N	96.2	Very high	97.1	Very high	14 Å²	14	35.2 Å²	35.2	8%	0.075	19%	0.186	C	C	.	.			trans	-86.1	94.3	173.8	-176.8	87.9	0	0	0	111.4	F294 A298 F301 R328 K329	N292-F294 PolarHBondContact ND2-O 2.92Å; N292-F294 VanDerWaalsContact ND2-O 3.1Å; N292-F294 PolarHBondContact O-N 3.33Å; N292-A298 VanDerWaalsContact OD1-CA 3.32Å; N292-A298 WeakPolarHBondContact OD1-CA 3.34Å; N292-A298 WeakPolarHBondContact OD1-CB 3.44Å; N292-F301 HydrophobicContact CB-CD1 3.93Å; N292-F301 HydrophobicContact CB-CD2 3.96Å; N292-F301 HydrophobicContact CB-CE1 4.05Å; N292-F301 HydrophobicContact CB-CE2 4.1Å; N292-F301 HydrophobicContact CB-CG 3.88Å; N292-F301 HydrophobicContact CB-CZ 4.13Å; N292-F301 WeakPolarHBondContact OD1-CB 3.44Å; N292-F301 VanDerWaalsContact OD1-CG 3.29Å; N292-F301 WeakPolarHBondContact OD1-CG 3.37Å; N292-R328 PolarHBondContact N-O 2.9Å; N292-K329 HydrophobicContact CB-CB 4.42Å; N292-K329 HydrophobicContact CB-CG 4.11Å
293	H	95.5	Very high	97.1	Very high	31 Å²	31	38 Å²	38	14%	0.144	20%	0.196	C	C	.	.			trans	-73	-19.8	-177.8	-63.8	-85.7	0	0	0	115.2	A291	A291-H293 PolarHBondContact O-CD2 3.24Å; A291-H293 VanDerWaalsContact O-CD2 3.23Å; A291-H293 PolarHBondContact O-N 3.16Å
294	F	95.2	Very high	97.1	Very high	41 Å²	41	38 Å²	38	18%	0.18	20%	0.196	C	C	.	.			trans	-137.4	126.7	-172.2	-57.5	-72.3	0	0	0	113.5	N292 T297 A298 H340 L344 V350 H352	N292-F294 PolarHBondContact ND2-O 2.92Å; N292-F294 VanDerWaalsContact ND2-O 3.1Å; N292-F294 PolarHBondContact O-N 3.33Å; F294-T297 PolarHBondContact O-OG1 2.7Å; F294-A298 PolarHBondContact O-N 3.48Å; F294-H340 AromaticContact CZ-CD2 3.8Å; F294-H340 AromaticContact CZ-NE2 3.62Å; F294-L344 HydrophobicContact CD1-CD1 4.47Å; F294-L344 HydrophobicContact CE1-CD1 4.07Å; F294-L344 HydrophobicContact CE1-CD2 3.69Å; F294-L344 HydrophobicContact CZ-CD1 4.46Å; F294-L344 HydrophobicContact CZ-CD2 3.88Å; F294-V350 HydrophobicContact CD2-CB 3.97Å; F294-V350 HydrophobicContact CD2-CG1 4.01Å; F294-V350 VanDerWaalsContact CD2-O 3.29Å; F294-V350 WeakPolarHBondContact CD2-O 3.38Å; F294-V350 HydrophobicContact CE2-CB 3.79Å; F294-V350 HydrophobicContact CE2-CG1 3.54Å; F294-V350 HydrophobicContact CZ-CB 4.39Å; F294-V350 HydrophobicContact CZ-CG1 4.33Å; F294-H352 HydrophobicContact CE2-CB 4.13Å
295	D	94.6	Very high	97.1	Very high	147 Å²	147	38.8 Å²	38.8	79%	0.786	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-34.5	180	-76.2	-36.3	0	0	0	113.4	T297 A298	D295-T297 PolarHBondContact O-N 2.86Å; D295-A298 WeakPolarHBondContact O-CB 3.35Å; D295-A298 PolarHBondContact O-N 2.83Å
296	N	95.5	Very high	97.2	Very high	105 Å²	105	39.9 Å²	39.9	56%	0.561	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.9	-177.3	64.4	-3.6	0	0	0	113.4
297	T	97.1	Very high	97.2	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.012	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	0.1	174.6	59.1	0	0	0	0	113.4	L276 F294 D295 R299 W300 F301 P349 V350	L276-T297 HydrophobicContact CD1-CG2 3.47Å; L276-T297 VanDerWaalsContact CD1-CG2 3.47Å; F294-T297 PolarHBondContact O-OG1 2.7Å; D295-T297 PolarHBondContact O-N 2.86Å; T297-R299 PolarHBondContact O-N 2.9Å; T297-W300 WeakPolarHBondContact O-CA 3.46Å; T297-W300 WeakPolarHBondContact O-CB 3.39Å; T297-W300 PolarHBondContact O-N 3.33Å; T297-F301 PolarHBondContact O-N 3.24Å; T297-P349 HydrophobicContact CG2-CB 3.55Å; T297-V350 WeakPolarHBondContact CB-O 3.39Å; T297-V350 WeakPolarHBondContact CG2-O 3.45Å; T297-V350 PolarHBondContact OG1-O 2.87Å
298	A	96.8	Very high	97.4	Very high	7 Å²	7	32.1 Å²	32.1	6%	0.058	16%	0.161	C	C	.	.	H	α-helix	trans	-57.4	-19.9	-176.1	0	0	0	0	0	115	N292 F294 D295 W300 F301 D302 K329	N292-A298 VanDerWaalsContact OD1-CA 3.32Å; N292-A298 WeakPolarHBondContact OD1-CA 3.34Å; N292-A298 WeakPolarHBondContact OD1-CB 3.44Å; F294-A298 PolarHBondContact O-N 3.48Å; D295-A298 WeakPolarHBondContact O-CB 3.35Å; D295-A298 PolarHBondContact O-N 2.83Å; A298-W300 VanDerWaalsContact C-N 3.28Å; A298-F301 PolarHBondContact O-N 3.19Å; A298-D302 VanDerWaalsContact O-CG 3.24Å; A298-D302 PolarHBondContact O-N 3.45Å; A298-D302 VanDerWaalsContact O-OD2 3.09Å; A298-K329 PolarHBondContact O-NZ 2.9Å
299	R	97.8	Very high	97.5	Very high	81 Å²	81	34.2 Å²	34.2	31%	0.306	17%	0.169	S	C	.	.	H	α-helix	trans	-68	-23	171.1	71.1	-178.5	-178.9	113.5	-11.2	114.2	R73 H76 T297	R73-R299 PolarHBondContact O-NH2 2.98Å; H76-R299 PolarHBondContact O-NH1 2.69Å; T297-R299 PolarHBondContact O-N 2.9Å
300	W	98.6	Very high	97.6	Very high	7 Å²	7	34.8 Å²	34.8	3%	0.027	17%	0.168	C	C	.	.	H	α-helix	trans	-89.9	-34.7	174.7	-63.4	122.6	0	0	0	110.8	H76 P78 L276 T297 A298 D302 R303 L304 L351 F387 Y391	H76-W300 AromaticContact CD2-CH2 3.68Å; H76-W300 AromaticContact CD2-CZ2 3.84Å; P78-W300 HydrophobicContact CB-CZ3 4.11Å; P78-W300 HydrophobicContact CG-CZ3 4.36Å; L276-W300 HydrophobicContact CD2-CB 4.19Å; L276-W300 HydrophobicContact CD2-CD2 4.41Å; L276-W300 HydrophobicContact CD2-CG 3.87Å; T297-W300 WeakPolarHBondContact O-CA 3.46Å; T297-W300 WeakPolarHBondContact O-CB 3.39Å; T297-W300 PolarHBondContact O-N 3.33Å; A298-W300 VanDerWaalsContact C-N 3.28Å; W300-D302 VanDerWaalsContact C-N 3.26Å; W300-D302 PolarHBondContact O-N 3.37Å; W300-R303 HydrophobicContact CE3-CG 3.98Å; W300-R303 HydrophobicContact CZ3-CG 4.48Å; W300-R303 WeakPolarHBondContact O-CA 3.21Å; W300-R303 VanDerWaalsContact O-CB 3.28Å; W300-R303 WeakPolarHBondContact O-CB 3.21Å; W300-R303 PolarHBondContact O-N 3.06Å; W300-L304 PolarHBondContact O-N 2.91Å; W300-L351 HydrophobicContact CB-CD2 3.89Å; W300-F387 HydrophobicContact CB-CE2 4.09Å; W300-F387 HydrophobicContact CB-CZ 4.3Å; W300-F387 HydrophobicContact CE3-CE2 4.39Å; W300-Y391 HydrophobicContact CD2-CD2 4.1Å; W300-Y391 AromaticContact CD2-CE2 3.87Å; W300-Y391 HydrophobicContact CD2-CE2 3.87Å; W300-Y391 AromaticContact CE2-CE2 3.57Å; W300-Y391 AromaticContact CE3-CD2 3.76Å; W300-Y391 HydrophobicContact CE3-CD2 3.76Å; W300-Y391 AromaticContact CE3-CE2 4Å; W300-Y391 HydrophobicContact CE3-CE2 4Å; W300-Y391 AromaticContact CH2-CD2 3.71Å; W300-Y391 HydrophobicContact CH2-CD2 3.71Å; W300-Y391 AromaticContact CH2-CE2 3.65Å; W300-Y391 HydrophobicContact CH2-CE2 3.65Å; W300-Y391 HydrophobicContact CZ2-CD2 4.03Å; W300-Y391 AromaticContact CZ2-CE2 3.48Å; W300-Y391 HydrophobicContact CZ2-CE2 3.48Å; W300-Y391 VanDerWaalsContact CZ2-CE2 3.48Å; W300-Y391 AromaticContact CZ3-CD2 3.56Å; W300-Y391 HydrophobicContact CZ3-CD2 3.56Å; W300-Y391 AromaticContact CZ3-CE2 3.9Å; W300-Y391 HydrophobicContact CZ3-CE2 3.9Å; W300-Y391 HydrophobicContact CZ3-CG 4.43Å
301	F	98.5	Very high	97.6	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-57.8	-39.3	167.1	-161.4	-85.6	0	0	0	112	I290 A291 N292 T297 A298 R303 L304 I305 F327 K329 L351	I290-F301 HydrophobicContact CG2-CE2 4.28Å; I290-F301 WeakPolarHBondContact O-CZ 3.37Å; A291-F301 VanDerWaalsContact C-CE2 3.46Å; A291-F301 WeakPolarHBondContact O-CE2 3.49Å; N292-F301 HydrophobicContact CB-CD1 3.93Å; N292-F301 HydrophobicContact CB-CD2 3.96Å; N292-F301 HydrophobicContact CB-CE1 4.05Å; N292-F301 HydrophobicContact CB-CE2 4.1Å; N292-F301 HydrophobicContact CB-CG 3.88Å; N292-F301 HydrophobicContact CB-CZ 4.13Å; N292-F301 WeakPolarHBondContact OD1-CB 3.44Å; N292-F301 VanDerWaalsContact OD1-CG 3.29Å; N292-F301 WeakPolarHBondContact OD1-CG 3.37Å; T297-F301 PolarHBondContact O-N 3.24Å; A298-F301 PolarHBondContact O-N 3.19Å; F301-R303 PolarHBondContact O-N 2.95Å; F301-R303 VanDerWaalsContact O-N 3.14Å; F301-L304 WeakPolarHBondContact O-CB 3.25Å; F301-L304 PolarHBondContact O-N 3.37Å; F301-I305 HydrophobicContact CD1-CD1 3.74Å; F301-I305 HydrophobicContact CD1-CG1 4.13Å; F301-I305 HydrophobicContact CE1-CD1 3.79Å; F301-I305 HydrophobicContact CE1-CG1 4.07Å; F301-I305 PolarHBondContact O-N 2.9Å; F301-I305 VanDerWaalsContact O-N 3.15Å; F301-F327 HydrophobicContact CE1-CB 4.06Å; F301-F327 HydrophobicContact CE2-CD1 4.09Å; F301-F327 HydrophobicContact CZ-CB 4.06Å; F301-F327 HydrophobicContact CZ-CD1 4.01Å; F301-K329 HydrophobicContact CD1-CB 4.07Å; F301-K329 HydrophobicContact CD1-CD 4.31Å; F301-K329 HydrophobicContact CE1-CB 3.98Å; F301-L351 HydrophobicContact CB-CD1 3.92Å; F301-L351 HydrophobicContact CD2-CD1 3.89Å; F301-L351 HydrophobicContact CG-CD1 4.43Å
302	D	98.4	Very high	97.7	Very high	71 Å²	71	37.3 Å²	37.3	38%	0.38	18%	0.18	S	C	.	.	H	α-helix	trans	-58.9	-23.3	171	-66.6	-36.6	0	0	0	113.6	A298 W300 S306 K329	A298-D302 VanDerWaalsContact O-CG 3.24Å; A298-D302 PolarHBondContact O-N 3.45Å; A298-D302 VanDerWaalsContact O-OD2 3.09Å; W300-D302 VanDerWaalsContact C-N 3.26Å; W300-D302 PolarHBondContact O-N 3.37Å; D302-S306 VanDerWaalsContact O-CB 3.24Å; D302-S306 WeakPolarHBondContact O-CB 3.26Å; D302-S306 PolarHBondContact O-N 3.11Å; D302-K329 VanDerWaalsContact OD1-CD 3.28Å; D302-K329 WeakPolarHBondContact OD1-CD 3.48Å; D302-K329 IonicContact OD1-NZ 3.16Å; D302-K329 PolarHBondContact OD1-NZ 2.94Å; D302-K329 IonicContact OD2-NZ 3.02Å; D302-K329 PolarHBondContact OD2-NZ 3.48Å
303	R	98.7	Very high	97.8	Very high	61 Å²	61	44 Å²	44	23%	0.23	20%	0.204	C	C	.	.	H	α-helix	trans	-78.7	-34.5	174.6	-55.2	-45.8	-60.3	171.4	3	112.2	P78 W300 F301 S306 A307 F387 E390	P78-R303 HydrophobicContact CB-CG 4.48Å; P78-R303 HydrophobicContact CG-CG 4.44Å; W300-R303 HydrophobicContact CE3-CG 3.98Å; W300-R303 HydrophobicContact CZ3-CG 4.48Å; W300-R303 WeakPolarHBondContact O-CA 3.21Å; W300-R303 VanDerWaalsContact O-CB 3.28Å; W300-R303 WeakPolarHBondContact O-CB 3.21Å; W300-R303 PolarHBondContact O-N 3.06Å; F301-R303 PolarHBondContact O-N 2.95Å; F301-R303 VanDerWaalsContact O-N 3.14Å; R303-S306 WeakPolarHBondContact O-CB 3.33Å; R303-S306 PolarHBondContact O-N 2.92Å; R303-A307 WeakPolarHBondContact O-CB 3.42Å; R303-A307 PolarHBondContact O-N 2.84Å; R303-F387 HydrophobicContact CB-CD2 3.99Å; R303-F387 HydrophobicContact CB-CE2 4.21Å; R303-E390 IonicContact CZ-OE1 3.03Å; R303-E390 IonicContact CZ-OE2 3.18Å; R303-E390 IonicContact NE-OE2 2.67Å; R303-E390 PolarHBondContact NE-OE2 2.99Å; R303-E390 IonicContact NH2-OE1 3.81Å; R303-E390 PolarHBondContact NH2-OE1 3.1Å; R303-E390 IonicContact NH2-OE2 3.5Å; R303-E390 PolarHBondContact NH2-OE2 3.25Å
304	L	98.8	Very high	97.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-50.3	173.1	-60.9	170.4	0	0	0	110.4	W300 F301 S306 A307 E308 F327 L351 I353 I383 M384 F387	W300-L304 PolarHBondContact O-N 2.91Å; F301-L304 WeakPolarHBondContact O-CB 3.25Å; F301-L304 PolarHBondContact O-N 3.37Å; L304-S306 VanDerWaalsContact C-N 3.26Å; L304-S306 PolarHBondContact O-N 2.83Å; L304-A307 PolarHBondContact O-N 3.25Å; L304-E308 WeakPolarHBondContact O-CB 3.18Å; L304-E308 PolarHBondContact O-N 3.37Å; L304-F327 HydrophobicContact CB-CD1 3.75Å; L304-F327 HydrophobicContact CB-CD2 4.16Å; L304-F327 HydrophobicContact CB-CE1 3.89Å; L304-F327 HydrophobicContact CB-CE2 4.31Å; L304-F327 HydrophobicContact CB-CG 3.9Å; L304-F327 HydrophobicContact CB-CZ 4.17Å; L304-F327 HydrophobicContact CD1-CD1 3.94Å; L304-F327 HydrophobicContact CD1-CE1 3.61Å; L304-F327 HydrophobicContact CD1-CZ 4.32Å; L304-F327 HydrophobicContact CD2-CZ 4.47Å; L304-F327 HydrophobicContact CG-CD1 4.45Å; L304-F327 HydrophobicContact CG-CE1 4.21Å; L304-L351 HydrophobicContact CD1-CD2 4.02Å; L304-L351 HydrophobicContact CD1-CG 4.45Å; L304-I353 HydrophobicContact CD1-CD1 3.69Å; L304-I353 HydrophobicContact CD1-CG1 4.15Å; L304-I353 HydrophobicContact CD2-CD1 4.38Å; L304-I383 HydrophobicContact CD2-CG2 4.13Å; L304-M384 HydrophobicContact CD2-SD 3.71Å; L304-F387 HydrophobicContact CD2-CB 3.91Å; L304-F387 HydrophobicContact CD2-CD2 3.58Å; L304-F387 HydrophobicContact CD2-CE2 4.29Å; L304-F387 HydrophobicContact CD2-CG 3.82Å; L304-F387 HydrophobicContact CG-CD2 3.99Å; L304-F387 HydrophobicContact CG-CE2 4.35Å
305	I	98.7	Very high	98.1	Very high	18 Å²	18	45.8 Å²	45.8	9%	0.092	23%	0.231	C	C	.	.	H	α-helix	trans	-57	-39.4	172.4	-60.2	170	0	0	0	111.4	F301 K309 Q324 F327 K329	F301-I305 HydrophobicContact CD1-CD1 3.74Å; F301-I305 HydrophobicContact CD1-CG1 4.13Å; F301-I305 HydrophobicContact CE1-CD1 3.79Å; F301-I305 HydrophobicContact CE1-CG1 4.07Å; F301-I305 PolarHBondContact O-N 2.9Å; F301-I305 VanDerWaalsContact O-N 3.15Å; I305-K309 HydrophobicContact CG2-CD 3.99Å; I305-K309 WeakPolarHBondContact O-CB 3.48Å; I305-K309 WeakPolarHBondContact O-CG 3.5Å; I305-K309 PolarHBondContact O-N 3.44Å; I305-Q324 HydrophobicContact CG2-CG 4.44Å; I305-F327 HydrophobicContact CG1-CB 3.65Å; I305-K329 HydrophobicContact CD1-CB 3.95Å
306	S	98.6	Very high	98.2	Very high	30 Å²	30	40.6 Å²	40.6	21%	0.21	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-44.5	178.1	-170.9	0	0	0	0	112.1	D302 R303 L304 R310	D302-S306 VanDerWaalsContact O-CB 3.24Å; D302-S306 WeakPolarHBondContact O-CB 3.26Å; D302-S306 PolarHBondContact O-N 3.11Å; R303-S306 WeakPolarHBondContact O-CB 3.33Å; R303-S306 PolarHBondContact O-N 2.92Å; L304-S306 VanDerWaalsContact C-N 3.26Å; L304-S306 PolarHBondContact O-N 2.83Å; S306-R310 VanDerWaalsContact O-CB 3.28Å; S306-R310 WeakPolarHBondContact O-CB 3.36Å; S306-R310 WeakPolarHBondContact O-CD 3.23Å; S306-R310 WeakPolarHBondContact O-CG 3.21Å; S306-R310 PolarHBondContact O-N 3.47Å; S306-R310 VanDerWaalsContact O-N 3.09Å
307	A	98.8	Very high	98.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.4	-49.2	178.8	0	0	0	0	0	111.3	R303 L304 K309 R310 L311 I383 V386	R303-A307 WeakPolarHBondContact O-CB 3.42Å; R303-A307 PolarHBondContact O-N 2.84Å; L304-A307 PolarHBondContact O-N 3.25Å; A307-K309 PolarHBondContact O-N 2.91Å; A307-R310 CarbonylContact O-C 3.57Å; A307-R310 PolarHBondContact O-N 2.93Å; A307-R310 VanDerWaalsContact O-N 3.12Å; A307-L311 WeakPolarHBondContact O-CB 3.47Å; A307-L311 WeakPolarHBondContact O-CD1 3.47Å; A307-L311 WeakPolarHBondContact O-CG 3.29Å; A307-L311 PolarHBondContact O-N 2.65Å; A307-I383 HydrophobicContact CB-CG2 4.09Å; A307-V386 HydrophobicContact CB-CB 3.94Å; A307-V386 HydrophobicContact CB-CG1 3.68Å
308	E	98.8	Very high	98.4	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-48.8	-59.7	173.8	-178.5	-174.6	-161.1	0	0	111.6	L304 R310 L311 H312 L317 H320 T325 Y326 F327 I383	L304-E308 WeakPolarHBondContact O-CB 3.18Å; L304-E308 PolarHBondContact O-N 3.37Å; E308-R310 VanDerWaalsContact C-N 3.25Å; E308-R310 PolarHBondContact O-N 2.97Å; E308-L311 PolarHBondContact O-N 2.69Å; E308-L311 VanDerWaalsContact O-N 3.11Å; E308-H312 PolarHBondContact O-N 2.97Å; E308-L317 HydrophobicContact CG-CD1 4.47Å; E308-H320 IonicContact OE1-CE1 2.7Å; E308-H320 IonicContact OE1-NE2 2.69Å; E308-H320 PolarHBondContact OE1-NE2 3.15Å; E308-T325 PolarHBondContact OE1-N 3.38Å; E308-Y326 PolarHBondContact OE1-N 2.85Å; E308-F327 HydrophobicContact CB-CD2 4.49Å; E308-I383 HydrophobicContact CB-CD1 3.85Å; E308-I383 HydrophobicContact CB-CG1 4.28Å; E308-I383 HydrophobicContact CG-CD1 4.02Å
309	K	98.8	Very high	98.4	Very high	55 Å²	55	44.3 Å²	44.3	24%	0.239	23%	0.226	C	C	.	.	H	α-helix	trans	-56.8	-37.6	178.4	-73.6	173.7	-179.7	176.6	0	112.9	I305 A307 R313 E323	I305-K309 HydrophobicContact CG2-CD 3.99Å; I305-K309 WeakPolarHBondContact O-CB 3.48Å; I305-K309 WeakPolarHBondContact O-CG 3.5Å; I305-K309 PolarHBondContact O-N 3.44Å; A307-K309 PolarHBondContact O-N 2.91Å; K309-R313 VanDerWaalsContact O-CB 3.29Å; K309-R313 WeakPolarHBondContact O-CB 3.43Å; K309-R313 WeakPolarHBondContact O-CD 3.5Å; K309-R313 WeakPolarHBondContact O-CG 3.25Å; K309-R313 PolarHBondContact O-N 2.65Å; K309-E323 WeakPolarHBondContact CA-O 3.07Å; K309-E323 HydrophobicContact CG-CB 4.3Å; K309-E323 WeakPolarHBondContact CG-O 2.98Å
310	R	98.6	Very high	98.5	Very high	59 Å²	59	41.1 Å²	41.1	22%	0.223	21%	0.214	C	C	.	.	H	α-helix	trans	-81.3	-18.3	-177.7	-72	163.6	62.7	-148.4	4.6	113.5	V81 I86 S306 A307 E308 Q314 E390	V81-R310 PolarHBondContact O-NH2 3.26Å; I86-R310 HydrophobicContact CD1-CB 3.76Å; I86-R310 VanDerWaalsContact CD1-CZ 3.48Å; S306-R310 VanDerWaalsContact O-CB 3.28Å; S306-R310 WeakPolarHBondContact O-CB 3.36Å; S306-R310 WeakPolarHBondContact O-CD 3.23Å; S306-R310 WeakPolarHBondContact O-CG 3.21Å; S306-R310 PolarHBondContact O-N 3.47Å; S306-R310 VanDerWaalsContact O-N 3.09Å; A307-R310 CarbonylContact O-C 3.57Å; A307-R310 PolarHBondContact O-N 2.93Å; A307-R310 VanDerWaalsContact O-N 3.12Å; E308-R310 VanDerWaalsContact C-N 3.25Å; E308-R310 PolarHBondContact O-N 2.97Å; R310-Q314 WeakPolarHBondContact O-CG 3.41Å; R310-Q314 PolarHBondContact O-NE2 3.2Å; R310-E390 IonicContact CZ-OE1 3.34Å; R310-E390 IonicContact NH1-OE1 3.7Å; R310-E390 PolarHBondContact NH1-OE1 3.47Å; R310-E390 IonicContact NH2-OE1 3.43Å
311	L	98.8	Very high	98.3	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-83.3	-46.8	168.9	-72.1	158.6	0	0	0	110.3	I86 A90 A307 E308 R313 Q314 G315 L316 L317 K382 I383 V386	I86-L311 HydrophobicContact CG2-CD2 3.54Å; I86-L311 HydrophobicContact CG2-CG 4.13Å; A90-L311 HydrophobicContact CB-CD2 3.74Å; A307-L311 WeakPolarHBondContact O-CB 3.47Å; A307-L311 WeakPolarHBondContact O-CD1 3.47Å; A307-L311 WeakPolarHBondContact O-CG 3.29Å; A307-L311 PolarHBondContact O-N 2.65Å; E308-L311 PolarHBondContact O-N 2.69Å; E308-L311 VanDerWaalsContact O-N 3.11Å; L311-R313 PolarHBondContact O-N 3.01Å; L311-Q314 PolarHBondContact O-N 3.16Å; L311-Q314 VanDerWaalsContact O-N 3.11Å; L311-G315 PolarHBondContact O-N 3Å; L311-L316 HydrophobicContact CB-CB 4.32Å; L311-L316 HydrophobicContact CD2-CB 3.91Å; L311-L316 HydrophobicContact CD2-CD1 3.86Å; L311-L316 WeakPolarHBondContact O-CB 3.45Å; L311-L316 PolarHBondContact O-N 2.89Å; L311-L316 VanDerWaalsContact O-N 3.07Å; L311-L317 HydrophobicContact CB-CD1 4.06Å; L311-L317 HydrophobicContact CB-CD2 3.62Å; L311-L317 HydrophobicContact CB-CG 3.66Å; L311-L317 HydrophobicContact CD1-CD2 4.11Å; L311-L317 HydrophobicContact CG-CD2 4.37Å; L311-K382 HydrophobicContact CD1-CB 4.13Å; L311-K382 HydrophobicContact CD2-CB 4.43Å; L311-I383 HydrophobicContact CD1-CB 4.29Å; L311-I383 HydrophobicContact CD1-CG1 3.6Å; L311-V386 HydrophobicContact CD1-CG2 4.14Å; L311-V386 HydrophobicContact CD2-CG2 4.25Å; L311-V386 HydrophobicContact CG-CG2 4.39Å
312	H	98.7	Very high	98.2	Very high	53 Å²	53	48.5 Å²	48.5	25%	0.245	27%	0.265	C	S	.	.	H	α-helix	trans	-57.4	-50.7	176.7	174.8	84.5	0	0	0	112.2	E308 Q314 G315 L317 H320 S322	E308-H312 PolarHBondContact O-N 2.97Å; H312-Q314 PolarHBondContact O-N 2.95Å; H312-G315 PolarHBondContact O-N 3.47Å; H312-L317 HydrophobicContact CB-CD1 4.15Å; H312-H320 PolarHBondContact CE1-O 3.34Å; H312-H320 AromaticContact CG-ND1 3.77Å; H312-H320 AromaticContact ND1-ND1 3.25Å; H312-H320 PolarHBondContact ND1-ND1 2.93Å; H312-H320 PolarHBondContact ND1-O 3.14Å; H312-H320 VanDerWaalsContact ND1-O 3.13Å; H312-S322 PolarHBondContact CE1-O 3.48Å; H312-S322 PolarHBondContact ND1-O 3.17Å
313	R	98.4	Very high	98	Very high	154 Å²	154	48.9 Å²	48.9	58%	0.581	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-6.3	177.7	-73.6	172	-177.6	174	3.8	115.1	K309 L311 E323	K309-R313 VanDerWaalsContact O-CB 3.29Å; K309-R313 WeakPolarHBondContact O-CB 3.43Å; K309-R313 WeakPolarHBondContact O-CD 3.5Å; K309-R313 WeakPolarHBondContact O-CG 3.25Å; K309-R313 PolarHBondContact O-N 2.65Å; L311-R313 PolarHBondContact O-N 3.01Å; R313-E323 VanDerWaalsContact CG-OE1 3.29Å; R313-E323 WeakPolarHBondContact CG-OE1 3.5Å; R313-E323 IonicContact CZ-OE1 2.74Å; R313-E323 IonicContact CZ-OE2 3.98Å; R313-E323 VanDerWaalsContact NE-CD 3.32Å; R313-E323 IonicContact NE-OE1 3.47Å; R313-E323 PolarHBondContact NE-OE1 3.28Å; R313-E323 IonicContact NE-OE2 2.99Å; R313-E323 PolarHBondContact NE-OE2 3.02Å; R313-E323 IonicContact NH2-OE1 3.49Å; R313-E323 PolarHBondContact NH2-OE1 2.71Å; R313-E323 IonicContact NH2-OE2 3.41Å; R313-E323 PolarHBondContact NH2-OE2 2.93Å
314	Q	98.1	Very high	97.9	Very high	42 Å²	42	48.2 Å²	48.2	20%	0.196	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	2.9	176.7	-65.6	-170.5	79.4	0	0	113.3	I86 R310 L311 H312 L316	I86-Q314 VanDerWaalsContact CG2-NE2 3.3Å; R310-Q314 WeakPolarHBondContact O-CG 3.41Å; R310-Q314 PolarHBondContact O-NE2 3.2Å; L311-Q314 PolarHBondContact O-N 3.16Å; L311-Q314 VanDerWaalsContact O-N 3.11Å; H312-Q314 PolarHBondContact O-N 2.95Å; Q314-L316 VanDerWaalsContact C-N 3.3Å; Q314-L316 HydrophobicContact CB-CD1 3.69Å; Q314-L316 HydrophobicContact CB-CG 3.8Å
315	G	98.3	Very high	97.7	Very high	68 Å²	68	49.5 Å²	49.5	70%	0.701	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	24.5	-175.4	0	0	0	0	0	113.9	L311 H312	L311-G315 PolarHBondContact O-N 3Å; H312-G315 PolarHBondContact O-N 3.47Å
316	L	98.6	Very high	97.6	Very high	39 Å²	39	48.7 Å²	48.7	20%	0.204	27%	0.267	C	S	.	.			trans	-93	-7.6	-174.9	-61.6	170.8	0	0	0	113.8	I86 R87 A90 L311 Q314 K382	I86-L316 HydrophobicContact CG2-CD1 3.83Å; R87-L316 HydrophobicContact CG-CD1 4.1Å; A90-L316 HydrophobicContact CB-CB 4.31Å; A90-L316 HydrophobicContact CB-CD1 4.03Å; A90-L316 HydrophobicContact CB-CD2 4.39Å; A90-L316 HydrophobicContact CB-CG 4.47Å; L311-L316 HydrophobicContact CB-CB 4.32Å; L311-L316 HydrophobicContact CD2-CB 3.91Å; L311-L316 HydrophobicContact CD2-CD1 3.86Å; L311-L316 WeakPolarHBondContact O-CB 3.45Å; L311-L316 PolarHBondContact O-N 2.89Å; L311-L316 VanDerWaalsContact O-N 3.07Å; Q314-L316 VanDerWaalsContact C-N 3.3Å; Q314-L316 HydrophobicContact CB-CD1 3.69Å; Q314-L316 HydrophobicContact CB-CG 3.8Å; L316-K382 WeakPolarHBondContact O-CD 3.39Å; L316-K382 PolarHBondContact O-NZ 3.06Å; L316-K382 VanDerWaalsContact O-NZ 3.12Å
317	L	98.6	Very high	97.6	Very high	17 Å²	17	47.3 Å²	47.3	9%	0.089	26%	0.258	C	S	.	.	S	Bend	trans	-106.4	137.4	175.5	-56.3	-173.5	0	0	0	110.6	E308 L311 H312 H320 N379 I383	E308-L317 HydrophobicContact CG-CD1 4.47Å; L311-L317 HydrophobicContact CB-CD1 4.06Å; L311-L317 HydrophobicContact CB-CD2 3.62Å; L311-L317 HydrophobicContact CB-CG 3.66Å; L311-L317 HydrophobicContact CD1-CD2 4.11Å; L311-L317 HydrophobicContact CG-CD2 4.37Å; H312-L317 HydrophobicContact CB-CD1 4.15Å; L317-H320 HydrophobicContact CB-CB 3.71Å; L317-H320 HydrophobicContact CD1-CB 4.47Å; L317-N379 WeakPolarHBondContact CA-OD1 3.28Å; L317-N379 HydrophobicContact CD2-CB 3.9Å; L317-I383 HydrophobicContact CD1-CD1 4.41Å
318	M	97.7	Very high	97.5	Very high	99 Å²	99	51.1 Å²	51.1	49%	0.488	27%	0.272	S	S	.	.	S	Bend	trans	-98.4	146.9	179.9	-69.9	173.8	60.4	0	0	111	H320 P375 N379	M318-H320 PolarHBondContact O-N 3.28Å; M318-H320 VanDerWaalsContact O-N 3.11Å; M318-P375 HydrophobicContact CB-CB 4Å; M318-N379 PolarHBondContact N-OD1 2.81Å; M318-N379 PolarHBondContact O-ND2 2.95Å
319	S	97.2	Very high	97.2	Very high	75 Å²	75	55 Å²	55	52%	0.524	29%	0.289	S	S	.	.	S	Bend	trans	51.4	32.7	-178.6	-54.1	0	0	0	0	114.5	P321	S319-P321 WeakPolarHBondContact O-CD 3.07Å
320	H	98.1	Very high	96.8	Very high	14 Å²	14	57.5 Å²	57.5	7%	0.065	31%	0.305	C	S	.	.			trans	-114.9	89	-171.2	-167.7	-82.9	0	0	0	111.3	E308 H312 L317 M318 S322 T325 Y326	E308-H320 IonicContact OE1-CE1 2.7Å; E308-H320 IonicContact OE1-NE2 2.69Å; E308-H320 PolarHBondContact OE1-NE2 3.15Å; H312-H320 PolarHBondContact CE1-O 3.34Å; H312-H320 AromaticContact CG-ND1 3.77Å; H312-H320 AromaticContact ND1-ND1 3.25Å; H312-H320 PolarHBondContact ND1-ND1 2.93Å; H312-H320 PolarHBondContact ND1-O 3.14Å; H312-H320 VanDerWaalsContact ND1-O 3.13Å; L317-H320 HydrophobicContact CB-CB 3.71Å; L317-H320 HydrophobicContact CD1-CB 4.47Å; M318-H320 PolarHBondContact O-N 3.28Å; M318-H320 VanDerWaalsContact O-N 3.11Å; H320-S322 PolarHBondContact CE1-O 2.83Å; H320-S322 PolarHBondContact ND1-O 3.48Å; H320-S322 PolarHBondContact O-N 3.31Å; H320-T325 PolarHBondContact CD2-OG1 2.52Å; H320-T325 PolarHBondContact CE1-OG1 3.07Å; H320-T325 PolarHBondContact ND1-OG1 3.02Å; H320-T325 PolarHBondContact NE2-OG1 3.26Å; H320-Y326 AromaticContact CD2-CE2 3.47Å; H320-Y326 VanDerWaalsContact CD2-CE2 3.47Å; H320-Y326 WeakPolarHBondContact CD2-CE2 3.44Å; H320-Y326 AromaticContact CD2-CZ 3.59Å; H320-Y326 AromaticContact NE2-CD2 3.96Å; H320-Y326 AromaticContact NE2-CE2 3.71Å
321	P	95.1	Very high	96.3	Very high	110 Å²	110	56.5 Å²	56.5	71%	0.714	31%	0.305	S	S	*	.			trans	-78.7	-18.6	-165	30.7	-36.8	0	0	0	115.2	S319	S319-P321 WeakPolarHBondContact O-CD 3.07Å
322	S	96.1	Very high	95.6	Very high	54 Å²	54	66 Å²	66	38%	0.378	34%	0.342	S	S	.	.	S	Bend	trans	-107.5	163.7	179.4	178.6	0	0	0	0	110.9	H312 H320 Q324	H312-S322 PolarHBondContact CE1-O 3.48Å; H312-S322 PolarHBondContact ND1-O 3.17Å; H320-S322 PolarHBondContact CE1-O 2.83Å; H320-S322 PolarHBondContact ND1-O 3.48Å; H320-S322 PolarHBondContact O-N 3.31Å; S322-Q324 VanDerWaalsContact CB-O 3.3Å; S322-Q324 WeakPolarHBondContact CB-O 3.2Å; S322-Q324 PolarHBondContact O-N 3.2Å; S322-Q324 PolarHBondContact OG-N 3.1Å; S322-Q324 VanDerWaalsContact OG-N 3.1Å; S322-Q324 PolarHBondContact OG-O 3.11Å
323	E	95.3	Very high	94.9	Very high	78 Å²	78	66.3 Å²	66.3	36%	0.364	35%	0.346	S	S	.	.	S	Bend	trans	-67.2	-23.6	164.2	-63.8	-154.2	137.3	0	0	112.7	K309 R313	K309-E323 WeakPolarHBondContact CA-O 3.07Å; K309-E323 HydrophobicContact CG-CB 4.3Å; K309-E323 WeakPolarHBondContact CG-O 2.98Å; R313-E323 VanDerWaalsContact CG-OE1 3.29Å; R313-E323 WeakPolarHBondContact CG-OE1 3.5Å; R313-E323 IonicContact CZ-OE1 2.74Å; R313-E323 IonicContact CZ-OE2 3.98Å; R313-E323 VanDerWaalsContact NE-CD 3.32Å; R313-E323 IonicContact NE-OE1 3.47Å; R313-E323 PolarHBondContact NE-OE1 3.28Å; R313-E323 IonicContact NE-OE2 2.99Å; R313-E323 PolarHBondContact NE-OE2 3.02Å; R313-E323 IonicContact NH2-OE1 3.49Å; R313-E323 PolarHBondContact NH2-OE1 2.71Å; R313-E323 IonicContact NH2-OE2 3.41Å; R313-E323 PolarHBondContact NH2-OE2 2.93Å
324	Q	95.2	Very high	93.9	Very high	47 Å²	47	61.2 Å²	61.2	22%	0.22	34%	0.342	C	S	.	.			trans	-143.4	111.3	-178.3	-173.6	180	-8	0	0	107.6	I305 S322 F327	I305-Q324 HydrophobicContact CG2-CG 4.44Å; S322-Q324 VanDerWaalsContact CB-O 3.3Å; S322-Q324 WeakPolarHBondContact CB-O 3.2Å; S322-Q324 PolarHBondContact O-N 3.2Å; S322-Q324 PolarHBondContact OG-N 3.1Å; S322-Q324 VanDerWaalsContact OG-N 3.1Å; S322-Q324 PolarHBondContact OG-O 3.11Å; Q324-F327 PolarHBondContact NE2-O 2.77Å
325	T	94.6	Very high	93.2	Very high	28 Å²	28	65.3 Å²	65.3	17%	0.172	37%	0.371	C	S	.	.	S	Bend	trans	-114.5	-52.5	-177.4	-44.9	0	0	0	0	109.3	D287 E308 H320	D287-T325 HydrophobicContact CB-CG2 4.47Å; E308-T325 PolarHBondContact OE1-N 3.38Å; H320-T325 PolarHBondContact CD2-OG1 2.52Å; H320-T325 PolarHBondContact CE1-OG1 3.07Å; H320-T325 PolarHBondContact ND1-OG1 3.02Å; H320-T325 PolarHBondContact NE2-OG1 3.26Å
326	Y	98.3	Very high	92.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-90.2	-56.8	-165.8	-47.2	-47.9	0	0	0	112.9	P288 I290 E308 H320 R328 T376 N379 L380 I383	P288-Y326 HydrophobicContact CG-CD1 4.02Å; P288-Y326 HydrophobicContact CG-CE1 4.46Å; P288-Y326 VanDerWaalsContact O-CA 3.29Å; P288-Y326 WeakPolarHBondContact O-CA 3.42Å; I290-Y326 PolarHBondContact N-O 2.9Å; E308-Y326 PolarHBondContact OE1-N 2.85Å; H320-Y326 AromaticContact CD2-CE2 3.47Å; H320-Y326 VanDerWaalsContact CD2-CE2 3.47Å; H320-Y326 WeakPolarHBondContact CD2-CE2 3.44Å; H320-Y326 AromaticContact CD2-CZ 3.59Å; H320-Y326 AromaticContact NE2-CD2 3.96Å; H320-Y326 AromaticContact NE2-CE2 3.71Å; Y326-R328 PolarHBondContact O-N 3.12Å; Y326-T376 HydrophobicContact CE1-CG2 4.39Å; Y326-N379 HydrophobicContact CE2-CB 3.94Å; Y326-N379 PolarHBondContact OH-ND2 2.95Å; Y326-L380 HydrophobicContact CD2-CD2 3.75Å; Y326-L380 HydrophobicContact CE2-CD2 4.25Å; Y326-L380 HydrophobicContact CG-CD2 4.17Å; Y326-I383 HydrophobicContact CD2-CD1 4.04Å; Y326-I383 HydrophobicContact CE2-CD1 4.35Å
327	F	98.3	Very high	92.8	Very high	1 Å²	1	66.8 Å²	66.8	0%	0.004	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	113.7	-168.8	-66.5	-82	0	0	0	111.3	I290 F301 L304 I305 E308 Q324 I353 L380 I383	I290-F327 HydrophobicContact CB-CD1 4.04Å; I290-F327 HydrophobicContact CB-CE1 4.15Å; I290-F327 HydrophobicContact CD1-CD1 4.39Å; I290-F327 HydrophobicContact CD1-CE1 3.77Å; I290-F327 HydrophobicContact CD1-CE2 4.48Å; I290-F327 HydrophobicContact CD1-CZ 3.82Å; I290-F327 HydrophobicContact CG2-CD1 3.9Å; I290-F327 HydrophobicContact CG2-CE1 3.83Å; F301-F327 HydrophobicContact CE1-CB 4.06Å; F301-F327 HydrophobicContact CE2-CD1 4.09Å; F301-F327 HydrophobicContact CZ-CB 4.06Å; F301-F327 HydrophobicContact CZ-CD1 4.01Å; L304-F327 HydrophobicContact CB-CD1 3.75Å; L304-F327 HydrophobicContact CB-CD2 4.16Å; L304-F327 HydrophobicContact CB-CE1 3.89Å; L304-F327 HydrophobicContact CB-CE2 4.31Å; L304-F327 HydrophobicContact CB-CG 3.9Å; L304-F327 HydrophobicContact CB-CZ 4.17Å; L304-F327 HydrophobicContact CD1-CD1 3.94Å; L304-F327 HydrophobicContact CD1-CE1 3.61Å; L304-F327 HydrophobicContact CD1-CZ 4.32Å; L304-F327 HydrophobicContact CD2-CZ 4.47Å; L304-F327 HydrophobicContact CG-CD1 4.45Å; L304-F327 HydrophobicContact CG-CE1 4.21Å; I305-F327 HydrophobicContact CG1-CB 3.65Å; E308-F327 HydrophobicContact CB-CD2 4.49Å; Q324-F327 PolarHBondContact NE2-O 2.77Å; F327-I353 HydrophobicContact CE1-CG2 4.08Å; F327-I353 HydrophobicContact CZ-CG2 4.38Å; F327-L380 HydrophobicContact CE2-CD2 3.9Å; F327-L380 HydrophobicContact CZ-CD2 4.01Å; F327-I383 HydrophobicContact CE2-CD1 4.03Å; F327-I383 HydrophobicContact CE2-CG2 3.81Å; F327-I383 HydrophobicContact CZ-CG2 4.31Å
328	R	96	Very high	92.8	Very high	81 Å²	81	66 Å²	66	31%	0.306	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	116.1	-173.6	-63.7	-67.2	-68	-80.1	-4.1	111.7	L289 I290 A291 N292 Y326 D330 V331	L289-R328 HydrophobicContact CD1-CB 3.57Å; L289-R328 HydrophobicContact CD1-CG 3.39Å; I290-R328 PolarHBondContact O-N 2.83Å; A291-R328 WeakPolarHBondContact CA-O 3.47Å; N292-R328 PolarHBondContact N-O 2.9Å; Y326-R328 PolarHBondContact O-N 3.12Å; R328-D330 IonicContact CZ-OD1 3.44Å; R328-D330 IonicContact CZ-OD2 2.78Å; R328-D330 IonicContact NE-OD1 3.63Å; R328-D330 PolarHBondContact NE-OD1 3.21Å; R328-D330 IonicContact NE-OD2 3.39Å; R328-D330 PolarHBondContact NE-OD2 2.84Å; R328-D330 IonicContact NH2-OD1 3.61Å; R328-D330 IonicContact NH2-OD2 2.74Å; R328-D330 PolarHBondContact NH2-OD2 3.23Å; R328-V331 HydrophobicContact CB-CB 4.5Å; R328-V331 HydrophobicContact CB-CG2 4.02Å
329	K	92.2	Very high	92.9	Very high	80 Å²	80	61.3 Å²	61.3	35%	0.348	33%	0.333	S	S	.	.	S	Bend	trans	-100.7	-9.1	-179.7	-173.6	166.9	174.1	172.4	0	112.8	N292 A298 F301 D302 I305 V331	N292-K329 HydrophobicContact CB-CB 4.42Å; N292-K329 HydrophobicContact CB-CG 4.11Å; A298-K329 PolarHBondContact O-NZ 2.9Å; F301-K329 HydrophobicContact CD1-CB 4.07Å; F301-K329 HydrophobicContact CD1-CD 4.31Å; F301-K329 HydrophobicContact CE1-CB 3.98Å; D302-K329 VanDerWaalsContact OD1-CD 3.28Å; D302-K329 WeakPolarHBondContact OD1-CD 3.48Å; D302-K329 IonicContact OD1-NZ 3.16Å; D302-K329 PolarHBondContact OD1-NZ 2.94Å; D302-K329 IonicContact OD2-NZ 3.02Å; D302-K329 PolarHBondContact OD2-NZ 3.48Å; I305-K329 HydrophobicContact CD1-CB 3.95Å; K329-V331 VanDerWaalsContact C-N 3.34Å
330	D	89.9	Confident	92.9	Very high	109 Å²	109	57.8 Å²	57.8	58%	0.583	31%	0.309	S	S	*	.	S	Bend	trans	-85.5	-6.4	173.5	56.9	-56	0	0	0	113.2	R328	R328-D330 IonicContact CZ-OD1 3.44Å; R328-D330 IonicContact CZ-OD2 2.78Å; R328-D330 IonicContact NE-OD1 3.63Å; R328-D330 PolarHBondContact NE-OD1 3.21Å; R328-D330 IonicContact NE-OD2 3.39Å; R328-D330 PolarHBondContact NE-OD2 2.84Å; R328-D330 IonicContact NH2-OD1 3.61Å; R328-D330 IonicContact NH2-OD2 2.74Å; R328-D330 PolarHBondContact NH2-OD2 3.23Å
331	V	88.8	Confident	93	Very high	38 Å²	38	58.6 Å²	58.6	23%	0.23	31%	0.313	C	S	.	.			trans	-107.3	127.7	175.1	-171.9	0	0	0	0	108.8	L289 R328 K329 L333	L289-V331 HydrophobicContact CD1-CG2 4.45Å; R328-V331 HydrophobicContact CB-CB 4.5Å; R328-V331 HydrophobicContact CB-CG2 4.02Å; K329-V331 VanDerWaalsContact C-N 3.34Å; V331-L333 HydrophobicContact CG1-CD1 4.29Å; V331-L333 HydrophobicContact CG1-CD2 3.89Å; V331-L333 HydrophobicContact CG1-CG 3.9Å
332	Y	83.9	Confident	93.1	Very high	198 Å²	198	54 Å²	54	78%	0.776	28%	0.284	S	S	*	.			trans	-110.9	127.1	172.7	-175.6	-94	0	0	0	109.2
333	L	84.5	Confident	93.3	Very high	60 Å²	60	51.5 Å²	51.5	31%	0.314	27%	0.266	S	S	.	.			trans	-126.8	164	-177.5	-60.4	177.5	0	0	0	109.9	A291 V331 T356	A291-L333 HydrophobicContact CB-CD1 3.89Å; A291-L333 HydrophobicContact CB-CG 4.28Å; V331-L333 HydrophobicContact CG1-CD1 4.29Å; V331-L333 HydrophobicContact CG1-CD2 3.89Å; V331-L333 HydrophobicContact CG1-CG 3.9Å; L333-T356 WeakPolarHBondContact CD1-O 3.11Å; L333-T356 WeakPolarHBondContact CD1-OG1 3.46Å
334	G	77.6	Confident	93.4	Very high	48 Å²	48	50 Å²	50	50%	0.495	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-62.9	162.2	179	0	0	0	0	0	113	V336	G334-V336 PolarHBondContact O-N 2.83Å
335	P	83.6	Confident	93.6	Very high	127 Å²	127	55.1 Å²	55.1	83%	0.825	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-65.3	133.6	170.9	29.2	-33.9	0	0	0	110.1
336	V	91.9	Very high	93.7	Very high	24 Å²	24	57.7 Å²	57.7	15%	0.145	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-95.5	142	165.9	-179.1	0	0	0	0	107.5	G334 H340 H352 I354 T356 F358	G334-V336 PolarHBondContact O-N 2.83Å; V336-H340 PolarHBondContact O-CE1 3.06Å; V336-H352 WeakPolarHBondContact CB-NE2 3.26Å; V336-H352 VanDerWaalsContact CG1-NE2 3.34Å; V336-H352 WeakPolarHBondContact CG1-NE2 2.95Å; V336-I354 HydrophobicContact CG1-CD1 3.94Å; V336-I354 HydrophobicContact CG2-CD1 4.5Å; V336-T356 HydrophobicContact CG2-CG2 4.16Å; V336-F358 HydrophobicContact CG1-CE1 4.36Å; V336-F358 HydrophobicContact CG1-CZ 3.95Å; V336-F358 HydrophobicContact CG2-CE1 4.13Å; V336-F358 HydrophobicContact CG2-CZ 4.29Å
337	Q	96.4	Very high	93.7	Very high	114 Å²	114	60.1 Å²	60.1	53%	0.533	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-93.4	132.7	167.2	-64.2	-175.1	11.4	0	0	108.3	W240 I341	W240-Q337 HydrophobicContact CZ2-CB 3.74Å; Q337-I341 HydrophobicContact CB-CG1 4.3Å; Q337-I341 HydrophobicContact CG-CG1 4.48Å
338	D	98.6	Very high	93.7	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	32%	0.319	C	S	.	.	S	Bend	trans	-168.6	180	-178.1	127.5	80.8	0	0	0	107	E234 L246 L279 H340 I341 H352	E234-D338 WeakPolarHBondContact OE1-CA 3.29Å; L246-D338 WeakPolarHBondContact CD1-O 3.33Å; L246-D338 VanDerWaalsContact CD2-C 3.43Å; L279-D338 VanDerWaalsContact CD2-OD1 3.24Å; L279-D338 WeakPolarHBondContact CD2-OD1 3.3Å; L279-D338 WeakPolarHBondContact CD2-OD2 3.44Å; D338-H340 PolarHBondContact O-N 2.84Å; D338-H340 IonicContact OD2-CE1 2.73Å; D338-H340 PolarHBondContact OD2-CE1 3.4Å; D338-H340 IonicContact OD2-CG 3.72Å; D338-H340 IonicContact OD2-ND1 2.78Å; D338-H340 PolarHBondContact OD2-ND1 2.98Å; D338-I341 WeakPolarHBondContact O-CB 3.24Å; D338-I341 WeakPolarHBondContact O-CG1 3.21Å; D338-I341 PolarHBondContact O-N 3.27Å; D338-H352 VanDerWaalsContact CB-NE2 3.31Å; D338-H352 WeakPolarHBondContact CB-NE2 3.05Å; D338-H352 IonicContact OD2-CD2 2.87Å; D338-H352 IonicContact OD2-ND1 3.82Å; D338-H352 IonicContact OD2-NE2 3.77Å; D338-H352 PolarHBondContact OD2-NE2 2.72Å
339	D	98.9	Very high	93.8	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-15	-171.3	-87.3	-28.6	0	0	0	116.3	F231 S249 L279 I341 P342	F231-D339 WeakPolarHBondContact CB-OD2 3.22Å; F231-D339 HydrophobicContact CD2-CB 3.84Å; F231-D339 WeakPolarHBondContact CD2-OD2 3.5Å; F231-D339 HydrophobicContact CE2-CB 3.95Å; F231-D339 HydrophobicContact CG-CB 4.39Å; F231-D339 WeakPolarHBondContact CG-OD2 3.28Å; S249-D339 VanDerWaalsContact CB-O 3.29Å; S249-D339 WeakPolarHBondContact CB-O 3.12Å; S249-D339 WeakPolarHBondContact CB-OD1 3.43Å; S249-D339 WeakPolarHBondContact OG-CA 3Å; S249-D339 PolarHBondContact OG-OD1 3.34Å; L279-D339 HydrophobicContact CD2-CB 3.95Å; D339-I341 VanDerWaalsContact C-N 3.3Å; D339-I341 PolarHBondContact O-N 3.16Å; D339-P342 WeakPolarHBondContact O-CD 3.31Å
340	H	98.8	Very high	94.1	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.009	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-23.2	172.2	71.4	-82.5	0	0	0	113.9	F277 L279 F294 V336 D338 F343 L344 V350 H352	F277-H340 HydrophobicContact CD1-CB 4.48Å; F277-H340 HydrophobicContact CE1-CB 4.19Å; F277-H340 HydrophobicContact CZ-CB 4.44Å; L279-H340 HydrophobicContact CD2-CB 3.65Å; F294-H340 AromaticContact CZ-CD2 3.8Å; F294-H340 AromaticContact CZ-NE2 3.62Å; V336-H340 PolarHBondContact O-CE1 3.06Å; D338-H340 PolarHBondContact O-N 2.84Å; D338-H340 IonicContact OD2-CE1 2.73Å; D338-H340 PolarHBondContact OD2-CE1 3.4Å; D338-H340 IonicContact OD2-CG 3.72Å; D338-H340 IonicContact OD2-ND1 2.78Å; D338-H340 PolarHBondContact OD2-ND1 2.98Å; H340-F343 PolarHBondContact O-N 2.95Å; H340-F343 VanDerWaalsContact O-N 3.15Å; H340-L344 WeakPolarHBondContact O-CB 3.49Å; H340-L344 PolarHBondContact O-N 3.36Å; H340-V350 HydrophobicContact CB-CB 4.37Å; H340-V350 HydrophobicContact CB-CG1 3.53Å; H340-V350 HydrophobicContact CB-CG2 3.88Å; H340-H352 AromaticContact CE1-CE1 2.88Å; H340-H352 PolarHBondContact CE1-CE1 3.22Å; H340-H352 AromaticContact CE1-ND1 3.41Å; H340-H352 PolarHBondContact CE1-ND1 2.94Å; H340-H352 AromaticContact CE1-NE2 3.71Å; H340-H352 AromaticContact ND1-CE1 3.36Å; H340-H352 PolarHBondContact ND1-CE1 2.9Å; H340-H352 AromaticContact ND1-ND1 3.55Å; H340-H352 AromaticContact ND1-NE2 3.9Å; H340-H352 AromaticContact NE2-CE1 3.58Å
341	I	98.6	Very high	94.5	Very high	30 Å²	30	48.5 Å²	48.5	15%	0.154	27%	0.266	C	S	.	.	H	α-helix	trans	-59.2	-46.8	-170.6	-68.4	-69.1	0	0	0	113.2	L246 Q337 D338 D339 F343 L344 H345	L246-I341 HydrophobicContact CD1-CB 4.13Å; Q337-I341 HydrophobicContact CB-CG1 4.3Å; Q337-I341 HydrophobicContact CG-CG1 4.48Å; D338-I341 WeakPolarHBondContact O-CB 3.24Å; D338-I341 WeakPolarHBondContact O-CG1 3.21Å; D338-I341 PolarHBondContact O-N 3.27Å; D339-I341 VanDerWaalsContact C-N 3.3Å; D339-I341 PolarHBondContact O-N 3.16Å; I341-F343 PolarHBondContact O-N 2.92Å; I341-L344 HydrophobicContact CD1-CD2 4.39Å; I341-L344 PolarHBondContact O-N 3.09Å; I341-H345 WeakPolarHBondContact CG2-CE1 3.21Å; I341-H345 PolarHBondContact O-N 3.33Å
342	P	98.8	Very high	94.9	Very high	15 Å²	15	46.9 Å²	46.9	10%	0.097	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-29.1	178	-25.2	37.9	0	0	0	113.8	L246 R250 A253 D339 K346	L246-P342 HydrophobicContact CD1-CG 4.47Å; R250-P342 HydrophobicContact CB-CG 4.4Å; R250-P342 HydrophobicContact CG-CB 4.41Å; R250-P342 HydrophobicContact CG-CG 3.69Å; A253-P342 HydrophobicContact CB-CB 3.62Å; D339-P342 WeakPolarHBondContact O-CD 3.31Å; P342-K346 WeakPolarHBondContact O-CD 3.39Å; P342-K346 WeakPolarHBondContact O-CG 3.38Å
343	F	98.8	Very high	95.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-81	-41.4	177.3	-68.9	-108	0	0	0	111.5	L169 F231 L252 A253 L256 L271 F277 H340 I341 K346 G347 V348	L169-F343 HydrophobicContact CD1-CE1 4.27Å; F231-F343 AromaticContact CE1-CE2 3.82Å; F231-F343 HydrophobicContact CE1-CE2 3.82Å; F231-F343 AromaticContact CE1-CZ 3.94Å; F231-F343 HydrophobicContact CE1-CZ 3.94Å; F231-F343 AromaticContact CZ-CE2 3.69Å; F231-F343 HydrophobicContact CZ-CE2 3.69Å; F231-F343 AromaticContact CZ-CZ 3.84Å; F231-F343 HydrophobicContact CZ-CZ 3.84Å; L252-F343 HydrophobicContact CB-CZ 4.46Å; L252-F343 HydrophobicContact CD2-CZ 4.45Å; L252-F343 HydrophobicContact CG-CZ 4.38Å; A253-F343 HydrophobicContact CB-CD1 4.45Å; A253-F343 HydrophobicContact CB-CD2 3.72Å; A253-F343 HydrophobicContact CB-CE1 4.43Å; A253-F343 HydrophobicContact CB-CE2 3.71Å; A253-F343 HydrophobicContact CB-CG 4.1Å; A253-F343 HydrophobicContact CB-CZ 4.07Å; L256-F343 HydrophobicContact CD1-CE1 3.84Å; L256-F343 HydrophobicContact CD1-CZ 4.25Å; L271-F343 HydrophobicContact CD1-CD1 3.44Å; L271-F343 VanDerWaalsContact CD1-CD1 3.44Å; L271-F343 HydrophobicContact CD1-CE1 3.79Å; L271-F343 HydrophobicContact CD1-CG 4.35Å; F277-F343 HydrophobicContact CD1-CB 3.65Å; F277-F343 AromaticContact CD1-CD1 3.88Å; F277-F343 HydrophobicContact CD1-CD1 3.88Å; F277-F343 HydrophobicContact CD1-CD2 4.07Å; F277-F343 AromaticContact CD1-CG 3.62Å; F277-F343 HydrophobicContact CD1-CG 3.62Å; F277-F343 HydrophobicContact CE1-CB 3.89Å; F277-F343 HydrophobicContact CE1-CD1 4.03Å; F277-F343 AromaticContact CE1-CD2 3.48Å; F277-F343 HydrophobicContact CE1-CD2 3.48Å; F277-F343 VanDerWaalsContact CE1-CD2 3.48Å; F277-F343 HydrophobicContact CE1-CE1 4.43Å; F277-F343 AromaticContact CE1-CE2 3.93Å; F277-F343 HydrophobicContact CE1-CE2 3.93Å; F277-F343 AromaticContact CE1-CG 3.54Å; F277-F343 HydrophobicContact CE1-CG 3.54Å; F277-F343 HydrophobicContact CE1-CZ 4.4Å; H340-F343 PolarHBondContact O-N 2.95Å; H340-F343 VanDerWaalsContact O-N 3.15Å; I341-F343 PolarHBondContact O-N 2.92Å; F343-K346 CarbonylContact O-C 3.5Å; F343-K346 PolarHBondContact O-N 2.67Å; F343-K346 VanDerWaalsContact O-N 3.11Å; F343-G347 PolarHBondContact O-N 3.4Å; F343-V348 HydrophobicContact CB-CB 4.04Å; F343-V348 HydrophobicContact CB-CG2 4.11Å; F343-V348 HydrophobicContact CD1-CG2 4.35Å; F343-V348 WeakPolarHBondContact O-CB 3.4Å; F343-V348 WeakPolarHBondContact O-CG2 3.2Å; F343-V348 PolarHBondContact O-N 2.91Å; F343-V348 VanDerWaalsContact O-N 3.1Å
344	L	98.3	Very high	96.3	Very high	47 Å²	47	34.7 Å²	34.7	25%	0.246	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-46.6	176.6	-176.9	68.7	0	0	0	111.3	F294 H340 I341 K346 G347 V350	F294-L344 HydrophobicContact CD1-CD1 4.47Å; F294-L344 HydrophobicContact CE1-CD1 4.07Å; F294-L344 HydrophobicContact CE1-CD2 3.69Å; F294-L344 HydrophobicContact CZ-CD1 4.46Å; F294-L344 HydrophobicContact CZ-CD2 3.88Å; H340-L344 WeakPolarHBondContact O-CB 3.49Å; H340-L344 PolarHBondContact O-N 3.36Å; I341-L344 HydrophobicContact CD1-CD2 4.39Å; I341-L344 PolarHBondContact O-N 3.09Å; L344-K346 PolarHBondContact O-N 3.05Å; L344-K346 VanDerWaalsContact O-N 3.16Å; L344-G347 PolarHBondContact O-N 3.03Å; L344-V350 HydrophobicContact CB-CG2 4.06Å; L344-V350 HydrophobicContact CD1-CB 4.43Å; L344-V350 HydrophobicContact CD1-CG2 3.95Å
345	H	98.1	Very high	97.2	Very high	154 Å²	154	32.6 Å²	32.6	71%	0.713	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-22.8	175.8	-71.3	161	0	0	0	113.6	I341	I341-H345 WeakPolarHBondContact CG2-CE1 3.21Å; I341-H345 PolarHBondContact O-N 3.33Å
346	K	98	Very high	97.7	Very high	82 Å²	82	27 Å²	27	36%	0.357	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	8.6	175.6	-64.2	174.2	-174.3	-75.9	0	113.3	A253 E254 A257 L271 P342 F343 L344	A253-K346 HydrophobicContact CB-CD 4.21Å; A253-K346 WeakPolarHBondContact O-CD 3.35Å; A253-K346 WeakPolarHBondContact O-CE 3.45Å; E254-K346 IonicContact OE1-NZ 3.36Å; E254-K346 IonicContact OE2-NZ 2.69Å; E254-K346 PolarHBondContact OE2-NZ 3.23Å; A257-K346 HydrophobicContact CB-CD 4.23Å; L271-K346 HydrophobicContact CD2-CB 3.53Å; L271-K346 HydrophobicContact CD2-CD 3.49Å; L271-K346 VanDerWaalsContact CD2-CD 3.49Å; L271-K346 HydrophobicContact CD2-CG 4.13Å; P342-K346 WeakPolarHBondContact O-CD 3.39Å; P342-K346 WeakPolarHBondContact O-CG 3.38Å; F343-K346 CarbonylContact O-C 3.5Å; F343-K346 PolarHBondContact O-N 2.67Å; F343-K346 VanDerWaalsContact O-N 3.11Å; L344-K346 PolarHBondContact O-N 3.05Å; L344-K346 VanDerWaalsContact O-N 3.16Å
347	G	96.9	Very high	97.8	Very high	51 Å²	51	30.9 Å²	30.9	53%	0.526	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	17.8	172.2	0	0	0	0	0	115.9	F343 L344	F343-G347 PolarHBondContact O-N 3.4Å; L344-G347 PolarHBondContact O-N 3.03Å
348	V	98.3	Very high	97.9	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.03	16%	0.161	C	C	.	.			trans	-76.2	131.8	171	-178.6	0	0	0	0	109.8	L271 V274 F277 F343	L271-V348 HydrophobicContact CD1-CG2 3.67Å; L271-V348 HydrophobicContact CD2-CG2 4.41Å; L271-V348 HydrophobicContact CG-CG2 3.81Å; V274-V348 HydrophobicContact CB-CG1 4.05Å; V274-V348 HydrophobicContact CG1-CG1 3.59Å; F277-V348 HydrophobicContact CB-CG1 3.84Å; F343-V348 HydrophobicContact CB-CB 4.04Å; F343-V348 HydrophobicContact CB-CG2 4.11Å; F343-V348 HydrophobicContact CD1-CG2 4.35Å; F343-V348 WeakPolarHBondContact O-CB 3.4Å; F343-V348 WeakPolarHBondContact O-CG2 3.2Å; F343-V348 PolarHBondContact O-N 2.91Å; F343-V348 VanDerWaalsContact O-N 3.1Å
349	P	98.2	Very high	97.8	Very high	19 Å²	19	29.7 Å²	29.7	12%	0.123	17%	0.167	C	C	.	.			trans	-70.4	129.1	172.7	-16.7	31.3	0	0	0	110.8	L276 F277 T297	L276-P349 HydrophobicContact CD1-CB 4.37Å; F277-P349 PolarHBondContact N-O 3.25Å; T297-P349 HydrophobicContact CG2-CB 3.55Å
350	V	98.6	Very high	97.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	139	-175.5	177.6	0	0	0	0	111.4	F277 F294 T297 H340 L344 H352	F277-V350 HydrophobicContact CB-CG2 4.49Å; F277-V350 CarbonylContact O-C 3.46Å; F277-V350 WeakPolarHBondContact O-CA 3.45Å; F294-V350 HydrophobicContact CD2-CB 3.97Å; F294-V350 HydrophobicContact CD2-CG1 4.01Å; F294-V350 VanDerWaalsContact CD2-O 3.29Å; F294-V350 WeakPolarHBondContact CD2-O 3.38Å; F294-V350 HydrophobicContact CE2-CB 3.79Å; F294-V350 HydrophobicContact CE2-CG1 3.54Å; F294-V350 HydrophobicContact CZ-CB 4.39Å; F294-V350 HydrophobicContact CZ-CG1 4.33Å; T297-V350 WeakPolarHBondContact CB-O 3.39Å; T297-V350 WeakPolarHBondContact CG2-O 3.45Å; T297-V350 PolarHBondContact OG1-O 2.87Å; H340-V350 HydrophobicContact CB-CB 4.37Å; H340-V350 HydrophobicContact CB-CG1 3.53Å; H340-V350 HydrophobicContact CB-CG2 3.88Å; L344-V350 HydrophobicContact CB-CG2 4.06Å; L344-V350 HydrophobicContact CD1-CB 4.43Å; L344-V350 HydrophobicContact CD1-CG2 3.95Å; V350-H352 HydrophobicContact CG1-CB 4.23Å
351	L	98.4	Very high	97.6	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	92.2	166.8	-180	66.2	0	0	0	107.7	L276 F277 V278 L279 W300 F301 L304 I353 F387	L276-L351 HydrophobicContact CD1-CB 4.02Å; L276-L351 HydrophobicContact CD2-CB 4.49Å; L276-L351 HydrophobicContact CD2-CD2 4.29Å; L276-L351 HydrophobicContact CG-CB 4.46Å; F277-L351 PolarHBondContact O-N 2.59Å; V278-L351 WeakPolarHBondContact CA-O 3.39Å; V278-L351 HydrophobicContact CG1-CD2 4.37Å; V278-L351 HydrophobicContact CG2-CB 4.3Å; V278-L351 HydrophobicContact CG2-CD2 4.15Å; L279-L351 PolarHBondContact N-O 3.31Å; L279-L351 VanDerWaalsContact N-O 3.14Å; W300-L351 HydrophobicContact CB-CD2 3.89Å; F301-L351 HydrophobicContact CB-CD1 3.92Å; F301-L351 HydrophobicContact CD2-CD1 3.89Å; F301-L351 HydrophobicContact CG-CD1 4.43Å; L304-L351 HydrophobicContact CD1-CD2 4.02Å; L304-L351 HydrophobicContact CD1-CG 4.45Å; L351-I353 HydrophobicContact CG-CG1 4.44Å; L351-F387 HydrophobicContact CD2-CE2 4.09Å; L351-F387 HydrophobicContact CD2-CZ 3.9Å
352	H	98.4	Very high	97.5	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.019	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	120.9	-178.6	-166.1	177.5	0	0	0	109.4	F294 V336 D338 H340 V350	F294-H352 HydrophobicContact CE2-CB 4.13Å; V336-H352 WeakPolarHBondContact CB-NE2 3.26Å; V336-H352 VanDerWaalsContact CG1-NE2 3.34Å; V336-H352 WeakPolarHBondContact CG1-NE2 2.95Å; D338-H352 VanDerWaalsContact CB-NE2 3.31Å; D338-H352 WeakPolarHBondContact CB-NE2 3.05Å; D338-H352 IonicContact OD2-CD2 2.87Å; D338-H352 IonicContact OD2-ND1 3.82Å; D338-H352 IonicContact OD2-NE2 3.77Å; D338-H352 PolarHBondContact OD2-NE2 2.72Å; H340-H352 AromaticContact CE1-CE1 2.88Å; H340-H352 PolarHBondContact CE1-CE1 3.22Å; H340-H352 AromaticContact CE1-ND1 3.41Å; H340-H352 PolarHBondContact CE1-ND1 2.94Å; H340-H352 AromaticContact CE1-NE2 3.71Å; H340-H352 AromaticContact ND1-CE1 3.36Å; H340-H352 PolarHBondContact ND1-CE1 2.9Å; H340-H352 AromaticContact ND1-ND1 3.55Å; H340-H352 AromaticContact ND1-NE2 3.9Å; H340-H352 AromaticContact NE2-CE1 3.58Å; V350-H352 HydrophobicContact CG1-CB 4.23Å
353	I	98.6	Very high	97.4	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.015	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	79.8	-179.4	-56	-175.5	0	0	0	107.3	V278 L279 L280 D281 L283 I290 L304 F327 L351 M384	V278-I353 HydrophobicContact CG1-CD1 3.43Å; V278-I353 VanDerWaalsContact CG1-CD1 3.43Å; V278-I353 HydrophobicContact CG1-CG1 4.04Å; L279-I353 WeakPolarHBondContact O-CA 3.44Å; L279-I353 WeakPolarHBondContact O-CB 3.1Å; L279-I353 PolarHBondContact O-N 3.49Å; L280-I353 HydrophobicContact CD1-CB 4.33Å; L280-I353 HydrophobicContact CD1-CD1 4.07Å; L280-I353 HydrophobicContact CG-CB 4.39Å; D281-I353 PolarHBondContact N-O 3.09Å; D281-I353 VanDerWaalsContact N-O 3.13Å; L283-I353 HydrophobicContact CD1-CG2 4.23Å; L283-I353 HydrophobicContact CD2-CG2 4.47Å; I290-I353 HydrophobicContact CD1-CG2 4.01Å; I290-I353 HydrophobicContact CG2-CG2 4.22Å; L304-I353 HydrophobicContact CD1-CD1 3.69Å; L304-I353 HydrophobicContact CD1-CG1 4.15Å; L304-I353 HydrophobicContact CD2-CD1 4.38Å; F327-I353 HydrophobicContact CE1-CG2 4.08Å; F327-I353 HydrophobicContact CZ-CG2 4.38Å; L351-I353 HydrophobicContact CG-CG1 4.44Å; I353-M384 HydrophobicContact CD1-CE 4.06Å; I353-M384 HydrophobicContact CD1-SD 3.65Å
354	I	98.3	Very high	97.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.3	-178.5	-173.3	176.3	0	0	0	111.1	D281 L282 V336 T356 F358	D281-I354 HydrophobicContact CB-CB 4.41Å; D281-I354 HydrophobicContact CB-CD1 4.38Å; D281-I354 HydrophobicContact CB-CG1 4.24Å; D281-I354 WeakPolarHBondContact O-CA 3.38Å; D281-I354 WeakPolarHBondContact OD2-CD1 3.45Å; L282-I354 HydrophobicContact CB-CG1 4.14Å; L282-I354 HydrophobicContact CD1-CD1 4.14Å; L282-I354 HydrophobicContact CD1-CG1 4.32Å; L282-I354 HydrophobicContact CG-CD1 4.28Å; L282-I354 HydrophobicContact CG-CG1 4.22Å; V336-I354 HydrophobicContact CG1-CD1 3.94Å; V336-I354 HydrophobicContact CG2-CD1 4.5Å; I354-T356 HydrophobicContact CG1-CG2 4.47Å; I354-T356 HydrophobicContact CG2-CG2 4.01Å; I354-T356 PolarHBondContact O-N 2.93Å; I354-F358 HydrophobicContact CD1-CD1 4.44Å; I354-F358 HydrophobicContact CD1-CE1 3.72Å; I354-F358 HydrophobicContact CD1-CZ 4.3Å; I354-F358 HydrophobicContact CG1-CE1 4.44Å
355	A	97.3	Very high	97.2	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.033	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-70.8	119	172.5	0	0	0	0	0	110.1	L282 P288 L289 P357 F358	L282-A355 VanDerWaalsContact O-CB 3.3Å; L282-A355 WeakPolarHBondContact O-CB 3.49Å; P288-A355 HydrophobicContact CB-CB 3.74Å; L289-A355 CarbonylContact O-C 3.56Å; L289-A355 WeakPolarHBondContact O-CA 3.16Å; A355-P357 CarbonylContact C-O 3.5Å; A355-P357 CarbonylContact O-C 3.5Å; A355-F358 WeakPolarHBondContact O-CD1 3.32Å
356	T	93.3	Very high	97.1	Very high	8 Å²	8	43 Å²	43	5%	0.049	23%	0.229	C	C	.	.	S	Bend	trans	-137.3	109.6	-176.7	39.2	0	0	0	0	110.2	L289 L333 V336 I354 F358	L289-T356 WeakPolarHBondContact CB-O 3.16Å; L289-T356 WeakPolarHBondContact CD2-O 3.39Å; L289-T356 VanDerWaalsContact CG-O 3.27Å; L289-T356 WeakPolarHBondContact CG-O 3.45Å; L289-T356 PolarHBondContact O-N 3.28Å; L333-T356 WeakPolarHBondContact CD1-O 3.11Å; L333-T356 WeakPolarHBondContact CD1-OG1 3.46Å; V336-T356 HydrophobicContact CG2-CG2 4.16Å; I354-T356 HydrophobicContact CG1-CG2 4.47Å; I354-T356 HydrophobicContact CG2-CG2 4.01Å; I354-T356 PolarHBondContact O-N 2.93Å; T356-F358 HydrophobicContact CG2-CD1 4.13Å; T356-F358 HydrophobicContact CG2-CE1 3.92Å
357	P	94.9	Very high	97.1	Very high	107 Å²	107	39.1 Å²	39.1	70%	0.695	21%	0.212	S	C	*	.	S	Bend	cis	-64.4	154.2	7.3	29.8	-37.4	0	0	0	113.6	A355	A355-P357 CarbonylContact C-O 3.5Å; A355-P357 CarbonylContact O-C 3.5Å
358	F	97.1	Very high	97.2	Very high	69 Å²	69	37.5 Å²	37.5	30%	0.303	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-60.5	156.1	179.5	-62	-7.7	0	0	0	111.4	L282 V336 I354 A355 T356 W362	L282-F358 HydrophobicContact CD1-CB 3.83Å; L282-F358 HydrophobicContact CD1-CD1 3.51Å; L282-F358 HydrophobicContact CD1-CD2 3.78Å; L282-F358 HydrophobicContact CD1-CE1 3.88Å; L282-F358 HydrophobicContact CD1-CE2 4.12Å; L282-F358 HydrophobicContact CD1-CG 3.44Å; L282-F358 VanDerWaalsContact CD1-CG 3.44Å; L282-F358 HydrophobicContact CD1-CZ 4.16Å; V336-F358 HydrophobicContact CG1-CE1 4.36Å; V336-F358 HydrophobicContact CG1-CZ 3.95Å; V336-F358 HydrophobicContact CG2-CE1 4.13Å; V336-F358 HydrophobicContact CG2-CZ 4.29Å; I354-F358 HydrophobicContact CD1-CD1 4.44Å; I354-F358 HydrophobicContact CD1-CE1 3.72Å; I354-F358 HydrophobicContact CD1-CZ 4.3Å; I354-F358 HydrophobicContact CG1-CE1 4.44Å; A355-F358 WeakPolarHBondContact O-CD1 3.32Å; T356-F358 HydrophobicContact CG2-CD1 4.13Å; T356-F358 HydrophobicContact CG2-CE1 3.92Å; F358-W362 HydrophobicContact CB-CB 4.22Å; F358-W362 HydrophobicContact CB-CD2 4.4Å; F358-W362 HydrophobicContact CB-CG 4.22Å; F358-W362 AromaticContact CD2-CD2 3.56Å; F358-W362 HydrophobicContact CD2-CD2 3.56Å; F358-W362 AromaticContact CD2-CE2 3.58Å; F358-W362 AromaticContact CD2-CE3 3.78Å; F358-W362 HydrophobicContact CD2-CE3 3.78Å; F358-W362 HydrophobicContact CD2-CG 4.1Å; F358-W362 AromaticContact CD2-CH2 3.98Å; F358-W362 HydrophobicContact CD2-CH2 3.98Å; F358-W362 AromaticContact CD2-CZ2 3.78Å; F358-W362 HydrophobicContact CD2-CZ2 3.78Å; F358-W362 AromaticContact CD2-CZ3 3.99Å; F358-W362 HydrophobicContact CD2-CZ3 3.99Å; F358-W362 HydrophobicContact CE2-CD2 4.25Å; F358-W362 AromaticContact CE2-CE2 3.8Å; F358-W362 HydrophobicContact CE2-CE3 4.49Å; F358-W362 AromaticContact CE2-CH2 3.87Å; F358-W362 HydrophobicContact CE2-CH2 3.87Å; F358-W362 AromaticContact CE2-CZ2 3.58Å; F358-W362 HydrophobicContact CE2-CZ2 3.58Å; F358-W362 HydrophobicContact CE2-CZ3 4.33Å; F358-W362 HydrophobicContact CG-CD2 4.42Å
359	P	96.5	Very high	97.2	Very high	20 Å²	20	39 Å²	39	13%	0.13	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-54	144.6	174.8	-25	34.3	0	0	0	112.5	L282 F361 W362	L282-P359 HydrophobicContact CB-CG 4.13Å; P359-F361 HydrophobicContact CB-CD2 3.77Å; P359-F361 HydrophobicContact CB-CE1 4.34Å; P359-F361 HydrophobicContact CB-CE2 3.31Å; P359-F361 HydrophobicContact CB-CG 4.45Å; P359-F361 HydrophobicContact CB-CZ 3.65Å; P359-F361 HydrophobicContact CG-CE2 4.13Å; P359-F361 PolarHBondContact O-N 3.01Å; P359-W362 WeakPolarHBondContact O-CB 3.11Å; P359-W362 PolarHBondContact O-N 2.74Å
360	Q	97	Very high	97.2	Very high	203 Å²	203	45.4 Å²	45.4	95%	0.949	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.2	-175.1	-66	-175	-1.6	0	0	114.3
361	F	96.6	Very high	97.2	Very high	25 Å²	25	49 Å²	49	11%	0.11	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	2.4	178	45.3	-111.9	0	0	0	113.6	P359 H363 T364 D366 D367 N371 M372	P359-F361 HydrophobicContact CB-CD2 3.77Å; P359-F361 HydrophobicContact CB-CE1 4.34Å; P359-F361 HydrophobicContact CB-CE2 3.31Å; P359-F361 HydrophobicContact CB-CG 4.45Å; P359-F361 HydrophobicContact CB-CZ 3.65Å; P359-F361 HydrophobicContact CG-CE2 4.13Å; P359-F361 PolarHBondContact O-N 3.01Å; F361-H363 PolarHBondContact O-N 3.02Å; F361-T364 WeakPolarHBondContact CA-OG1 3.21Å; F361-T364 WeakPolarHBondContact O-CB 3.34Å; F361-T364 PolarHBondContact O-N 3.3Å; F361-T364 PolarHBondContact O-OG1 3.39Å; F361-D366 HydrophobicContact CB-CB 4.29Å; F361-D367 HydrophobicContact CB-CB 4.48Å; F361-D367 HydrophobicContact CD2-CB 3.71Å; F361-D367 HydrophobicContact CE2-CB 4.44Å; F361-D367 WeakPolarHBondContact CE2-OD1 3.09Å; F361-D367 HydrophobicContact CG-CB 4.45Å; F361-N371 HydrophobicContact CD1-CB 3.87Å; F361-N371 HydrophobicContact CE1-CB 3.87Å; F361-M372 HydrophobicContact CD2-CE 4.36Å; F361-M372 HydrophobicContact CE1-CE 4.23Å; F361-M372 HydrophobicContact CE2-CE 3.46Å; F361-M372 VanDerWaalsContact CE2-CE 3.46Å; F361-M372 HydrophobicContact CZ-CE 3.37Å
362	W	97.8	Very high	97.2	Very high	82 Å²	82	49.5 Å²	49.5	31%	0.311	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	135.9	178.3	173.5	70.9	0	0	0	112.1	D195 L282 F358 P359 T364	D195-W362 VanDerWaalsContact OD2-CD1 3.26Å; L282-W362 HydrophobicContact CD1-CG 4.25Å; L282-W362 VanDerWaalsContact CD2-CD1 3.45Å; F358-W362 HydrophobicContact CB-CB 4.22Å; F358-W362 HydrophobicContact CB-CD2 4.4Å; F358-W362 HydrophobicContact CB-CG 4.22Å; F358-W362 AromaticContact CD2-CD2 3.56Å; F358-W362 HydrophobicContact CD2-CD2 3.56Å; F358-W362 AromaticContact CD2-CE2 3.58Å; F358-W362 AromaticContact CD2-CE3 3.78Å; F358-W362 HydrophobicContact CD2-CE3 3.78Å; F358-W362 HydrophobicContact CD2-CG 4.1Å; F358-W362 AromaticContact CD2-CH2 3.98Å; F358-W362 HydrophobicContact CD2-CH2 3.98Å; F358-W362 AromaticContact CD2-CZ2 3.78Å; F358-W362 HydrophobicContact CD2-CZ2 3.78Å; F358-W362 AromaticContact CD2-CZ3 3.99Å; F358-W362 HydrophobicContact CD2-CZ3 3.99Å; F358-W362 HydrophobicContact CE2-CD2 4.25Å; F358-W362 AromaticContact CE2-CE2 3.8Å; F358-W362 HydrophobicContact CE2-CE3 4.49Å; F358-W362 AromaticContact CE2-CH2 3.87Å; F358-W362 HydrophobicContact CE2-CH2 3.87Å; F358-W362 AromaticContact CE2-CZ2 3.58Å; F358-W362 HydrophobicContact CE2-CZ2 3.58Å; F358-W362 HydrophobicContact CE2-CZ3 4.33Å; F358-W362 HydrophobicContact CG-CD2 4.42Å; P359-W362 WeakPolarHBondContact O-CB 3.11Å; P359-W362 PolarHBondContact O-N 2.74Å; W362-T364 PolarHBondContact O-N 3.35Å; W362-T364 VanDerWaalsContact O-N 3.17Å
363	H	96.6	Very high	97.2	Very high	66 Å²	66	51.8 Å²	51.8	31%	0.306	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	28.5	-172.6	-68.8	-172.9	0	0	0	114.7	L179 D195 E235 F361	L179-H363 WeakPolarHBondContact CD1-O 3.12Å; D195-H363 IonicContact OD2-CD2 3.88Å; D195-H363 PolarHBondContact OD2-CD2 3.44Å; E235-H363 IonicContact OE1-CD2 2.74Å; E235-H363 IonicContact OE1-NE2 2.7Å; E235-H363 IonicContact OE2-NE2 3.61Å; F361-H363 PolarHBondContact O-N 3.02Å
364	T	96.5	Very high	97.2	Very high	50 Å²	50	56.9 Å²	56.9	31%	0.307	28%	0.279	S	S	.	.	S	Bend	trans	-119.7	157.9	171.6	78.3	0	0	0	0	111.6	F190 F361 W362 D366 D367	F190-T364 VanDerWaalsContact CD2-O 3.23Å; F190-T364 WeakPolarHBondContact CD2-O 3.36Å; F190-T364 WeakPolarHBondContact CE2-O 3.44Å; F361-T364 WeakPolarHBondContact CA-OG1 3.21Å; F361-T364 WeakPolarHBondContact O-CB 3.34Å; F361-T364 PolarHBondContact O-N 3.3Å; F361-T364 PolarHBondContact O-OG1 3.39Å; W362-T364 PolarHBondContact O-N 3.35Å; W362-T364 VanDerWaalsContact O-N 3.17Å; T364-D366 PolarHBondContact O-N 2.99Å; T364-D366 PolarHBondContact OG1-N 3.11Å; T364-D367 PolarHBondContact O-N 3.37Å; T364-D367 VanDerWaalsContact O-N 3.16Å
365	L	96.1	Very high	97.2	Very high	24 Å²	24	58 Å²	58	13%	0.126	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-5.8	173.2	-61	177.7	0	0	0	113.6	L179 D182 R188 F190 T368	L179-L365 HydrophobicContact CD1-CD2 4.23Å; D182-L365 HydrophobicContact CB-CD1 3.9Å; R188-L365 HydrophobicContact CB-CD1 4.13Å; R188-L365 VanDerWaalsContact NH2-C 3.25Å; R188-L365 PolarHBondContact NH2-O 3.49Å; F190-L365 HydrophobicContact CB-CD2 4.22Å; L365-T368 VanDerWaalsContact O-CG2 3.3Å; L365-T368 WeakPolarHBondContact O-CG2 3.47Å
366	D	96.5	Very high	97.2	Very high	78 Å²	78	57.8 Å²	57.8	42%	0.417	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	2.1	177.6	-58.2	-29.2	0	0	0	112.8	R188 F361 T364 T368 N371	R188-D366 IonicContact CZ-OD1 3.73Å; R188-D366 IonicContact NH1-OD1 2.91Å; R188-D366 PolarHBondContact NH1-OD1 2.9Å; R188-D366 IonicContact NH2-OD1 3.23Å; R188-D366 PolarHBondContact NH2-OD1 3.46Å; F361-D366 HydrophobicContact CB-CB 4.29Å; T364-D366 PolarHBondContact O-N 2.99Å; T364-D366 PolarHBondContact OG1-N 3.11Å; D366-T368 VanDerWaalsContact C-N 3.26Å; D366-T368 PolarHBondContact O-N 3.1Å; D366-N371 PolarHBondContact O-ND2 2.79Å
367	D	98.2	Very high	97.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.283	C	S	.	.			trans	-77.6	76.3	166.8	-166.9	2.1	0	0	0	111.1	F190 G192 A193 S194 D195 F361 T364 M372	F190-D367 HydrophobicContact CE2-CB 3.98Å; G192-D367 PolarHBondContact N-O 3.45Å; A193-D367 WeakPolarHBondContact CB-O 3.25Å; A193-D367 WeakPolarHBondContact CB-OD1 3.44Å; A193-D367 VanDerWaalsContact N-CG 3.3Å; A193-D367 PolarHBondContact N-O 3.49Å; A193-D367 VanDerWaalsContact N-O 3.14Å; A193-D367 PolarHBondContact N-OD1 2.89Å; A193-D367 PolarHBondContact N-OD2 3.43Å; S194-D367 PolarHBondContact N-OD1 2.62Å; S194-D367 PolarHBondContact N-OD2 3.08Å; S194-D367 VanDerWaalsContact N-OD2 3.13Å; S194-D367 PolarHBondContact OG-OD1 3.08Å; S194-D367 PolarHBondContact OG-OD2 3.23Å; D195-D367 VanDerWaalsContact CB-OD2 3.29Å; D195-D367 WeakPolarHBondContact CB-OD2 3.48Å; F361-D367 HydrophobicContact CB-CB 4.48Å; F361-D367 HydrophobicContact CD2-CB 3.71Å; F361-D367 HydrophobicContact CE2-CB 4.44Å; F361-D367 WeakPolarHBondContact CE2-OD1 3.09Å; F361-D367 HydrophobicContact CG-CB 4.45Å; T364-D367 PolarHBondContact O-N 3.37Å; T364-D367 VanDerWaalsContact O-N 3.16Å; D367-M372 WeakPolarHBondContact OD1-CE 3.01Å
368	T	98	Very high	97.7	Very high	18 Å²	18	54.5 Å²	54.5	11%	0.11	26%	0.259	C	S	.	.	S	Bend	trans	-129.3	172.6	-173.5	70.7	0	0	0	0	112.1	L191 L365 D366 E370 N371	L191-T368 HydrophobicContact CD1-CG2 4.24Å; L365-T368 VanDerWaalsContact O-CG2 3.3Å; L365-T368 WeakPolarHBondContact O-CG2 3.47Å; D366-T368 VanDerWaalsContact C-N 3.26Å; D366-T368 PolarHBondContact O-N 3.1Å; T368-E370 WeakPolarHBondContact CB-OE2 3.16Å; T368-E370 PolarHBondContact O-N 3Å; T368-E370 VanDerWaalsContact O-N 3.14Å; T368-E370 PolarHBondContact OG1-OE2 2.83Å; T368-N371 PolarHBondContact O-N 2.86Å
369	E	98.4	Very high	97.8	Very high	36 Å²	36	51.2 Å²	51.2	17%	0.168	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-53.3	-37.6	-177.9	-158.7	-165.6	127.9	0	0	113	W99 R104 L107 N371 M372 R374	W99-E369 HydrophobicContact CZ2-CG 3.76Å; W99-E369 PolarHBondContact NE1-OE1 3.35Å; R104-E369 IonicContact CZ-OE1 3.78Å; R104-E369 IonicContact CZ-OE2 3.75Å; R104-E369 IonicContact NE-OE1 2.65Å; R104-E369 PolarHBondContact NE-OE1 2.92Å; R104-E369 IonicContact NE-OE2 3.35Å; R104-E369 PolarHBondContact NE-OE2 3.13Å; R104-E369 IonicContact NH2-OE1 3.47Å; R104-E369 PolarHBondContact NH2-OE1 2.91Å; R104-E369 IonicContact NH2-OE2 2.67Å; R104-E369 PolarHBondContact NH2-OE2 2.87Å; R104-E369 VanDerWaalsContact NH2-OE2 3.16Å; L107-E369 HydrophobicContact CD1-CB 3.8Å; L107-E369 HydrophobicContact CD1-CG 3.82Å; E369-N371 VanDerWaalsContact C-N 3.27Å; E369-N371 PolarHBondContact O-N 3.4Å; E369-M372 PolarHBondContact O-N 3.11Å; E369-R374 IonicContact OE1-NH2 2.88Å; E369-R374 PolarHBondContact OE1-NH2 3.32Å
370	E	97.9	Very high	97.9	Very high	154 Å²	154	50.4 Å²	50.4	72%	0.72	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-64.8	-29	-174.4	-63.7	72.7	-159	0	0	113	T368	T368-E370 WeakPolarHBondContact CB-OE2 3.16Å; T368-E370 PolarHBondContact O-N 3Å; T368-E370 VanDerWaalsContact O-N 3.14Å; T368-E370 PolarHBondContact OG1-OE2 2.83Å
371	N	98.1	Very high	98	Very high	76 Å²	76	40.7 Å²	40.7	41%	0.406	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-94.7	-2.5	-179.5	-73.6	-39.5	0	0	0	113.3	F361 D366 T368 E369	F361-N371 HydrophobicContact CD1-CB 3.87Å; F361-N371 HydrophobicContact CE1-CB 3.87Å; D366-N371 PolarHBondContact O-ND2 2.79Å; T368-N371 PolarHBondContact O-N 2.86Å; E369-N371 VanDerWaalsContact C-N 3.27Å; E369-N371 PolarHBondContact O-N 3.4Å
372	M	98.6	Very high	98.1	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.059	19%	0.193	C	C	.	.			trans	-79.9	121.9	177.4	-62.6	-60.8	101.9	0	0	111.9	W99 A193 V198 F361 D367 E369 R374	W99-M372 HydrophobicContact CH2-CB 3.46Å; W99-M372 VanDerWaalsContact CH2-CB 3.46Å; W99-M372 HydrophobicContact CH2-CG 4.41Å; W99-M372 HydrophobicContact CZ2-CB 3.93Å; A193-M372 HydrophobicContact CB-CE 3.89Å; A193-M372 HydrophobicContact CB-CG 3.85Å; A193-M372 HydrophobicContact CB-SD 3.84Å; V198-M372 HydrophobicContact CG2-CG 4.24Å; V198-M372 HydrophobicContact CG2-SD 3.93Å; F361-M372 HydrophobicContact CD2-CE 4.36Å; F361-M372 HydrophobicContact CE1-CE 4.23Å; F361-M372 HydrophobicContact CE2-CE 3.46Å; F361-M372 VanDerWaalsContact CE2-CE 3.46Å; F361-M372 HydrophobicContact CZ-CE 3.37Å; D367-M372 WeakPolarHBondContact OD1-CE 3.01Å; E369-M372 PolarHBondContact O-N 3.11Å; M372-R374 PolarHBondContact O-N 3.17Å
373	H	98.6	Very high	98.2	Very high	53 Å²	53	36.4 Å²	36.4	25%	0.245	18%	0.178	C	C	.	.			trans	-80.9	88.1	179.2	-173.2	-120.8	0	0	0	111.1	G284 P286 P375 T376 V377	G284-H373 PolarHBondContact O-N 2.85Å; P286-H373 HydrophobicContact CB-CB 4.03Å; H373-P375 VanDerWaalsContact C-CD 3.4Å; H373-P375 VanDerWaalsContact C-N 3.29Å; H373-T376 PolarHBondContact ND1-N 3.44Å; H373-T376 PolarHBondContact ND1-OG1 3.28Å; H373-T376 WeakPolarHBondContact O-CB 3.32Å; H373-T376 PolarHBondContact O-N 3.25Å; H373-V377 PolarHBondContact O-N 3.03Å
374	R	98.4	Very high	98.3	Very high	109 Å²	109	33.4 Å²	33.4	41%	0.411	16%	0.164	S	C	.	.	H	α-helix	trans	-36.6	-47.5	178.1	-73.7	174.4	-176.9	-112	8.5	114.5	W99 E100 E369 M372 T376 V377 E378	W99-R374 VanDerWaalsContact CD1-CZ 3.45Å; W99-R374 HydrophobicContact CD2-CG 4.1Å; W99-R374 HydrophobicContact CE3-CG 3.8Å; W99-R374 VanDerWaalsContact CG-NH1 3.28Å; W99-R374 HydrophobicContact CH2-CB 4.28Å; W99-R374 HydrophobicContact CH2-CG 3.28Å; W99-R374 HydrophobicContact CZ2-CG 3.66Å; W99-R374 HydrophobicContact CZ3-CB 4.15Å; W99-R374 HydrophobicContact CZ3-CG 3.41Å; W99-R374 VanDerWaalsContact CZ3-CG 3.41Å; W99-R374 VanDerWaalsContact NE1-CZ 3.26Å; E100-R374 IonicContact OE1-NH1 3.98Å; E369-R374 IonicContact OE1-NH2 2.88Å; E369-R374 PolarHBondContact OE1-NH2 3.32Å; M372-R374 PolarHBondContact O-N 3.17Å; R374-T376 PolarHBondContact O-N 2.63Å; R374-V377 PolarHBondContact O-N 2.94Å; R374-E378 PolarHBondContact O-N 3.34Å; R374-E378 VanDerWaalsContact O-N 3.11Å
375	P	98.6	Very high	98.4	Very high	24 Å²	24	31 Å²	31	16%	0.156	15%	0.149	C	C	.	.	H	α-helix	trans	-61.8	-38.7	176.6	-24	35.2	0	0	0	114.8	M318 H373 N379	M318-P375 HydrophobicContact CB-CB 4Å; H373-P375 VanDerWaalsContact C-CD 3.4Å; H373-P375 VanDerWaalsContact C-N 3.29Å; P375-N379 VanDerWaalsContact O-CB 3.27Å; P375-N379 WeakPolarHBondContact O-CB 3.3Å; P375-N379 PolarHBondContact O-N 3.21Å; P375-N379 PolarHBondContact O-ND2 2.99Å; P375-N379 PolarHBondContact O-OD1 3.23Å
376	T	98.8	Very high	98.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-47.8	175.1	-63.1	0	0	0	0	110.2	G285 P288 Y326 H373 R374 E378 N379 L380	G285-T376 WeakPolarHBondContact O-CB 3.47Å; G285-T376 WeakPolarHBondContact O-CG2 3.3Å; G285-T376 PolarHBondContact O-OG1 2.72Å; P288-T376 HydrophobicContact CG-CG2 3.71Å; Y326-T376 HydrophobicContact CE1-CG2 4.39Å; H373-T376 PolarHBondContact ND1-N 3.44Å; H373-T376 PolarHBondContact ND1-OG1 3.28Å; H373-T376 WeakPolarHBondContact O-CB 3.32Å; H373-T376 PolarHBondContact O-N 3.25Å; R374-T376 PolarHBondContact O-N 2.63Å; T376-E378 PolarHBondContact O-N 3.13Å; T376-N379 WeakPolarHBondContact O-CB 3.24Å; T376-N379 PolarHBondContact O-N 2.78Å; T376-L380 HydrophobicContact CG2-CD1 3.69Å; T376-L380 HydrophobicContact CG2-CG 4.04Å; T376-L380 WeakPolarHBondContact O-CG 3.35Å; T376-L380 PolarHBondContact O-N 3.16Å
377	V	98.9	Very high	98.6	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-46.5	-176.5	-179.5	0	0	0	0	111	L98 W99 V198 M202 H373 R374 T381	L98-V377 HydrophobicContact CD1-CG1 3.93Å; L98-V377 HydrophobicContact CD2-CG1 3.72Å; W99-V377 HydrophobicContact CZ3-CB 4.25Å; W99-V377 HydrophobicContact CZ3-CG1 4.4Å; W99-V377 HydrophobicContact CZ3-CG2 4.14Å; V198-V377 HydrophobicContact CG1-CB 4.44Å; V198-V377 HydrophobicContact CG1-CG1 3.79Å; V198-V377 HydrophobicContact CG1-CG2 3.84Å; V198-V377 HydrophobicContact CG2-CG2 4.41Å; M202-V377 HydrophobicContact CG-CG1 4.19Å; H373-V377 PolarHBondContact O-N 3.03Å; R374-V377 PolarHBondContact O-N 2.94Å; V377-T381 WeakPolarHBondContact O-CB 3.41Å; V377-T381 PolarHBondContact O-N 3.24Å; V377-T381 PolarHBondContact O-OG1 3.05Å
378	E	98.8	Very high	98.7	Very high	44 Å²	44	26.4 Å²	26.4	21%	0.206	12%	0.124	C	C	.	.	H	α-helix	trans	-66	-39.4	176.7	-161.8	-174.5	115.1	0	0	111.9	V93 R374 T376 T381 K382	V93-E378 HydrophobicContact CG1-CG 4.16Å; R374-E378 PolarHBondContact O-N 3.34Å; R374-E378 VanDerWaalsContact O-N 3.11Å; T376-E378 PolarHBondContact O-N 3.13Å; E378-T381 PolarHBondContact O-N 3.09Å; E378-K382 HydrophobicContact CG-CD 4.5Å; E378-K382 VanDerWaalsContact O-CG 3.3Å; E378-K382 WeakPolarHBondContact O-CG 3.33Å; E378-K382 PolarHBondContact O-N 3.5Å; E378-K382 VanDerWaalsContact OE1-CE 3.24Å; E378-K382 WeakPolarHBondContact OE1-CE 3.34Å; E378-K382 IonicContact OE1-NZ 3.49Å; E378-K382 PolarHBondContact OE1-NZ 2.87Å
379	N	98.9	Very high	98.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.2	-49.2	176.3	-72.7	-12.4	0	0	0	112.6	L317 M318 Y326 P375 T376 T381 K382 I383	L317-N379 WeakPolarHBondContact CA-OD1 3.28Å; L317-N379 HydrophobicContact CD2-CB 3.9Å; M318-N379 PolarHBondContact N-OD1 2.81Å; M318-N379 PolarHBondContact O-ND2 2.95Å; Y326-N379 HydrophobicContact CE2-CB 3.94Å; Y326-N379 PolarHBondContact OH-ND2 2.95Å; P375-N379 VanDerWaalsContact O-CB 3.27Å; P375-N379 WeakPolarHBondContact O-CB 3.3Å; P375-N379 PolarHBondContact O-N 3.21Å; P375-N379 PolarHBondContact O-ND2 2.99Å; P375-N379 PolarHBondContact O-OD1 3.23Å; T376-N379 WeakPolarHBondContact O-CB 3.24Å; T376-N379 PolarHBondContact O-N 2.78Å; N379-T381 VanDerWaalsContact C-N 3.3Å; N379-T381 PolarHBondContact O-N 3.27Å; N379-K382 PolarHBondContact O-N 2.69Å; N379-I383 VanDerWaalsContact O-CG1 3.31Å; N379-I383 WeakPolarHBondContact O-CG1 3.11Å; N379-I383 PolarHBondContact O-N 2.96Å
380	L	98.9	Very high	98.7	Very high	3 Å²	3	24 Å²	24	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-63.1	-39.7	178.6	-67.9	176.8	0	0	0	110.6	M202 L283 P288 I290 Y326 F327 T376 K382 I383 M384	M202-L380 HydrophobicContact CE-CB 3.64Å; L283-L380 HydrophobicContact CB-CD1 4.39Å; L283-L380 HydrophobicContact CD1-CD1 4.37Å; L283-L380 HydrophobicContact CD2-CD1 4.25Å; P288-L380 HydrophobicContact CG-CD1 4.28Å; I290-L380 HydrophobicContact CD1-CD2 4.1Å; Y326-L380 HydrophobicContact CD2-CD2 3.75Å; Y326-L380 HydrophobicContact CE2-CD2 4.25Å; Y326-L380 HydrophobicContact CG-CD2 4.17Å; F327-L380 HydrophobicContact CE2-CD2 3.9Å; F327-L380 HydrophobicContact CZ-CD2 4.01Å; T376-L380 HydrophobicContact CG2-CD1 3.69Å; T376-L380 HydrophobicContact CG2-CG 4.04Å; T376-L380 WeakPolarHBondContact O-CG 3.35Å; T376-L380 PolarHBondContact O-N 3.16Å; L380-K382 PolarHBondContact O-N 2.88Å; L380-I383 PolarHBondContact O-N 3.01Å; L380-M384 WeakPolarHBondContact O-CG 3.16Å; L380-M384 PolarHBondContact O-N 3.01Å
381	T	98.9	Very high	98.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.4	-43.6	174.5	-52.4	0	0	0	0	111.6	V93 L98 M202 E205 L206 V377 E378 N379 I383 M384 A385	V93-T381 HydrophobicContact CG1-CG2 3.64Å; V93-T381 HydrophobicContact CG2-CG2 4.06Å; L98-T381 HydrophobicContact CD1-CG2 4.17Å; L98-T381 WeakPolarHBondContact CD1-OG1 3.33Å; M202-T381 WeakPolarHBondContact CG-OG1 3.14Å; E205-T381 HydrophobicContact CB-CG2 4.41Å; E205-T381 HydrophobicContact CG-CG2 3.9Å; L206-T381 HydrophobicContact CD2-CG2 4.19Å; L206-T381 HydrophobicContact CG-CG2 4.17Å; V377-T381 WeakPolarHBondContact O-CB 3.41Å; V377-T381 PolarHBondContact O-N 3.24Å; V377-T381 PolarHBondContact O-OG1 3.05Å; E378-T381 PolarHBondContact O-N 3.09Å; N379-T381 VanDerWaalsContact C-N 3.3Å; N379-T381 PolarHBondContact O-N 3.27Å; T381-I383 PolarHBondContact O-N 2.7Å; T381-M384 PolarHBondContact O-N 3.45Å; T381-A385 WeakPolarHBondContact O-CB 3.44Å; T381-A385 PolarHBondContact O-N 2.69Å
382	K	98.9	Very high	98.7	Very high	17 Å²	17	13.7 Å²	13.7	7%	0.074	6%	0.062	C	C	.	.	H	α-helix	trans	-62.9	-39.3	173.9	-71.7	166.2	176.4	166.5	0	112.8	A90 V93 L311 L316 E378 N379 L380 A385 V386	A90-K382 HydrophobicContact CB-CD 4.35Å; A90-K382 HydrophobicContact CB-CG 4.28Å; A90-K382 WeakPolarHBondContact O-CE 3.27Å; V93-K382 HydrophobicContact CB-CG 3.99Å; V93-K382 HydrophobicContact CG1-CG 4.19Å; V93-K382 HydrophobicContact CG2-CG 4.01Å; L311-K382 HydrophobicContact CD1-CB 4.13Å; L311-K382 HydrophobicContact CD2-CB 4.43Å; L316-K382 WeakPolarHBondContact O-CD 3.39Å; L316-K382 PolarHBondContact O-NZ 3.06Å; L316-K382 VanDerWaalsContact O-NZ 3.12Å; E378-K382 HydrophobicContact CG-CD 4.5Å; E378-K382 VanDerWaalsContact O-CG 3.3Å; E378-K382 WeakPolarHBondContact O-CG 3.33Å; E378-K382 PolarHBondContact O-N 3.5Å; E378-K382 VanDerWaalsContact OE1-CE 3.24Å; E378-K382 WeakPolarHBondContact OE1-CE 3.34Å; E378-K382 IonicContact OE1-NZ 3.49Å; E378-K382 PolarHBondContact OE1-NZ 2.87Å; N379-K382 PolarHBondContact O-N 2.69Å; L380-K382 PolarHBondContact O-N 2.88Å; K382-A385 PolarHBondContact O-N 3.11Å; K382-V386 WeakPolarHBondContact O-CG2 3.48Å; K382-V386 PolarHBondContact O-N 3.21Å; K382-V386 VanDerWaalsContact O-N 3.15Å
383	I	98.9	Very high	98.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-63.3	-45	175.4	-69.9	163.8	0	0	0	110.2	L304 A307 E308 L311 L317 Y326 F327 N379 L380 T381 V386 F387	L304-I383 HydrophobicContact CD2-CG2 4.13Å; A307-I383 HydrophobicContact CB-CG2 4.09Å; E308-I383 HydrophobicContact CB-CD1 3.85Å; E308-I383 HydrophobicContact CB-CG1 4.28Å; E308-I383 HydrophobicContact CG-CD1 4.02Å; L311-I383 HydrophobicContact CD1-CB 4.29Å; L311-I383 HydrophobicContact CD1-CG1 3.6Å; L317-I383 HydrophobicContact CD1-CD1 4.41Å; Y326-I383 HydrophobicContact CD2-CD1 4.04Å; Y326-I383 HydrophobicContact CE2-CD1 4.35Å; F327-I383 HydrophobicContact CE2-CD1 4.03Å; F327-I383 HydrophobicContact CE2-CG2 3.81Å; F327-I383 HydrophobicContact CZ-CG2 4.31Å; N379-I383 VanDerWaalsContact O-CG1 3.31Å; N379-I383 WeakPolarHBondContact O-CG1 3.11Å; N379-I383 PolarHBondContact O-N 2.96Å; L380-I383 PolarHBondContact O-N 3.01Å; T381-I383 PolarHBondContact O-N 2.7Å; I383-V386 PolarHBondContact O-N 3.28Å; I383-F387 PolarHBondContact O-N 3.15Å
384	M	98.9	Very high	98.4	Very high	3 Å²	3	13.8 Å²	13.8	2%	0.015	7%	0.07	C	C	.	.	H	α-helix	trans	-66.4	-36.1	176.4	-69.6	-54.5	-62.6	0	0	113	L170 L206 V278 L280 L304 I353 L380 T381 V386 F387 L388	L170-M384 HydrophobicContact CD1-CE 3.88Å; L206-M384 HydrophobicContact CD1-CB 3.63Å; L206-M384 HydrophobicContact CD1-CG 4.46Å; L206-M384 HydrophobicContact CD2-CB 3.95Å; L206-M384 HydrophobicContact CG-CB 4.42Å; V278-M384 HydrophobicContact CG1-CE 4.09Å; L280-M384 HydrophobicContact CD1-CE 4.24Å; L304-M384 HydrophobicContact CD2-SD 3.71Å; I353-M384 HydrophobicContact CD1-CE 4.06Å; I353-M384 HydrophobicContact CD1-SD 3.65Å; L380-M384 WeakPolarHBondContact O-CG 3.16Å; L380-M384 PolarHBondContact O-N 3.01Å; T381-M384 PolarHBondContact O-N 3.45Å; M384-V386 VanDerWaalsContact C-N 3.33Å; M384-V386 PolarHBondContact O-N 2.87Å; M384-F387 HydrophobicContact CE-CD1 4.12Å; M384-F387 WeakPolarHBondContact O-CB 3.41Å; M384-F387 PolarHBondContact O-N 2.81Å; M384-L388 WeakPolarHBondContact O-CG 3.48Å; M384-L388 PolarHBondContact O-N 3.34Å
385	A	98.9	Very high	98.4	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.6	-39.8	174.7	0	0	0	0	0	111.9	V93 L206 T381 K382 A389	V93-A385 HydrophobicContact CG2-CB 4.09Å; L206-A385 HydrophobicContact CD2-CB 3.77Å; L206-A385 VanDerWaalsContact CD2-N 3.34Å; T381-A385 WeakPolarHBondContact O-CB 3.44Å; T381-A385 PolarHBondContact O-N 2.69Å; K382-A385 PolarHBondContact O-N 3.11Å; A385-A389 WeakPolarHBondContact O-CB 3.49Å; A385-A389 PolarHBondContact O-N 2.77Å; A385-A389 VanDerWaalsContact O-N 3.1Å
386	V	98.9	Very high	98.4	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-69	-40.3	172.5	175.8	0	0	0	0	111.3	I86 L89 A307 L311 K382 I383 M384 A389 E390	I86-V386 HydrophobicContact CD1-CG1 4.1Å; I86-V386 HydrophobicContact CG1-CG1 4.15Å; I86-V386 HydrophobicContact CG1-CG2 4.09Å; I86-V386 HydrophobicContact CG2-CG2 4.27Å; L89-V386 HydrophobicContact CB-CG2 4.46Å; L89-V386 HydrophobicContact CD1-CG2 4.37Å; A307-V386 HydrophobicContact CB-CB 3.94Å; A307-V386 HydrophobicContact CB-CG1 3.68Å; L311-V386 HydrophobicContact CD1-CG2 4.14Å; L311-V386 HydrophobicContact CD2-CG2 4.25Å; L311-V386 HydrophobicContact CG-CG2 4.39Å; K382-V386 WeakPolarHBondContact O-CG2 3.48Å; K382-V386 PolarHBondContact O-N 3.21Å; K382-V386 VanDerWaalsContact O-N 3.15Å; I383-V386 PolarHBondContact O-N 3.28Å; M384-V386 VanDerWaalsContact C-N 3.33Å; M384-V386 PolarHBondContact O-N 2.87Å; V386-A389 PolarHBondContact O-N 3.02Å; V386-E390 WeakPolarHBondContact O-CG 3.35Å; V386-E390 PolarHBondContact O-N 3.11Å
387	F	98.9	Very high	98.3	Very high	2 Å²	2	8.7 Å²	8.7	1%	0.009	5%	0.05	C	C	.	.	H	α-helix	trans	-60.8	-48.3	176.2	178.1	-90	0	0	0	112.3	L276 V278 W300 R303 L304 L351 I383 M384 E390 Y391	L276-F387 HydrophobicContact CD2-CZ 4.07Å; V278-F387 HydrophobicContact CG2-CE1 4.06Å; V278-F387 HydrophobicContact CG2-CZ 4.3Å; W300-F387 HydrophobicContact CB-CE2 4.09Å; W300-F387 HydrophobicContact CB-CZ 4.3Å; W300-F387 HydrophobicContact CE3-CE2 4.39Å; R303-F387 HydrophobicContact CB-CD2 3.99Å; R303-F387 HydrophobicContact CB-CE2 4.21Å; L304-F387 HydrophobicContact CD2-CB 3.91Å; L304-F387 HydrophobicContact CD2-CD2 3.58Å; L304-F387 HydrophobicContact CD2-CE2 4.29Å; L304-F387 HydrophobicContact CD2-CG 3.82Å; L304-F387 HydrophobicContact CG-CD2 3.99Å; L304-F387 HydrophobicContact CG-CE2 4.35Å; L351-F387 HydrophobicContact CD2-CE2 4.09Å; L351-F387 HydrophobicContact CD2-CZ 3.9Å; I383-F387 PolarHBondContact O-N 3.15Å; M384-F387 HydrophobicContact CE-CD1 4.12Å; M384-F387 WeakPolarHBondContact O-CB 3.41Å; M384-F387 PolarHBondContact O-N 2.81Å; F387-E390 PolarHBondContact O-N 2.8Å; F387-Y391 HydrophobicContact CE1-CD2 4.27Å; F387-Y391 HydrophobicContact CZ-CD2 4.08Å; F387-Y391 WeakPolarHBondContact O-CB 3.38Å; F387-Y391 PolarHBondContact O-N 3.17Å
388	L	98.8	Very high	98.3	Very high	2 Å²	2	9.1 Å²	9.1	1%	0.01	5%	0.053	C	C	.	.	H	α-helix	trans	-62.7	-43.2	177.3	-69.4	-178.8	0	0	0	111.6	L168 L170 L206 L210 L226 M384 E390 Y391 L392	L168-L388 HydrophobicContact CD2-CD2 3.54Å; L170-L388 HydrophobicContact CD2-CD1 4.22Å; L170-L388 HydrophobicContact CD2-CD2 4.42Å; L206-L388 HydrophobicContact CB-CD1 4.13Å; L206-L388 HydrophobicContact CD1-CD1 4.26Å; L206-L388 HydrophobicContact CD2-CD1 4.21Å; L206-L388 HydrophobicContact CG-CD1 4.44Å; L210-L388 HydrophobicContact CD1-CB 4.37Å; L210-L388 HydrophobicContact CD1-CD1 4.28Å; L226-L388 HydrophobicContact CD1-CD2 4.24Å; L226-L388 HydrophobicContact CD2-CD1 4.49Å; M384-L388 WeakPolarHBondContact O-CG 3.48Å; M384-L388 PolarHBondContact O-N 3.34Å; L388-E390 VanDerWaalsContact C-N 3.32Å; L388-E390 PolarHBondContact O-N 3.38Å; L388-Y391 PolarHBondContact O-N 2.92Å; L388-L392 WeakPolarHBondContact O-CB 3.38Å; L388-L392 WeakPolarHBondContact O-CG 3.38Å; L388-L392 PolarHBondContact O-N 2.99Å
389	A	98.6	Very high	98.3	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-62.9	-37.1	176.3	0	0	0	0	0	112.9	V81 L89 A385 V386 G393 L394	V81-A389 HydrophobicContact CG2-CB 4.08Å; L89-A389 HydrophobicContact CD1-CB 3.44Å; L89-A389 VanDerWaalsContact CD1-CB 3.44Å; L89-A389 HydrophobicContact CD2-CB 3.88Å; L89-A389 HydrophobicContact CG-CB 4.33Å; A385-A389 WeakPolarHBondContact O-CB 3.49Å; A385-A389 PolarHBondContact O-N 2.77Å; A385-A389 VanDerWaalsContact O-N 3.1Å; V386-A389 PolarHBondContact O-N 3.02Å; A389-G393 VanDerWaalsContact O-CA 3.24Å; A389-G393 WeakPolarHBondContact O-CA 3.41Å; A389-G393 PolarHBondContact O-N 3.47Å; A389-L394 HydrophobicContact CB-CB 3.99Å; A389-L394 HydrophobicContact CB-CG 4.5Å; A389-L394 PolarHBondContact O-N 3.09Å; A389-L394 VanDerWaalsContact O-N 3.16Å
390	E	98.6	Very high	98.2	Very high	3 Å²	3	7.4 Å²	7.4	1%	0.014	5%	0.046	C	C	.	.	H	α-helix	trans	-70.9	-40.9	172.1	-72.7	-164.7	160	0	0	112.6	P78 S79 V81 R303 R310 V386 F387 L388	P78-E390 CarbonylContact C-O 3.51Å; P78-E390 VanDerWaalsContact CA-O 3.3Å; P78-E390 WeakPolarHBondContact CA-O 3.3Å; P78-E390 HydrophobicContact CB-CB 4.06Å; S79-E390 PolarHBondContact N-O 2.74Å; V81-E390 HydrophobicContact CB-CG 4.04Å; V81-E390 HydrophobicContact CG2-CB 4.44Å; V81-E390 HydrophobicContact CG2-CG 3.54Å; R303-E390 IonicContact CZ-OE1 3.03Å; R303-E390 IonicContact CZ-OE2 3.18Å; R303-E390 IonicContact NE-OE2 2.67Å; R303-E390 PolarHBondContact NE-OE2 2.99Å; R303-E390 IonicContact NH2-OE1 3.81Å; R303-E390 PolarHBondContact NH2-OE1 3.1Å; R303-E390 IonicContact NH2-OE2 3.5Å; R303-E390 PolarHBondContact NH2-OE2 3.25Å; R310-E390 IonicContact CZ-OE1 3.34Å; R310-E390 IonicContact NH1-OE1 3.7Å; R310-E390 PolarHBondContact NH1-OE1 3.47Å; R310-E390 IonicContact NH2-OE1 3.43Å; V386-E390 WeakPolarHBondContact O-CG 3.35Å; V386-E390 PolarHBondContact O-N 3.11Å; F387-E390 PolarHBondContact O-N 2.8Å; L388-E390 VanDerWaalsContact C-N 3.32Å; L388-E390 PolarHBondContact O-N 3.38Å
391	Y	98.6	Very high	98.2	Very high	3 Å²	3	7.7 Å²	7.7	1%	0.012	5%	0.049	C	C	.	.	H	α-helix	trans	-69.6	-40.8	-177.5	-162.7	-75.1	0	0	0	112.7	H76 L168 V224 D275 L276 W300 F387 L388	H76-Y391 AromaticContact CD2-CE1 3.6Å; H76-Y391 AromaticContact CD2-CZ 3.65Å; H76-Y391 AromaticContact NE2-CD1 3.59Å; H76-Y391 AromaticContact NE2-CE1 3.46Å; H76-Y391 WeakPolarHBondContact NE2-CE1 3.48Å; H76-Y391 AromaticContact NE2-CZ 4Å; H76-Y391 PolarHBondContact NE2-O 3.48Å; L168-Y391 HydrophobicContact CB-CD1 4.05Å; L168-Y391 HydrophobicContact CB-CE1 3.82Å; L168-Y391 HydrophobicContact CD1-CD1 4.36Å; L168-Y391 HydrophobicContact CD1-CD2 4.35Å; L168-Y391 HydrophobicContact CD1-CE1 4.12Å; L168-Y391 HydrophobicContact CD1-CE2 4.08Å; L168-Y391 HydrophobicContact CD1-CG 4.48Å; L168-Y391 HydrophobicContact CD2-CD1 3.75Å; L168-Y391 HydrophobicContact CD2-CD2 4.41Å; L168-Y391 HydrophobicContact CD2-CE1 4.26Å; L168-Y391 HydrophobicContact CD2-CG 3.85Å; L168-Y391 HydrophobicContact CG-CD1 4.28Å; L168-Y391 HydrophobicContact CG-CE1 4.3Å; V224-Y391 HydrophobicContact CG1-CE1 4.17Å; D275-Y391 WeakPolarHBondContact CB-OH 3.4Å; L276-Y391 HydrophobicContact CB-CE2 4.3Å; L276-Y391 HydrophobicContact CD2-CD2 4.37Å; L276-Y391 HydrophobicContact CD2-CE2 3.69Å; W300-Y391 HydrophobicContact CD2-CD2 4.1Å; W300-Y391 AromaticContact CD2-CE2 3.87Å; W300-Y391 HydrophobicContact CD2-CE2 3.87Å; W300-Y391 AromaticContact CE2-CE2 3.57Å; W300-Y391 AromaticContact CE3-CD2 3.76Å; W300-Y391 HydrophobicContact CE3-CD2 3.76Å; W300-Y391 AromaticContact CE3-CE2 4Å; W300-Y391 HydrophobicContact CE3-CE2 4Å; W300-Y391 AromaticContact CH2-CD2 3.71Å; W300-Y391 HydrophobicContact CH2-CD2 3.71Å; W300-Y391 AromaticContact CH2-CE2 3.65Å; W300-Y391 HydrophobicContact CH2-CE2 3.65Å; W300-Y391 HydrophobicContact CZ2-CD2 4.03Å; W300-Y391 AromaticContact CZ2-CE2 3.48Å; W300-Y391 HydrophobicContact CZ2-CE2 3.48Å; W300-Y391 VanDerWaalsContact CZ2-CE2 3.48Å; W300-Y391 AromaticContact CZ3-CD2 3.56Å; W300-Y391 HydrophobicContact CZ3-CD2 3.56Å; W300-Y391 AromaticContact CZ3-CE2 3.9Å; W300-Y391 HydrophobicContact CZ3-CE2 3.9Å; W300-Y391 HydrophobicContact CZ3-CG 4.43Å; F387-Y391 HydrophobicContact CE1-CD2 4.27Å; F387-Y391 HydrophobicContact CZ-CD2 4.08Å; F387-Y391 WeakPolarHBondContact O-CB 3.38Å; F387-Y391 PolarHBondContact O-N 3.17Å; L388-Y391 PolarHBondContact O-N 2.92Å
392	L	98	Very high	98.1	Very high	12 Å²	12	8.3 Å²	8.3	6%	0.063	5%	0.052	C	C	.	.	H	α-helix	trans	-96.7	-27.4	-173.8	-58.7	171.5	0	0	0	112.7	L168 L214 F217 V224 L226 L388 L394	L168-L392 HydrophobicContact CB-CD2 4.42Å; L168-L392 HydrophobicContact CD2-CD2 4.48Å; L214-L392 HydrophobicContact CD2-CD1 4.25Å; F217-L392 HydrophobicContact CD2-CB 4.3Å; F217-L392 HydrophobicContact CE1-CD2 4.42Å; F217-L392 HydrophobicContact CE2-CB 3.75Å; F217-L392 HydrophobicContact CE2-CD2 4.39Å; F217-L392 VanDerWaalsContact CE2-O 3.27Å; F217-L392 WeakPolarHBondContact CE2-O 3.29Å; F217-L392 HydrophobicContact CZ-CB 3.94Å; F217-L392 HydrophobicContact CZ-CD2 3.78Å; F217-L392 HydrophobicContact CZ-CG 4.3Å; V224-L392 HydrophobicContact CG1-CD2 4.25Å; L226-L392 HydrophobicContact CB-CD1 4.14Å; L226-L392 HydrophobicContact CD2-CD1 4.18Å; L388-L392 WeakPolarHBondContact O-CB 3.38Å; L388-L392 WeakPolarHBondContact O-CG 3.38Å; L388-L392 PolarHBondContact O-N 2.99Å; L392-L394 HydrophobicContact CB-CD2 4.02Å; L392-L394 HydrophobicContact CB-CG 4.06Å; L392-L394 HydrophobicContact CD1-CD1 4.41Å
393	G	96.3	Very high	98.1	Very high	27 Å²	27	7.6 Å²	7.6	28%	0.278	5%	0.05	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	56.8	-176.2	0	0	0	0	0	113.7	S79 A389	S79-G393 WeakPolarHBondContact OG-CA 3.49Å; A389-G393 VanDerWaalsContact O-CA 3.24Å; A389-G393 WeakPolarHBondContact O-CA 3.41Å; A389-G393 PolarHBondContact O-N 3.47Å
394	L	93.3	Very high	98	Very high	39 Å²	39	8.3 Å²	8.3	20%	0.204	6%	0.055	C	C	.	.			trans	-94.5	0	-176.4	-51.5	-179.5	0	0	0	114.9	L210 Q213 L214 F217 A389 L392	L210-L394 HydrophobicContact CD1-CD1 4.11Å; Q213-L394 HydrophobicContact CB-CB 4.15Å; Q213-L394 HydrophobicContact CB-CD1 4.42Å; Q213-L394 HydrophobicContact CB-CD2 4.47Å; Q213-L394 HydrophobicContact CG-CB 4.37Å; L214-L394 HydrophobicContact CD2-CD1 3.97Å; L214-L394 HydrophobicContact CD2-CD2 4.31Å; F217-L394 HydrophobicContact CB-CD2 3.6Å; F217-L394 HydrophobicContact CD1-CD2 4.47Å; F217-L394 HydrophobicContact CD2-CD2 3.83Å; F217-L394 HydrophobicContact CG-CD2 3.73Å; A389-L394 HydrophobicContact CB-CB 3.99Å; A389-L394 HydrophobicContact CB-CG 4.5Å; A389-L394 PolarHBondContact O-N 3.09Å; A389-L394 VanDerWaalsContact O-N 3.16Å; L392-L394 HydrophobicContact CB-CD2 4.02Å; L392-L394 HydrophobicContact CB-CG 4.06Å; L392-L394 HydrophobicContact CD1-CD1 4.41Å

Retrieved 394 of 394 residues in 186.3 ms (Link to these results)

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