A0A087Y069_POEFO Loading...

Usher syndrome 1C binding protein 1

AlphaFold DB , UniProt , Accession A0A087Y069, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 701 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	33.6	Very low	30.7	Very low	217 Å²	217	160.1 Å²	160.1	100%	1.069	81%	0.809	S	S	*	*				0	63.6	0	-50.5	-175.1	-160.9	0	0	108
2	E	35.5	Very low	30.5	Very low	164 Å²	164	158.7 Å²	158.7	77%	0.766	80%	0.804	S	S	*	*				69.3	122	67.6	-60.8	142.6	148.3	0	0	109.5
3	D	33.3	Very low	30.2	Very low	138 Å²	138	158.6 Å²	158.6	74%	0.738	81%	0.807	S	S	*	*			cis	-152.6	166.7	2.9	-128.9	-47.7	0	0	0	115
4	S	31.1	Very low	30.1	Very low	98 Å²	98	156.1 Å²	156.1	69%	0.685	80%	0.804	S	S	*	*			trans	-19.7	126.8	169.4	-55	0	0	0	0	116.8
5	K	32.3	Very low	30	Very low	198 Å²	198	153.5 Å²	153.5	86%	0.861	80%	0.804	S	S	*	*				56.8	134.2	57.9	-72.6	-170.2	178.2	176.8	0	116.7
6	R	32.3	Very low	29.8	Very low	251 Å²	251	150.8 Å²	150.8	95%	0.947	80%	0.803	S	S	*	*			trans	97.6	139.4	166.3	-58	174.2	176.3	-145.6	-1.8	114.9
7	S	28.2	Very low	29.8	Very low	120 Å²	120	152.1 Å²	152.1	84%	0.839	81%	0.808	S	S	*	*			cis	-130.9	155.1	3.5	60.7	0	0	0	0	113.7
8	R	27.7	Very low	29.7	Very low	233 Å²	233	154 Å²	154	88%	0.879	81%	0.809	S	S	*	*			trans	-137.3	170.8	163.6	-158	-178.2	-167.5	179.4	4.8	105.6
9	C	28.3	Very low	29.6	Very low	105 Å²	105	153.9 Å²	153.9	71%	0.709	81%	0.81	S	S	*	*			trans	76.1	141.3	176.8	-45.8	0	0	0	0	111.9
10	N	26.6	Very low	29.7	Very low	153 Å²	153	154.6 Å²	154.6	82%	0.818	81%	0.805	S	S	*	*			cis	-149.8	172	21.8	-90	-46.3	0	0	0	107.7
11	S	28.4	Very low	29.6	Very low	84 Å²	84	153.4 Å²	153.4	59%	0.587	80%	0.8	S	S	*	*			cis	172.2	138.1	-11.3	174.5	0	0	0	0	104
12	L	28.5	Very low	29.5	Very low	143 Å²	143	149.9 Å²	149.9	75%	0.749	79%	0.79	S	S	*	*			trans	28.5	131.2	141.5	-50.6	170.7	0	0	0	119.6
13	D	26.9	Very low	29.4	Very low	158 Å²	158	149.3 Å²	149.3	85%	0.845	79%	0.792	S	S	*	*				-166.3	164.2	96.4	-102.6	-24.2	0	0	0	115.1
14	T	28.5	Very low	29.2	Very low	124 Å²	124	147.5 Å²	147.5	76%	0.761	79%	0.79	S	S	*	*			trans	-115.9	133.7	-170.3	52.2	0	0	0	0	113.2
15	S	28.2	Very low	29.1	Very low	116 Å²	116	152 Å²	152	81%	0.811	80%	0.799	S	S	*	*			trans	-176.7	127.3	149.8	43.5	0	0	0	0	108.6
16	S	27.5	Very low	28.9	Very low	111 Å²	111	146.1 Å²	146.1	78%	0.776	80%	0.795	S	S	*	*				68.6	95.6	59.3	178.5	0	0	0	0	114.2
17	L	29.1	Very low	28.9	Very low	172 Å²	172	141.4 Å²	141.4	90%	0.901	79%	0.789	S	S	*	*			trans	-165	140.7	135.8	-108.7	148.6	0	0	0	112.8
18	F	28.6	Very low	29.1	Very low	187 Å²	187	145 Å²	145	82%	0.82	79%	0.79	S	S	*	*			trans	-83.6	149.2	175.8	-95.9	-103.6	0	0	0	111.8
19	N	28.3	Very low	29.3	Very low	153 Å²	153	141.2 Å²	141.2	82%	0.818	79%	0.792	S	S	*	*			trans	171.1	111.8	136.9	-84.5	-31.8	0	0	0	106.5
20	K	30.5	Very low	29.3	Very low	166 Å²	166	141 Å²	141	72%	0.722	79%	0.788	S	S	*	*				83.1	110.4	59	-168.8	169.9	-177.6	176.9	0	113.3
21	D	28.6	Very low	29.5	Very low	131 Å²	131	142.6 Å²	142.6	70%	0.701	79%	0.788	S	S	*	*			trans	54.5	125.8	159.9	-50.4	-19.8	0	0	0	120.5
22	V	31.6	Very low	29.4	Very low	142 Å²	142	145.3 Å²	145.3	86%	0.861	80%	0.796	S	S	*	*				177	157.6	112.4	154.2	0	0	0	0	110.8
23	L	32.8	Very low	30.1	Very low	152 Å²	152	143.6 Å²	143.6	80%	0.796	79%	0.793	S	S	*	*			trans	-79.3	164.8	-166.2	-75.7	68.5	0	0	0	116.5
24	S	29	Very low	30.5	Very low	100 Å²	100	145.1 Å²	145.1	70%	0.699	79%	0.792	S	S	*	*			trans	97.4	122.7	139.1	-75.3	0	0	0	0	121.6
25	H	28.4	Very low	30.8	Very low	192 Å²	192	143.8 Å²	143.8	89%	0.889	79%	0.794	S	S	*	*			trans	35.1	121.9	142.3	-71.8	-60.6	0	0	0	121.4
26	G	29.3	Very low	31.1	Very low	75 Å²	75	144 Å²	144	77%	0.773	80%	0.795	S	S	*	*			trans	177.9	132.7	155.3	0	0	0	0	0	110
27	D	32.9	Very low	31.4	Very low	153 Å²	153	148 Å²	148	82%	0.818	80%	0.802	S	S	*	*			trans	-68.6	-176.2	176.3	-65.4	-66.9	0	0	0	112.6
28	F	32.2	Very low	31.9	Very low	196 Å²	196	145.4 Å²	145.4	86%	0.86	80%	0.795	S	S	*	*			trans	88.3	98.9	-179	-56.2	-75.9	0	0	0	116.4
29	V	32.3	Very low	32.4	Very low	152 Å²	152	144.5 Å²	144.5	92%	0.921	80%	0.798	S	S	*	*			trans	-119.9	125.7	150.5	176.4	0	0	0	0	108.1
30	T	28	Very low	33	Very low	100 Å²	100	144.3 Å²	144.3	61%	0.613	80%	0.795	S	S	*	*			trans	-113.1	133	-175.9	-20.8	0	0	0	0	110.3
31	F	30.2	Very low	33.8	Very low	187 Å²	187	139.8 Å²	139.8	82%	0.82	80%	0.796	S	S	*	*			trans	61.5	131.8	170	-59.3	-69.5	0	0	0	117
32	D	26.8	Very low	34.7	Very low	142 Å²	142	141.8 Å²	141.8	76%	0.759	80%	0.801	S	S	*	*				-156.9	128.4	73.7	-176.8	13.4	0	0	0	112.2
33	P	42.6	Very low	35.6	Very low	107 Å²	107	143.3 Å²	143.3	70%	0.695	80%	0.799	S	S	*	*			trans	-100.5	90.7	178.5	36.5	-29.6	0	0	0	112.5
34	K	35.2	Very low	37	Very low	190 Å²	190	140.2 Å²	140.2	83%	0.826	79%	0.788	S	S	*	*			trans	-152.3	149.2	164.4	-112.3	158.9	-171.6	172.3	0	112.9
35	A	34.4	Very low	39.3	Very low	96 Å²	96	138.7 Å²	138.7	79%	0.793	77%	0.774	S	S	*	*			trans	69.1	82.7	-177	0	0	0	0	0	116.3
36	S	34.1	Very low	41.2	Very low	120 Å²	120	134.9 Å²	134.9	84%	0.839	77%	0.767	S	S	*	*			trans	-148.4	94.3	152.8	-75.1	0	0	0	0	109.2	P38	S36-P38 WeakPolarHBondContact O-CD 3.12Å
37	E	34.4	Very low	43.1	Very low	195 Å²	195	134.7 Å²	134.7	91%	0.911	76%	0.758	S	S	*	*			trans	-81	122.4	166.6	-69.6	-176.4	142.4	0	0	109.2
38	P	40.5	Very low	45.4	Very low	118 Å²	118	132.2 Å²	132.2	77%	0.766	74%	0.741	S	S	*	*			trans	-86.6	111.7	172.8	30.6	-27.1	0	0	0	110.2	S36	S36-P38 WeakPolarHBondContact O-CD 3.12Å
39	L	38	Very low	47.7	Very low	167 Å²	167	125.9 Å²	125.9	87%	0.874	72%	0.719	S	S	*	*			trans	-66.8	139.6	177.3	-168.7	65	0	0	0	111.6
40	I	40.3	Very low	50	Low	149 Å²	149	121.1 Å²	121.1	76%	0.764	70%	0.695	S	S	*	*			trans	-78	158.6	-166.8	-68.6	160.9	0	0	0	112.4
41	G	47.9	Very low	52.7	Low	72 Å²	72	121.9 Å²	121.9	74%	0.742	69%	0.691	S	S	*	*			trans	-44.2	137.2	-168.7	0	0	0	0	0	117.9
42	H	48.8	Very low	55.1	Low	173 Å²	173	115.5 Å²	115.5	80%	0.801	67%	0.67	S	S	*	*			trans	-108	128.4	159.9	-89.8	-87.3	0	0	0	109.5
43	E	50.4	Low	58.1	Low	173 Å²	173	114.7 Å²	114.7	81%	0.808	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-62.2	138	164.5	-170.3	176.5	-173.8	0	0	109.1	T45	E43-T45 PolarHBondContact O-N 3.13Å
44	P	62.4	Low	60.2	Low	88 Å²	88	112.2 Å²	112.2	57%	0.571	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-61.9	126	-175.5	25.3	-34.2	0	0	0	110.3	V49	P44-V49 HydrophobicContact CB-CG2 4.47Å
45	T	75.9	Confident	62.5	Low	67 Å²	67	107 Å²	107	41%	0.411	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-66.3	149.7	-178.5	56.9	0	0	0	0	110.6	E43 A47 E48 V49	E43-T45 PolarHBondContact O-N 3.13Å; T45-A47 PolarHBondContact O-N 2.62Å; T45-E48 WeakPolarHBondContact CB-OE2 3.35Å; T45-E48 PolarHBondContact N-OE2 3.23Å; T45-E48 WeakPolarHBondContact O-CB 3.29Å; T45-E48 PolarHBondContact O-N 3.12Å; T45-E48 WeakPolarHBondContact OG1-CG 3.27Å; T45-E48 PolarHBondContact OG1-OE2 3.06Å; T45-V49 PolarHBondContact O-N 3.04Å; T45-V49 VanDerWaalsContact O-N 3.16Å
46	P	68.9	Low	65.2	Low	113 Å²	113	106.4 Å²	106.4	73%	0.734	62%	0.615	S	S	*	*	H	α-helix	trans	-60.1	-18.4	-179.5	21.6	-33	0	0	0	113.7	A50	P46-A50 WeakPolarHBondContact O-CB 3.46Å; P46-A50 PolarHBondContact O-N 3.2Å
47	A	69.8	Low	67.8	Low	70 Å²	70	104.2 Å²	104.2	58%	0.579	60%	0.599	S	S	*	*	H	α-helix	trans	-71	-39.2	170.4	0	0	0	0	0	112.8	T45 Q51	T45-A47 PolarHBondContact O-N 2.62Å; A47-Q51 VanDerWaalsContact O-CB 3.32Å; A47-Q51 WeakPolarHBondContact O-CB 3.28Å; A47-Q51 PolarHBondContact O-N 2.7Å
48	E	79.4	Confident	70.5	Confident	101 Å²	101	98.8 Å²	98.8	47%	0.472	58%	0.58	S	S	.	*	H	α-helix	trans	-69.9	-35.4	175.8	-67.1	164.8	124.7	0	0	111.1	T45 C52	T45-E48 WeakPolarHBondContact CB-OE2 3.35Å; T45-E48 PolarHBondContact N-OE2 3.23Å; T45-E48 WeakPolarHBondContact O-CB 3.29Å; T45-E48 PolarHBondContact O-N 3.12Å; T45-E48 WeakPolarHBondContact OG1-CG 3.27Å; T45-E48 PolarHBondContact OG1-OE2 3.06Å; E48-C52 PolarHBondContact O-N 3.44Å; E48-C52 PolarHBondContact O-SG 3.46Å
49	V	80.7	Confident	73	Confident	64 Å²	64	98 Å²	98	39%	0.388	57%	0.568	S	S	.	*	H	α-helix	trans	-65.5	-51	172.9	-178.5	0	0	0	0	110.9	P44 T45 Q51 C52 E53	P44-V49 HydrophobicContact CB-CG2 4.47Å; T45-V49 PolarHBondContact O-N 3.04Å; T45-V49 VanDerWaalsContact O-N 3.16Å; V49-Q51 VanDerWaalsContact C-N 3.26Å; V49-Q51 PolarHBondContact O-N 3.42Å; V49-C52 WeakPolarHBondContact O-CA 3.41Å; V49-C52 WeakPolarHBondContact O-CB 3.45Å; V49-C52 PolarHBondContact O-N 3.49Å; V49-E53 PolarHBondContact O-N 3.2Å
50	A	81.4	Confident	75.5	Confident	51 Å²	51	95.2 Å²	95.2	42%	0.421	55%	0.554	S	S	.	*	H	α-helix	trans	-61.5	-33.9	177	0	0	0	0	0	112.7	P46 E53 A54	P46-A50 WeakPolarHBondContact O-CB 3.46Å; P46-A50 PolarHBondContact O-N 3.2Å; A50-E53 PolarHBondContact O-N 2.73Å; A50-A54 PolarHBondContact O-N 3.11Å; A50-A54 VanDerWaalsContact O-N 3.09Å
51	Q	83.9	Confident	77.9	Confident	116 Å²	116	91.5 Å²	91.5	54%	0.542	54%	0.541	S	S	.	.	H	α-helix	trans	-67	-42.1	172	-178.3	172.1	-18.9	0	0	111.6	A47 V49 E53 A54 E55	A47-Q51 VanDerWaalsContact O-CB 3.32Å; A47-Q51 WeakPolarHBondContact O-CB 3.28Å; A47-Q51 PolarHBondContact O-N 2.7Å; V49-Q51 VanDerWaalsContact C-N 3.26Å; V49-Q51 PolarHBondContact O-N 3.42Å; Q51-E53 VanDerWaalsContact C-N 3.34Å; Q51-E53 PolarHBondContact O-N 3.5Å; Q51-A54 PolarHBondContact O-N 3.29Å; Q51-E55 HydrophobicContact CG-CG 4.4Å; Q51-E55 WeakPolarHBondContact CG-OE1 3.37Å; Q51-E55 PolarHBondContact NE2-OE1 3.31Å; Q51-E55 WeakPolarHBondContact O-CB 3.24Å; Q51-E55 WeakPolarHBondContact O-CG 3.47Å; Q51-E55 PolarHBondContact O-N 3.46Å
52	C	81.6	Confident	80	Confident	54 Å²	54	92.8 Å²	92.8	37%	0.365	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-39.2	174.1	-69.5	0	0	0	0	112.1	E48 V49 E55 V56	E48-C52 PolarHBondContact O-N 3.44Å; E48-C52 PolarHBondContact O-SG 3.46Å; V49-C52 WeakPolarHBondContact O-CA 3.41Å; V49-C52 WeakPolarHBondContact O-CB 3.45Å; V49-C52 PolarHBondContact O-N 3.49Å; C52-E55 PolarHBondContact O-N 3.38Å; C52-V56 WeakPolarHBondContact O-CB 3.34Å; C52-V56 VanDerWaalsContact O-CG2 3.28Å; C52-V56 WeakPolarHBondContact O-CG2 3.43Å; C52-V56 PolarHBondContact O-N 3.15Å
53	E	88.4	Confident	82	Confident	124 Å²	124	88.1 Å²	88.1	58%	0.579	51%	0.51	S	S	*	.	H	α-helix	trans	-63.1	-40.4	175.3	-70.4	173.8	173	0	0	112.1	V49 A50 Q51 S57	V49-E53 PolarHBondContact O-N 3.2Å; A50-E53 PolarHBondContact O-N 2.73Å; Q51-E53 VanDerWaalsContact C-N 3.34Å; Q51-E53 PolarHBondContact O-N 3.5Å; E53-S57 WeakPolarHBondContact O-CB 3.28Å; E53-S57 PolarHBondContact O-N 3.45Å; E53-S57 PolarHBondContact O-OG 3.39Å
54	A	87.3	Confident	83.7	Confident	56 Å²	56	82.6 Å²	82.6	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-69	-38.9	174.2	0	0	0	0	0	112.8	A50 Q51 S57 T58	A50-A54 PolarHBondContact O-N 3.11Å; A50-A54 VanDerWaalsContact O-N 3.09Å; Q51-A54 PolarHBondContact O-N 3.29Å; A54-S57 PolarHBondContact O-N 2.79Å; A54-T58 PolarHBondContact O-N 3.13Å; A54-T58 PolarHBondContact O-OG1 2.96Å
55	E	83.1	Confident	84.9	Confident	81 Å²	81	82.4 Å²	82.4	38%	0.379	49%	0.488	S	S	.	.	H	α-helix	trans	-66.8	-40.5	175.7	-75.5	177.6	-165.1	0	0	111.6	Q51 C52 T58 L59	Q51-E55 HydrophobicContact CG-CG 4.4Å; Q51-E55 WeakPolarHBondContact CG-OE1 3.37Å; Q51-E55 PolarHBondContact NE2-OE1 3.31Å; Q51-E55 WeakPolarHBondContact O-CB 3.24Å; Q51-E55 WeakPolarHBondContact O-CG 3.47Å; Q51-E55 PolarHBondContact O-N 3.46Å; C52-E55 PolarHBondContact O-N 3.38Å; E55-T58 WeakPolarHBondContact CA-OG1 3.28Å; E55-T58 PolarHBondContact O-N 2.99Å; E55-T58 PolarHBondContact O-OG1 2.89Å; E55-L59 WeakPolarHBondContact O-CB 3.37Å; E55-L59 PolarHBondContact O-N 3.28Å
56	V	92.7	Very high	85.3	Confident	82 Å²	82	83.6 Å²	83.6	50%	0.497	49%	0.492	S	S	.	.	H	α-helix	trans	-65	-42.6	172.8	169.2	0	0	0	0	111.3	C52 T58 L59 L60	C52-V56 WeakPolarHBondContact O-CB 3.34Å; C52-V56 VanDerWaalsContact O-CG2 3.28Å; C52-V56 WeakPolarHBondContact O-CG2 3.43Å; C52-V56 PolarHBondContact O-N 3.15Å; V56-T58 VanDerWaalsContact C-N 3.35Å; V56-T58 PolarHBondContact O-N 3.17Å; V56-L59 WeakPolarHBondContact O-CB 3.49Å; V56-L59 PolarHBondContact O-N 3.48Å; V56-L60 HydrophobicContact CG1-CD1 4.06Å; V56-L60 HydrophobicContact CG1-CG 4.48Å; V56-L60 WeakPolarHBondContact O-CG 3.4Å; V56-L60 PolarHBondContact O-N 3.17Å
57	S	87.3	Confident	85.9	Confident	74 Å²	74	82.6 Å²	82.6	52%	0.517	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-40.3	178.2	-60.1	0	0	0	0	112.4	E53 A54 L60 S61	E53-S57 WeakPolarHBondContact O-CB 3.28Å; E53-S57 PolarHBondContact O-N 3.45Å; E53-S57 PolarHBondContact O-OG 3.39Å; A54-S57 PolarHBondContact O-N 2.79Å; S57-L60 PolarHBondContact O-N 3.05Å; S57-S61 PolarHBondContact O-N 2.88Å; S57-S61 VanDerWaalsContact O-N 3.08Å
58	T	91.9	Very high	86.7	Confident	82 Å²	82	86.7 Å²	86.7	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-70.8	-36.2	175.1	48.4	0	0	0	0	112.3	A54 E55 V56 S61 I62	A54-T58 PolarHBondContact O-N 3.13Å; A54-T58 PolarHBondContact O-OG1 2.96Å; E55-T58 WeakPolarHBondContact CA-OG1 3.28Å; E55-T58 PolarHBondContact O-N 2.99Å; E55-T58 PolarHBondContact O-OG1 2.89Å; V56-T58 VanDerWaalsContact C-N 3.35Å; V56-T58 PolarHBondContact O-N 3.17Å; T58-S61 WeakPolarHBondContact O-CB 3.47Å; T58-S61 PolarHBondContact O-N 3.25Å; T58-I62 VanDerWaalsContact O-CG1 3.31Å; T58-I62 WeakPolarHBondContact O-CG1 3.46Å; T58-I62 PolarHBondContact O-N 3.18Å
59	L	92.9	Very high	86.9	Confident	100 Å²	100	87.9 Å²	87.9	52%	0.524	49%	0.488	S	S	.	.	H	α-helix	trans	-59.9	-45.6	171.6	-118.4	155.8	0	0	0	112.2	E55 V56 S61 I62 I63	E55-L59 WeakPolarHBondContact O-CB 3.37Å; E55-L59 PolarHBondContact O-N 3.28Å; V56-L59 WeakPolarHBondContact O-CB 3.49Å; V56-L59 PolarHBondContact O-N 3.48Å; L59-S61 VanDerWaalsContact C-N 3.33Å; L59-S61 PolarHBondContact O-N 3.26Å; L59-I62 PolarHBondContact O-N 3.17Å; L59-I63 HydrophobicContact CD2-CD1 4.09Å; L59-I63 VanDerWaalsContact O-CG1 3.3Å; L59-I63 WeakPolarHBondContact O-CG1 3.27Å; L59-I63 PolarHBondContact O-N 2.76Å
60	L	89.7	Confident	86.8	Confident	110 Å²	110	90.1 Å²	90.1	58%	0.576	50%	0.496	S	S	*	.	H	α-helix	trans	-63.4	-38	176.5	-69.8	170.3	0	0	0	112	V56 S57 I63 A64	V56-L60 HydrophobicContact CG1-CD1 4.06Å; V56-L60 HydrophobicContact CG1-CG 4.48Å; V56-L60 WeakPolarHBondContact O-CG 3.4Å; V56-L60 PolarHBondContact O-N 3.17Å; S57-L60 PolarHBondContact O-N 3.05Å; L60-I63 PolarHBondContact O-N 3.45Å; L60-A64 WeakPolarHBondContact O-CB 3.24Å; L60-A64 PolarHBondContact O-N 3.4Å
61	S	91.2	Very high	86.2	Confident	70 Å²	70	90.6 Å²	90.6	49%	0.49	51%	0.506	S	S	.	.	H	α-helix	trans	-63.1	-41.6	172.8	-168.5	0	0	0	0	112.3	S57 T58 L59 A64 D65	S57-S61 PolarHBondContact O-N 2.88Å; S57-S61 VanDerWaalsContact O-N 3.08Å; T58-S61 WeakPolarHBondContact O-CB 3.47Å; T58-S61 PolarHBondContact O-N 3.25Å; L59-S61 VanDerWaalsContact C-N 3.33Å; L59-S61 PolarHBondContact O-N 3.26Å; S61-A64 PolarHBondContact O-N 2.9Å; S61-D65 PolarHBondContact O-N 3.43Å
62	I	93.1	Very high	85.2	Confident	99 Å²	99	89.4 Å²	89.4	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-39.8	177.3	-69	163.4	0	0	0	110.9	T58 L59 D65 L66	T58-I62 VanDerWaalsContact O-CG1 3.31Å; T58-I62 WeakPolarHBondContact O-CG1 3.46Å; T58-I62 PolarHBondContact O-N 3.18Å; L59-I62 PolarHBondContact O-N 3.17Å; I62-D65 PolarHBondContact O-N 3.19Å; I62-L66 HydrophobicContact CG2-CD1 4.04Å; I62-L66 WeakPolarHBondContact O-CB 3.45Å; I62-L66 PolarHBondContact O-N 3.25Å
63	I	89.4	Confident	83.8	Confident	76 Å²	76	93.7 Å²	93.7	39%	0.39	53%	0.529	S	S	.	.	H	α-helix	trans	-64.2	-41.5	175	-68.9	163	0	0	0	110.7	L59 L60 L66 N67	L59-I63 HydrophobicContact CD2-CD1 4.09Å; L59-I63 VanDerWaalsContact O-CG1 3.3Å; L59-I63 WeakPolarHBondContact O-CG1 3.27Å; L59-I63 PolarHBondContact O-N 2.76Å; L60-I63 PolarHBondContact O-N 3.45Å; I63-L66 PolarHBondContact O-N 3.31Å; I63-N67 WeakPolarHBondContact O-CB 3.47Å; I63-N67 VanDerWaalsContact O-CG 3.27Å; I63-N67 PolarHBondContact O-N 3.36Å; I63-N67 PolarHBondContact O-ND2 2.8Å
64	A	86.1	Confident	82	Confident	57 Å²	57	96.8 Å²	96.8	47%	0.471	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-44.2	175.5	0	0	0	0	0	112.3	L60 S61 N67 K68	L60-A64 WeakPolarHBondContact O-CB 3.24Å; L60-A64 PolarHBondContact O-N 3.4Å; S61-A64 PolarHBondContact O-N 2.9Å; A64-N67 PolarHBondContact O-N 3.2Å; A64-K68 WeakPolarHBondContact O-CB 3.36Å; A64-K68 PolarHBondContact O-N 2.75Å
65	D	87.3	Confident	79.9	Confident	83 Å²	83	97.8 Å²	97.8	44%	0.444	55%	0.548	S	S	.	.	H	α-helix	trans	-66.6	-36.8	175.8	-95.1	-11.7	0	0	0	113	S61 I62 K68 K69	S61-D65 PolarHBondContact O-N 3.43Å; I62-D65 PolarHBondContact O-N 3.19Å; D65-K68 PolarHBondContact O-N 3.28Å; D65-K69 WeakPolarHBondContact O-CB 3.36Å; D65-K69 VanDerWaalsContact O-CG 3.3Å; D65-K69 WeakPolarHBondContact O-CG 3.21Å; D65-K69 PolarHBondContact O-N 3.36Å
66	L	85.3	Confident	78	Confident	92 Å²	92	100.3 Å²	100.3	48%	0.482	57%	0.572	S	S	.	*	H	α-helix	trans	-65.3	-45.2	172.3	-86.7	164.7	0	0	0	111.4	I62 I63 K68 K69 M70	I62-L66 HydrophobicContact CG2-CD1 4.04Å; I62-L66 WeakPolarHBondContact O-CB 3.45Å; I62-L66 PolarHBondContact O-N 3.25Å; I63-L66 PolarHBondContact O-N 3.31Å; L66-K68 VanDerWaalsContact C-N 3.31Å; L66-K68 PolarHBondContact O-N 3.13Å; L66-K69 PolarHBondContact O-N 3.41Å; L66-M70 WeakPolarHBondContact O-CB 3.43Å; L66-M70 WeakPolarHBondContact O-CG 3.46Å; L66-M70 PolarHBondContact O-N 3.26Å
67	N	81.4	Confident	75.5	Confident	92 Å²	92	101.8 Å²	101.8	49%	0.492	59%	0.586	S	S	.	*	H	α-helix	trans	-61.7	-38.9	175.7	-75.1	-20.6	0	0	0	111.9	I63 A64 M70 G71	I63-N67 WeakPolarHBondContact O-CB 3.47Å; I63-N67 VanDerWaalsContact O-CG 3.27Å; I63-N67 PolarHBondContact O-N 3.36Å; I63-N67 PolarHBondContact O-ND2 2.8Å; A64-N67 PolarHBondContact O-N 3.2Å; N67-M70 WeakPolarHBondContact OD1-CE 3.44Å; N67-G71 PolarHBondContact O-N 2.86Å
68	K	86.3	Confident	73	Confident	157 Å²	157	105.8 Å²	105.8	68%	0.683	60%	0.601	S	S	*	*	H	α-helix	trans	-63.1	-42.6	173.3	-172.8	176.3	-179.3	179	0	112	A64 D65 L66 G71 S72	A64-K68 WeakPolarHBondContact O-CB 3.36Å; A64-K68 PolarHBondContact O-N 2.75Å; D65-K68 PolarHBondContact O-N 3.28Å; L66-K68 VanDerWaalsContact C-N 3.31Å; L66-K68 PolarHBondContact O-N 3.13Å; K68-G71 PolarHBondContact O-N 3.33Å; K68-S72 PolarHBondContact O-N 3.05Å; K68-S72 VanDerWaalsContact O-N 3.09Å
69	K	84.8	Confident	70.9	Confident	125 Å²	125	108 Å²	108	54%	0.543	62%	0.617	S	S	.	*	H	α-helix	trans	-68.7	-43.5	176.4	-74	169.5	-177.6	171.7	0	112.3	D65 L66 G71 S72 L73	D65-K69 WeakPolarHBondContact O-CB 3.36Å; D65-K69 VanDerWaalsContact O-CG 3.3Å; D65-K69 WeakPolarHBondContact O-CG 3.21Å; D65-K69 PolarHBondContact O-N 3.36Å; L66-K69 PolarHBondContact O-N 3.41Å; K69-G71 VanDerWaalsContact C-N 3.33Å; K69-G71 PolarHBondContact O-N 3.4Å; K69-S72 WeakPolarHBondContact CA-OG 3.49Å; K69-S72 PolarHBondContact O-N 3.14Å; K69-S72 VanDerWaalsContact O-N 3.12Å; K69-S72 PolarHBondContact O-OG 2.9Å; K69-L73 WeakPolarHBondContact O-CG 3.37Å; K69-L73 PolarHBondContact O-N 3.31Å; K69-L73 VanDerWaalsContact O-N 3.1Å
70	M	77.4	Confident	68.5	Low	112 Å²	112	106.6 Å²	106.6	55%	0.552	63%	0.628	S	S	*	*	H	α-helix	trans	-62.9	-38.7	173.7	-69.1	-171.8	-60.3	0	0	111.7	L66 N67 S72 L73	L66-M70 WeakPolarHBondContact O-CB 3.43Å; L66-M70 WeakPolarHBondContact O-CG 3.46Å; L66-M70 PolarHBondContact O-N 3.26Å; N67-M70 WeakPolarHBondContact OD1-CE 3.44Å; M70-S72 VanDerWaalsContact C-N 3.28Å; M70-S72 PolarHBondContact O-N 3.35Å; M70-L73 PolarHBondContact O-N 3.28Å; M70-L73 VanDerWaalsContact O-N 3.07Å
71	G	70.1	Confident	65.6	Low	61 Å²	61	108.5 Å²	108.5	63%	0.629	64%	0.638	S	S	*	*	H	α-helix	trans	-62.5	-31.1	172.3	0	0	0	0	0	113.8	N67 K68 K69	N67-G71 PolarHBondContact O-N 2.86Å; K68-G71 PolarHBondContact O-N 3.33Å; K69-G71 VanDerWaalsContact C-N 3.33Å; K69-G71 PolarHBondContact O-N 3.4Å
72	S	62.8	Low	63.5	Low	91 Å²	91	111.9 Å²	111.9	64%	0.636	66%	0.656	S	S	*	*	H	α-helix	trans	-78.8	-16.7	172.4	69.1	0	0	0	0	114.2	K68 K69 M70 K74	K68-S72 PolarHBondContact O-N 3.05Å; K68-S72 VanDerWaalsContact O-N 3.09Å; K69-S72 WeakPolarHBondContact CA-OG 3.49Å; K69-S72 PolarHBondContact O-N 3.14Å; K69-S72 VanDerWaalsContact O-N 3.12Å; K69-S72 PolarHBondContact O-OG 2.9Å; M70-S72 VanDerWaalsContact C-N 3.28Å; M70-S72 PolarHBondContact O-N 3.35Å; S72-K74 VanDerWaalsContact C-N 3.3Å; S72-K74 PolarHBondContact O-N 3.2Å
73	L	52.3	Low	60.7	Low	143 Å²	143	117.6 Å²	117.6	75%	0.749	67%	0.671	S	S	*	*			trans	-91.6	56	177.3	-69.2	171.5	0	0	0	111.3	K69 M70	K69-L73 WeakPolarHBondContact O-CG 3.37Å; K69-L73 PolarHBondContact O-N 3.31Å; K69-L73 VanDerWaalsContact O-N 3.1Å; M70-L73 PolarHBondContact O-N 3.28Å; M70-L73 VanDerWaalsContact O-N 3.07Å
74	K	49.8	Very low	58.5	Low	190 Å²	190	119.9 Å²	119.9	83%	0.826	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-90.4	127	165.4	-160.2	155	-173.4	170.7	0	109	S72	S72-K74 VanDerWaalsContact C-N 3.3Å; S72-K74 PolarHBondContact O-N 3.2Å
75	A	43.9	Very low	56.3	Low	76 Å²	76	123.2 Å²	123.2	63%	0.628	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-61.5	155.1	-171.2	0	0	0	0	0	113.1	S77	A75-S77 PolarHBondContact O-N 2.83Å
76	P	41.6	Very low	53.7	Low	134 Å²	134	130.2 Å²	130.2	87%	0.87	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-59.7	124.5	177.5	-17	29.9	0	0	0	110
77	S	40.7	Very low	51.5	Low	114 Å²	114	132.3 Å²	132.3	80%	0.797	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-91	137.7	168.1	-55.7	0	0	0	0	108.5	A75	A75-S77 PolarHBondContact O-N 2.83Å
78	D	34.8	Very low	49.1	Very low	157 Å²	157	133.5 Å²	133.5	84%	0.84	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-56.1	148.7	-174.2	-106.4	-38.3	0	0	0	113.4	G80	D78-G80 PolarHBondContact O-N 3.13Å; D78-G80 VanDerWaalsContact O-N 3.09Å
79	P	48.7	Very low	46.7	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	77%	0.771	S	S	*	*	S	Bend	trans	-82.5	89.7	-176.7	33.7	-31.9	0	0	0	110.6
80	G	42	Very low	44.3	Very low	72 Å²	72	136.5 Å²	136.5	74%	0.742	78%	0.782	S	S	*	*			trans	-169.3	41.6	-171.1	0	0	0	0	0	119.7	D78	D78-G80 PolarHBondContact O-N 3.13Å; D78-G80 VanDerWaalsContact O-N 3.09Å
81	D	29.8	Very low	42.2	Very low	149 Å²	149	139.1 Å²	139.1	80%	0.797	80%	0.797	S	S	*	*			trans	-157	138.9	142.9	-146.2	-18.2	0	0	0	112.6
82	T	45.4	Very low	40.9	Very low	141 Å²	141	142.4 Å²	142.4	87%	0.865	81%	0.805	S	S	*	*			trans	-113.2	86.5	179.3	42.5	0	0	0	0	110.6
83	R	35.3	Very low	39.6	Very low	219 Å²	219	143.2 Å²	143.2	83%	0.826	81%	0.808	S	S	*	*			trans	-147.9	124.7	172.1	-139.6	173.4	-166.4	164.4	5.1	112.7	P85	R83-P85 WeakPolarHBondContact O-CD 3.42Å
84	P	42.6	Very low	39	Very low	125 Å²	125	142 Å²	142	81%	0.812	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-85.9	128.4	179.2	32.3	-32.3	0	0	0	111.9
85	P	39.7	Very low	38.3	Very low	127 Å²	127	140.2 Å²	140.2	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-91.2	152.8	161.9	8.9	10.4	0	0	0	111.6	R83	R83-P85 WeakPolarHBondContact O-CD 3.42Å
86	R	32.8	Very low	38.1	Very low	229 Å²	229	144.1 Å²	144.1	86%	0.864	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-73	160.7	-173.1	-73.8	171.1	171.8	161.6	-5.1	113.6	S88	R86-S88 PolarHBondContact O-N 3.18Å
87	P	38.3	Very low	37.8	Very low	137 Å²	137	145.6 Å²	145.6	89%	0.89	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-66.3	116.4	175.9	27.5	-35.3	0	0	0	111.8
88	S	31.9	Very low	37.5	Very low	116 Å²	116	145.4 Å²	145.4	81%	0.811	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-99	120.2	170.4	39.1	0	0	0	0	111.3	R86	R86-S88 PolarHBondContact O-N 3.18Å
89	R	36.3	Very low	37.3	Very low	226 Å²	226	147 Å²	147	85%	0.853	82%	0.818	S	S	*	*			trans	-34.2	137.5	169.4	-173.4	-177.7	-170.7	-173.2	3.3	114	L91	R89-L91 PolarHBondContact O-N 3.03Å
90	P	34.5	Very low	36.5	Very low	119 Å²	119	151.3 Å²	151.3	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-62.3	125.7	173.9	-20.1	32.1	0	0	0	111.8
91	L	33.7	Very low	35.9	Very low	168 Å²	168	156.1 Å²	156.1	88%	0.88	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-87.1	120.4	164.4	-75.5	164.3	0	0	0	108.1	R89	R89-L91 PolarHBondContact O-N 3.03Å
92	V	41	Very low	36.1	Very low	130 Å²	130	155.9 Å²	155.9	79%	0.788	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-79	124.5	172.4	177.3	0	0	0	0	108.3
93	P	36.4	Very low	35.3	Very low	108 Å²	108	160.2 Å²	160.2	70%	0.701	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-65	143.4	170.1	-19.1	32.7	0	0	0	110.8
94	P	40.2	Very low	35.3	Very low	117 Å²	117	155.3 Å²	155.3	76%	0.76	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-74.2	131	-174.4	29.2	-34.4	0	0	0	112.7	L96	P94-L96 PolarHBondContact O-N 3.13Å
95	D	34	Very low	34.5	Very low	153 Å²	153	154.5 Å²	154.5	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.9	169.2	-97.2	-35.2	0	0	0	111.2	L97	D95-L97 VanDerWaalsContact C-N 3.35Å; D95-L97 PolarHBondContact O-N 2.88Å
96	L	40	Very low	34.5	Very low	158 Å²	158	153.9 Å²	153.9	83%	0.827	82%	0.817	S	S	*	*	S	Bend	trans	-92.2	56.2	173.1	-72.9	178.1	0	0	0	112.1	P94	P94-L96 PolarHBondContact O-N 3.13Å
97	L	35.7	Very low	34.4	Very low	165 Å²	165	152.5 Å²	152.5	86%	0.864	82%	0.82	S	S	*	*			trans	-138.4	50.5	169	-74.7	-178.7	0	0	0	112.6	D95	D95-L97 VanDerWaalsContact C-N 3.35Å; D95-L97 PolarHBondContact O-N 2.88Å
98	S	34	Very low	33.9	Very low	109 Å²	109	151.2 Å²	151.2	76%	0.762	81%	0.814	S	S	*	*			trans	-97.8	75.5	173.9	50.7	0	0	0	0	112.7
99	H	30.4	Very low	33.8	Very low	192 Å²	192	151.5 Å²	151.5	89%	0.889	82%	0.816	S	S	*	*			trans	-101.5	117.9	160.7	-88	-82.4	0	0	0	111.1
100	R	33.2	Very low	33.3	Very low	217 Å²	217	146.5 Å²	146.5	82%	0.819	82%	0.816	S	S	*	*			trans	-38.9	132.4	-179	-69.5	169.7	165.4	175.8	-5.8	114.6	L102	R100-L102 HydrophobicContact CB-CD1 4.35Å; R100-L102 HydrophobicContact CG-CD1 4.04Å
101	L	28.5	Very low	33	Very low	173 Å²	173	145.4 Å²	145.4	91%	0.906	82%	0.817	S	S	*	*			trans	-122.3	100.7	130.6	-79.1	175	0	0	0	108.7	R103	L101-R103 PolarHBondContact O-N 3.42Å
102	L	34.5	Very low	32.9	Very low	144 Å²	144	143.2 Å²	143.2	75%	0.754	82%	0.816	S	S	*	*			trans	-67.5	120.1	161.3	-95	79.2	0	0	0	107.6	R100	R100-L102 HydrophobicContact CB-CD1 4.35Å; R100-L102 HydrophobicContact CG-CD1 4.04Å
103	R	28.7	Very low	32.4	Very low	232 Å²	232	142.3 Å²	142.3	88%	0.875	82%	0.821	S	S	*	*			trans	-135.6	90.1	153.7	-165.7	170.8	-173.7	158.3	2.6	109	L101	L101-R103 PolarHBondContact O-N 3.42Å
104	S	34.1	Very low	32.1	Very low	116 Å²	116	141.9 Å²	141.9	81%	0.811	83%	0.827	S	S	*	*			trans	-57.8	134.2	162.7	45.7	0	0	0	0	109.5
105	S	26.4	Very low	31.7	Very low	109 Å²	109	141 Å²	141	76%	0.762	83%	0.83	S	S	*	*			trans	-141.6	145.4	164.9	-145.3	0	0	0	0	107.6
106	P	39.7	Very low	31.5	Very low	114 Å²	114	139.6 Å²	139.6	74%	0.74	83%	0.832	S	S	*	*			trans	-85.1	157.7	-147.7	32.4	-36.8	0	0	0	114.5	S108	P106-S108 PolarHBondContact O-N 3.46Å
107	E	30.8	Very low	31.4	Very low	199 Å²	199	140.5 Å²	140.5	93%	0.93	83%	0.829	S	S	*	*			trans	-56.3	131.2	164.5	-72.4	160.1	109.1	0	0	110.8
108	S	28.9	Very low	31.2	Very low	111 Å²	111	141 Å²	141	78%	0.776	83%	0.827	S	S	*	*			trans	-121.4	100.7	160.3	42	0	0	0	0	108.3	P106 S110	P106-S108 PolarHBondContact O-N 3.46Å; S108-S110 PolarHBondContact O-N 3.02Å
109	S	27.9	Very low	31.6	Very low	121 Å²	121	140.6 Å²	140.6	85%	0.846	82%	0.822	S	S	*	*			trans	-62.2	129.3	177.3	54	0	0	0	0	111.4
110	S	26.9	Very low	32.1	Very low	121 Å²	121	136.6 Å²	136.6	85%	0.846	82%	0.822	S	S	*	*			trans	-141.5	98.3	155.3	39.8	0	0	0	0	110	S108	S108-S110 PolarHBondContact O-N 3.02Å
111	A	28.7	Very low	32.1	Very low	96 Å²	96	131.9 Å²	131.9	79%	0.793	82%	0.817	S	S	*	*			trans	-83	136.7	171.7	0	0	0	0	0	110.1
112	S	30.3	Very low	32.6	Very low	123 Å²	123	128.7 Å²	128.7	86%	0.86	81%	0.81	S	S	*	*			trans	-158.6	104.1	146.5	-87.8	0	0	0	0	110.5
113	A	30.6	Very low	32.7	Very low	110 Å²	110	131.4 Å²	131.4	91%	0.909	82%	0.818	S	S	*	*			trans	-77.6	123.8	158.5	0	0	0	0	0	108.4
114	A	30.1	Very low	33.1	Very low	99 Å²	99	123.5 Å²	123.5	82%	0.818	81%	0.809	S	S	*	*			trans	-129.2	102.2	162.7	0	0	0	0	0	107.7
115	A	32.7	Very low	33.7	Very low	99 Å²	99	121 Å²	121	82%	0.818	80%	0.802	S	S	*	*			trans	-72.3	135.4	178.4	0	0	0	0	0	110.5
116	S	29.3	Very low	34.7	Very low	124 Å²	124	118.1 Å²	118.1	87%	0.867	79%	0.79	S	S	*	*			trans	-124.2	126.8	147.9	83.9	0	0	0	0	108.1
117	K	37.8	Very low	35.4	Very low	176 Å²	176	115.1 Å²	115.1	77%	0.765	78%	0.779	S	S	*	*			trans	-98.6	162	178.8	-77.4	179.6	175	176.3	0	109.8
118	H	32.5	Very low	36.8	Very low	175 Å²	175	110.3 Å²	110.3	81%	0.81	76%	0.763	S	S	*	*			trans	104.4	145.6	161	-60.3	-76.1	0	0	0	116.1
119	P	41.7	Very low	38.6	Very low	102 Å²	102	109.4 Å²	109.4	66%	0.662	75%	0.753	S	S	*	*			cis	-129.8	156.8	-50	34	-20	0	0	0	111.6	T121	P119-T121 PolarHBondContact O-N 3.23Å
120	A	40.8	Very low	40.6	Very low	108 Å²	108	111 Å²	111	89%	0.893	74%	0.74	S	S	*	*			trans	-74.9	111.3	173.8	0	0	0	0	0	110.9
121	T	33.6	Very low	42.8	Very low	117 Å²	117	109.2 Å²	109.2	72%	0.718	73%	0.725	S	S	*	*			trans	-124.7	103.8	162.5	49.1	0	0	0	0	110.3	P119	P119-T121 PolarHBondContact O-N 3.23Å
122	S	37.9	Very low	44.9	Very low	107 Å²	107	109.9 Å²	109.9	75%	0.748	71%	0.711	S	S	*	*			trans	51.3	123.1	149.4	61.2	0	0	0	0	120.8
123	Q	37.8	Very low	46.9	Very low	200 Å²	200	107.8 Å²	107.8	94%	0.935	69%	0.69	S	S	*	*			trans	89.7	114.1	133.2	-154	169.2	17.8	0	0	118.3
124	G	36.1	Very low	49.3	Very low	66 Å²	66	107.4 Å²	107.4	68%	0.68	67%	0.669	S	S	*	*			trans	134.1	125	170	0	0	0	0	0	112.5	G126	G124-G126 PolarHBondContact O-N 3.45Å
125	G	47.4	Very low	51.7	Low	64 Å²	64	109.1 Å²	109.1	66%	0.66	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	4.1	-178.6	0	0	0	0	0	115.9	G127	G125-G127 VanDerWaalsContact C-N 3.28Å; G125-G127 PolarHBondContact O-N 2.97Å
126	G	46.8	Very low	54.2	Low	49 Å²	49	108.2 Å²	108.2	51%	0.505	65%	0.645	S	S	.	*	H	α-helix	trans	-66.9	-22.1	-179.8	0	0	0	0	0	114.6	G124 V129 W130	G124-G126 PolarHBondContact O-N 3.45Å; G126-V129 PolarHBondContact O-N 2.89Å; G126-W130 VanDerWaalsContact O-CB 3.31Å; G126-W130 WeakPolarHBondContact O-CB 3.5Å; G126-W130 PolarHBondContact O-N 3.15Å
127	G	54.2	Low	56.4	Low	51 Å²	51	106.5 Å²	106.5	53%	0.526	63%	0.625	S	S	.	*	H	α-helix	trans	-63.6	-43.7	178.3	0	0	0	0	0	113.1	G125 W130 T131	G125-G127 VanDerWaalsContact C-N 3.28Å; G125-G127 PolarHBondContact O-N 2.97Å; G127-W130 PolarHBondContact O-N 2.84Å; G127-T131 PolarHBondContact O-N 3.34Å; G127-T131 PolarHBondContact O-OG1 3.19Å
128	V	59.8	Low	58.2	Low	97 Å²	97	100.7 Å²	100.7	59%	0.588	61%	0.607	S	S	*	*	H	α-helix	trans	-67.7	-44.4	176.9	-179	0	0	0	0	110.3	W130 T131 Q132	V128-W130 VanDerWaalsContact C-N 3.3Å; V128-W130 PolarHBondContact O-N 3.43Å; V128-T131 WeakPolarHBondContact CA-OG1 3.45Å; V128-T131 PolarHBondContact O-N 2.87Å; V128-T131 PolarHBondContact O-OG1 3.32Å; V128-Q132 WeakPolarHBondContact O-CB 3.44Å; V128-Q132 PolarHBondContact O-N 2.88Å
129	V	68.1	Low	60.3	Low	93 Å²	93	95.9 Å²	95.9	56%	0.564	59%	0.593	S	S	*	*	H	α-helix	trans	-62.5	-37	177.1	-179.5	0	0	0	0	111.3	G126 Q132 L133	G126-V129 PolarHBondContact O-N 2.89Å; V129-Q132 PolarHBondContact O-N 2.91Å; V129-L133 WeakPolarHBondContact O-CB 3.44Å; V129-L133 PolarHBondContact O-N 2.93Å
130	W	69	Low	61.8	Low	154 Å²	154	94.2 Å²	94.2	58%	0.583	58%	0.581	S	S	*	*	H	α-helix	trans	-68	-45.5	175.6	-177.9	-104.7	0	0	0	112.1	G126 G127 V128 Q132 L133 Q134	G126-W130 VanDerWaalsContact O-CB 3.31Å; G126-W130 WeakPolarHBondContact O-CB 3.5Å; G126-W130 PolarHBondContact O-N 3.15Å; G127-W130 PolarHBondContact O-N 2.84Å; V128-W130 VanDerWaalsContact C-N 3.3Å; V128-W130 PolarHBondContact O-N 3.43Å; W130-Q132 VanDerWaalsContact C-N 3.27Å; W130-Q132 PolarHBondContact O-N 3.24Å; W130-L133 HydrophobicContact CE3-CD2 4.13Å; W130-L133 HydrophobicContact CZ3-CD2 4Å; W130-L133 PolarHBondContact O-N 3.12Å; W130-Q134 VanDerWaalsContact O-CB 3.28Å; W130-Q134 WeakPolarHBondContact O-CB 3.39Å; W130-Q134 PolarHBondContact O-N 3.18Å
131	T	73.8	Confident	63.5	Low	84 Å²	84	95.5 Å²	95.5	52%	0.515	57%	0.568	S	S	.	*	H	α-helix	trans	-62.2	-36.8	174.6	46.1	0	0	0	0	112.3	G127 V128 Q134 E135	G127-T131 PolarHBondContact O-N 3.34Å; G127-T131 PolarHBondContact O-OG1 3.19Å; V128-T131 WeakPolarHBondContact CA-OG1 3.45Å; V128-T131 PolarHBondContact O-N 2.87Å; V128-T131 PolarHBondContact O-OG1 3.32Å; T131-Q134 PolarHBondContact O-N 3.09Å; T131-E135 WeakPolarHBondContact O-CB 3.23Å; T131-E135 PolarHBondContact O-N 3.05Å
132	Q	72.2	Confident	65	Low	110 Å²	110	95 Å²	95	51%	0.514	56%	0.561	S	S	.	*	H	α-helix	trans	-76.6	-34.6	-179.1	-160.8	164.2	24.5	0	0	111.9	V128 V129 W130 E135 V136	V128-Q132 WeakPolarHBondContact O-CB 3.44Å; V128-Q132 PolarHBondContact O-N 2.88Å; V129-Q132 PolarHBondContact O-N 2.91Å; W130-Q132 VanDerWaalsContact C-N 3.27Å; W130-Q132 PolarHBondContact O-N 3.24Å; Q132-E135 PolarHBondContact O-N 3.39Å; Q132-V136 WeakPolarHBondContact O-CB 3.49Å; Q132-V136 VanDerWaalsContact O-CG2 3.27Å; Q132-V136 WeakPolarHBondContact O-CG2 3.49Å; Q132-V136 PolarHBondContact O-N 3.2Å
133	L	73.7	Confident	66.3	Low	78 Å²	78	91.9 Å²	91.9	41%	0.408	54%	0.539	S	S	.	.	H	α-helix	trans	-66.1	-40.6	168.6	179.2	62.1	0	0	0	111	V129 W130 V136 L137	V129-L133 WeakPolarHBondContact O-CB 3.44Å; V129-L133 PolarHBondContact O-N 2.93Å; W130-L133 HydrophobicContact CE3-CD2 4.13Å; W130-L133 HydrophobicContact CZ3-CD2 4Å; W130-L133 PolarHBondContact O-N 3.12Å; L133-V136 PolarHBondContact O-N 2.96Å; L133-L137 HydrophobicContact CD1-CD1 4.23Å; L133-L137 HydrophobicContact CD1-CG 4.24Å; L133-L137 HydrophobicContact CG-CD1 4Å; L133-L137 HydrophobicContact CG-CG 4.43Å; L133-L137 WeakPolarHBondContact O-CB 3.28Å; L133-L137 VanDerWaalsContact O-CG 3.23Å; L133-L137 WeakPolarHBondContact O-CG 3.09Å; L133-L137 PolarHBondContact O-N 3.15Å
134	Q	79.8	Confident	67.4	Low	103 Å²	103	85.9 Å²	85.9	48%	0.481	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-39.4	176.2	-171.8	167.9	-15.5	0	0	111.4	W130 T131 L137 S138	W130-Q134 VanDerWaalsContact O-CB 3.28Å; W130-Q134 WeakPolarHBondContact O-CB 3.39Å; W130-Q134 PolarHBondContact O-N 3.18Å; T131-Q134 PolarHBondContact O-N 3.09Å; Q134-L137 PolarHBondContact O-N 3.05Å; Q134-S138 WeakPolarHBondContact O-CB 3.42Å; Q134-S138 PolarHBondContact O-N 2.98Å; Q134-S138 PolarHBondContact O-OG 3Å
135	E	80.6	Confident	68.3	Low	135 Å²	135	85.3 Å²	85.3	63%	0.631	50%	0.499	S	S	*	.	H	α-helix	trans	-63.4	-43.5	172	-176	178.2	-163.3	0	0	112.2	T131 Q132 S138 S139	T131-E135 WeakPolarHBondContact O-CB 3.23Å; T131-E135 PolarHBondContact O-N 3.05Å; Q132-E135 PolarHBondContact O-N 3.39Å; E135-S138 PolarHBondContact O-N 2.94Å; E135-S139 VanDerWaalsContact O-CB 3.25Å; E135-S139 WeakPolarHBondContact O-CB 3.4Å; E135-S139 PolarHBondContact O-N 3.46Å
136	V	84.8	Confident	68.5	Low	80 Å²	80	88.4 Å²	88.4	49%	0.485	49%	0.494	S	S	.	.	H	α-helix	trans	-65.5	-41.3	174.7	168.5	0	0	0	0	111.5	Q132 L133 S139 V140	Q132-V136 WeakPolarHBondContact O-CB 3.49Å; Q132-V136 VanDerWaalsContact O-CG2 3.27Å; Q132-V136 WeakPolarHBondContact O-CG2 3.49Å; Q132-V136 PolarHBondContact O-N 3.2Å; L133-V136 PolarHBondContact O-N 2.96Å; V136-S139 PolarHBondContact O-N 2.64Å; V136-V140 HydrophobicContact CG1-CG2 4.46Å; V136-V140 WeakPolarHBondContact O-CB 3.24Å; V136-V140 VanDerWaalsContact O-CG2 3.26Å; V136-V140 WeakPolarHBondContact O-CG2 3.4Å; V136-V140 PolarHBondContact O-N 3.4Å
137	L	76.3	Confident	68.9	Low	88 Å²	88	92.6 Å²	92.6	46%	0.461	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-42.4	176.3	-73.9	171.4	0	0	0	111.5	L133 Q134 V140 E141	L133-L137 HydrophobicContact CD1-CD1 4.23Å; L133-L137 HydrophobicContact CD1-CG 4.24Å; L133-L137 HydrophobicContact CG-CD1 4Å; L133-L137 HydrophobicContact CG-CG 4.43Å; L133-L137 WeakPolarHBondContact O-CB 3.28Å; L133-L137 VanDerWaalsContact O-CG 3.23Å; L133-L137 WeakPolarHBondContact O-CG 3.09Å; L133-L137 PolarHBondContact O-N 3.15Å; Q134-L137 PolarHBondContact O-N 3.05Å; L137-V140 PolarHBondContact O-N 2.91Å; L137-E141 WeakPolarHBondContact O-CB 3.45Å; L137-E141 WeakPolarHBondContact O-CG 3.36Å; L137-E141 PolarHBondContact O-N 2.98Å
138	S	75.5	Confident	68.7	Low	53 Å²	53	98.7 Å²	98.7	37%	0.371	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-43.4	172.6	-63.5	0	0	0	0	111.7	Q134 E135 V140 E141 D142	Q134-S138 WeakPolarHBondContact O-CB 3.42Å; Q134-S138 PolarHBondContact O-N 2.98Å; Q134-S138 PolarHBondContact O-OG 3Å; E135-S138 PolarHBondContact O-N 2.94Å; S138-V140 VanDerWaalsContact C-N 3.31Å; S138-V140 PolarHBondContact O-N 2.92Å; S138-E141 CarbonylContact O-C 3.58Å; S138-E141 PolarHBondContact O-N 3.04Å; S138-D142 WeakPolarHBondContact O-CB 3.37Å; S138-D142 PolarHBondContact O-N 3.44Å
139	S	75.8	Confident	68.3	Low	74 Å²	74	99.4 Å²	99.4	52%	0.517	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-35.3	174.8	-179.9	0	0	0	0	112.9	E135 V136 S143	E135-S139 VanDerWaalsContact O-CB 3.25Å; E135-S139 WeakPolarHBondContact O-CB 3.4Å; E135-S139 PolarHBondContact O-N 3.46Å; V136-S139 PolarHBondContact O-N 2.64Å; S139-S143 WeakPolarHBondContact O-CB 3.39Å; S139-S143 PolarHBondContact O-N 2.7Å
140	V	73.6	Confident	67.1	Low	68 Å²	68	103.2 Å²	103.2	41%	0.412	51%	0.511	S	S	.	.	H	α-helix	trans	-72.9	-41.6	173.6	167.5	0	0	0	0	111.2	V136 L137 S138 D142 S143 I144	V136-V140 HydrophobicContact CG1-CG2 4.46Å; V136-V140 WeakPolarHBondContact O-CB 3.24Å; V136-V140 VanDerWaalsContact O-CG2 3.26Å; V136-V140 WeakPolarHBondContact O-CG2 3.4Å; V136-V140 PolarHBondContact O-N 3.4Å; L137-V140 PolarHBondContact O-N 2.91Å; S138-V140 VanDerWaalsContact C-N 3.31Å; S138-V140 PolarHBondContact O-N 2.92Å; V140-D142 VanDerWaalsContact C-N 3.33Å; V140-S143 PolarHBondContact O-N 3.26Å; V140-I144 HydrophobicContact CG1-CD1 3.64Å; V140-I144 HydrophobicContact CG1-CG1 4.38Å; V140-I144 WeakPolarHBondContact O-CB 3.32Å; V140-I144 WeakPolarHBondContact O-CD1 3.4Å; V140-I144 WeakPolarHBondContact O-CG1 3.31Å; V140-I144 PolarHBondContact O-N 3.43Å
141	E	75.8	Confident	65.9	Low	135 Å²	135	98.9 Å²	98.9	63%	0.631	51%	0.508	S	S	*	.	H	α-helix	trans	-63.2	-37.8	172.7	-76.8	-169.5	133.5	0	0	111.8	L137 S138 I144 S145	L137-E141 WeakPolarHBondContact O-CB 3.45Å; L137-E141 WeakPolarHBondContact O-CG 3.36Å; L137-E141 PolarHBondContact O-N 2.98Å; S138-E141 CarbonylContact O-C 3.58Å; S138-E141 PolarHBondContact O-N 3.04Å; E141-I144 CarbonylContact O-C 3.59Å; E141-I144 PolarHBondContact O-N 3.37Å; E141-S145 WeakPolarHBondContact O-CA 3.33Å; E141-S145 WeakPolarHBondContact O-CB 3.35Å; E141-S145 PolarHBondContact O-N 3.49Å; E141-S145 PolarHBondContact O-OG 3.13Å
142	D	65.6	Low	64.3	Low	105 Å²	105	97.3 Å²	97.3	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-68.9	-39.2	173.1	-75	-26.6	0	0	0	111.8	S138 V140 I144 S145 F146	S138-D142 WeakPolarHBondContact O-CB 3.37Å; S138-D142 PolarHBondContact O-N 3.44Å; V140-D142 VanDerWaalsContact C-N 3.33Å; D142-I144 VanDerWaalsContact C-N 3.33Å; D142-I144 PolarHBondContact O-N 2.93Å; D142-S145 WeakPolarHBondContact CA-OG 3.25Å; D142-S145 PolarHBondContact O-N 3.22Å; D142-S145 PolarHBondContact O-OG 3.34Å; D142-S145 VanDerWaalsContact O-OG 3.13Å; D142-F146 WeakPolarHBondContact O-CB 3.41Å; D142-F146 PolarHBondContact O-N 2.85Å
143	S	65.9	Low	62.8	Low	43 Å²	43	96.6 Å²	96.6	30%	0.301	51%	0.508	S	S	.	.	H	α-helix	trans	-66.2	-36.5	172.8	-161.9	0	0	0	0	111.9	S139 V140 R147	S139-S143 WeakPolarHBondContact O-CB 3.39Å; S139-S143 PolarHBondContact O-N 2.7Å; V140-S143 PolarHBondContact O-N 3.26Å; S143-R147 WeakPolarHBondContact O-CB 3.46Å; S143-R147 WeakPolarHBondContact O-CD 3.48Å; S143-R147 WeakPolarHBondContact O-CG 3.42Å; S143-R147 PolarHBondContact O-N 2.9Å; S143-R147 PolarHBondContact O-NE 3.48Å; S143-R147 PolarHBondContact OG-NE 3.14Å; S143-R147 PolarHBondContact OG-NH2 2.86Å; S143-R147 VanDerWaalsContact OG-NH2 3.15Å
144	I	60.6	Low	61.6	Low	74 Å²	74	97.1 Å²	97.1	38%	0.379	51%	0.511	S	S	.	.	H	α-helix	trans	-75.4	-37.9	177.1	-69.9	167	0	0	0	111	V140 E141 D142 R147 R148	V140-I144 HydrophobicContact CG1-CD1 3.64Å; V140-I144 HydrophobicContact CG1-CG1 4.38Å; V140-I144 WeakPolarHBondContact O-CB 3.32Å; V140-I144 WeakPolarHBondContact O-CD1 3.4Å; V140-I144 WeakPolarHBondContact O-CG1 3.31Å; V140-I144 PolarHBondContact O-N 3.43Å; E141-I144 CarbonylContact O-C 3.59Å; E141-I144 PolarHBondContact O-N 3.37Å; D142-I144 VanDerWaalsContact C-N 3.33Å; D142-I144 PolarHBondContact O-N 2.93Å; I144-R147 PolarHBondContact O-N 2.83Å; I144-R148 WeakPolarHBondContact O-CB 3.37Å; I144-R148 WeakPolarHBondContact O-CG 3.49Å; I144-R148 PolarHBondContact O-N 3.48Å
145	S	54.6	Low	60.2	Low	54 Å²	54	96.7 Å²	96.7	38%	0.378	52%	0.515	S	S	.	.	H	α-helix	trans	-70.4	-42.8	177.2	77	0	0	0	0	110.3	E141 D142 R148 T149	E141-S145 WeakPolarHBondContact O-CA 3.33Å; E141-S145 WeakPolarHBondContact O-CB 3.35Å; E141-S145 PolarHBondContact O-N 3.49Å; E141-S145 PolarHBondContact O-OG 3.13Å; D142-S145 WeakPolarHBondContact CA-OG 3.25Å; D142-S145 PolarHBondContact O-N 3.22Å; D142-S145 PolarHBondContact O-OG 3.34Å; D142-S145 VanDerWaalsContact O-OG 3.13Å; S145-R148 CarbonylContact O-C 3.56Å; S145-R148 PolarHBondContact O-N 2.87Å; S145-R148 VanDerWaalsContact O-N 3.16Å; S145-T149 PolarHBondContact O-N 3.17Å; S145-T149 PolarHBondContact O-OG1 3.4Å
146	F	52.9	Low	58.7	Low	128 Å²	128	93.3 Å²	93.3	56%	0.561	51%	0.51	S	S	*	.	H	α-helix	trans	-55.9	-53.6	169.4	-173.3	-102.2	0	0	0	110.4	D142 R148 T149 W150	D142-F146 WeakPolarHBondContact O-CB 3.41Å; D142-F146 PolarHBondContact O-N 2.85Å; F146-R148 VanDerWaalsContact C-N 3.29Å; F146-R148 PolarHBondContact O-N 2.79Å; F146-T149 WeakPolarHBondContact O-CB 3.49Å; F146-T149 PolarHBondContact O-N 2.92Å; F146-W150 AromaticContact CD1-CD1 3.74Å; F146-W150 AromaticContact CD1-NE1 3.77Å; F146-W150 AromaticContact CD2-NE1 3.92Å; F146-W150 AromaticContact CE1-CD1 3.66Å; F146-W150 AromaticContact CE1-NE1 3.29Å; F146-W150 VanDerWaalsContact CE1-NE1 3.29Å; F146-W150 AromaticContact CE2-NE1 3.45Å; F146-W150 AromaticContact CZ-CD1 3.95Å; F146-W150 HydrophobicContact CZ-CZ2 4.44Å; F146-W150 AromaticContact CZ-NE1 3.12Å; F146-W150 PolarHBondContact O-N 2.96Å; F146-W150 VanDerWaalsContact O-N 3.07Å
147	R	53.5	Low	57	Low	137 Å²	137	92.2 Å²	92.2	52%	0.517	51%	0.506	S	S	.	.	H	α-helix	trans	-58.8	-36.1	175.4	-73.1	168.9	-148.6	-96.3	4	113	S143 I144 W150 A151	S143-R147 WeakPolarHBondContact O-CB 3.46Å; S143-R147 WeakPolarHBondContact O-CD 3.48Å; S143-R147 WeakPolarHBondContact O-CG 3.42Å; S143-R147 PolarHBondContact O-N 2.9Å; S143-R147 PolarHBondContact O-NE 3.48Å; S143-R147 PolarHBondContact OG-NE 3.14Å; S143-R147 PolarHBondContact OG-NH2 2.86Å; S143-R147 VanDerWaalsContact OG-NH2 3.15Å; I144-R147 PolarHBondContact O-N 2.83Å; R147-W150 PolarHBondContact O-N 3.49Å; R147-A151 WeakPolarHBondContact O-CB 3.26Å; R147-A151 PolarHBondContact O-N 3.26Å
148	R	50.8	Low	55.9	Low	180 Å²	180	91.2 Å²	91.2	68%	0.679	50%	0.501	S	S	*	.	H	α-helix	trans	-70.3	-29.8	173.8	-84	-179.2	176.1	147.1	-0.7	113.1	I144 S145 F146 A151 A152	I144-R148 WeakPolarHBondContact O-CB 3.37Å; I144-R148 WeakPolarHBondContact O-CG 3.49Å; I144-R148 PolarHBondContact O-N 3.48Å; S145-R148 CarbonylContact O-C 3.56Å; S145-R148 PolarHBondContact O-N 2.87Å; S145-R148 VanDerWaalsContact O-N 3.16Å; F146-R148 VanDerWaalsContact C-N 3.29Å; F146-R148 PolarHBondContact O-N 2.79Å; R148-A151 CarbonylContact O-C 3.59Å; R148-A151 PolarHBondContact O-N 2.82Å; R148-A152 WeakPolarHBondContact O-CA 3.27Å; R148-A152 WeakPolarHBondContact O-CB 3.14Å; R148-A152 PolarHBondContact O-N 3.21Å
149	T	50.4	Low	55	Low	111 Å²	111	95 Å²	95	68%	0.681	51%	0.513	S	S	*	.	H	α-helix	trans	-70.5	-35.4	173.4	-55.5	0	0	0	0	110.8	S145 F146	S145-T149 PolarHBondContact O-N 3.17Å; S145-T149 PolarHBondContact O-OG1 3.4Å; F146-T149 WeakPolarHBondContact O-CB 3.49Å; F146-T149 PolarHBondContact O-N 2.92Å
150	W	43.6	Very low	54.2	Low	173 Å²	173	96.3 Å²	96.3	66%	0.655	51%	0.514	S	S	*	.	H	α-helix	trans	-78.4	-24.4	171.2	-67.9	102.9	0	0	0	114.3	F146 R147	F146-W150 AromaticContact CD1-CD1 3.74Å; F146-W150 AromaticContact CD1-NE1 3.77Å; F146-W150 AromaticContact CD2-NE1 3.92Å; F146-W150 AromaticContact CE1-CD1 3.66Å; F146-W150 AromaticContact CE1-NE1 3.29Å; F146-W150 VanDerWaalsContact CE1-NE1 3.29Å; F146-W150 AromaticContact CE2-NE1 3.45Å; F146-W150 AromaticContact CZ-CD1 3.95Å; F146-W150 HydrophobicContact CZ-CZ2 4.44Å; F146-W150 AromaticContact CZ-NE1 3.12Å; F146-W150 PolarHBondContact O-N 2.96Å; F146-W150 VanDerWaalsContact O-N 3.07Å; R147-W150 PolarHBondContact O-N 3.49Å
151	A	43.7	Very low	54	Low	63 Å²	63	97 Å²	97	52%	0.521	51%	0.512	S	S	.	.	H	α-helix	trans	-102.1	3.4	178.9	0	0	0	0	0	114	R147 R148	R147-A151 WeakPolarHBondContact O-CB 3.26Å; R147-A151 PolarHBondContact O-N 3.26Å; R148-A151 CarbonylContact O-C 3.59Å; R148-A151 PolarHBondContact O-N 2.82Å
152	A	39.8	Very low	53.3	Low	51 Å²	51	95.7 Å²	95.7	42%	0.421	51%	0.509	S	S	.	.	S	Bend	trans	-59.9	137.5	166.6	0	0	0	0	0	107.9	R148 I154	R148-A152 WeakPolarHBondContact O-CA 3.27Å; R148-A152 WeakPolarHBondContact O-CB 3.14Å; R148-A152 PolarHBondContact O-N 3.21Å; A152-I154 PolarHBondContact O-N 3.04Å
153	P	41.9	Very low	53.6	Low	96 Å²	96	94 Å²	94	62%	0.623	50%	0.502	S	S	*	.			trans	-58	107.7	-178.5	-26.5	35.6	0	0	0	111.3	T155 A156	P153-T155 VanDerWaalsContact CB-OG1 3.31Å; P153-T155 WeakPolarHBondContact CB-OG1 3.49Å; P153-T155 PolarHBondContact O-N 3.38Å; P153-T155 PolarHBondContact O-OG1 3.35Å; P153-A156 PolarHBondContact O-N 2.92Å; P153-A156 VanDerWaalsContact O-N 3.08Å
154	I	48.4	Very low	54.1	Low	89 Å²	89	97.2 Å²	97.2	46%	0.456	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-10.5	177.3	-62	176.4	0	0	0	111	A152 A156 S157 D158	A152-I154 PolarHBondContact O-N 3.04Å; I154-A156 PolarHBondContact O-N 3Å; I154-A156 VanDerWaalsContact O-N 3.14Å; I154-S157 CarbonylContact O-C 3.59Å; I154-S157 WeakPolarHBondContact O-CA 3.31Å; I154-S157 PolarHBondContact O-N 3.42Å; I154-D158 PolarHBondContact O-N 3.22Å
155	T	50.7	Low	54.8	Low	94 Å²	94	99.5 Å²	99.5	58%	0.577	52%	0.522	S	S	*	.	H	α-helix	trans	-49.7	-33.4	166.6	55.8	0	0	0	0	113.8	P153 Q159	P153-T155 VanDerWaalsContact CB-OG1 3.31Å; P153-T155 WeakPolarHBondContact CB-OG1 3.49Å; P153-T155 PolarHBondContact O-N 3.38Å; P153-T155 PolarHBondContact O-OG1 3.35Å; T155-Q159 WeakPolarHBondContact O-CB 3.38Å; T155-Q159 VanDerWaalsContact O-CG 3.25Å; T155-Q159 WeakPolarHBondContact O-CG 3.42Å; T155-Q159 PolarHBondContact O-N 3Å
156	A	48.1	Very low	56.2	Low	63 Å²	63	103 Å²	103	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-75.1	-31.6	175	0	0	0	0	0	112.9	P153 I154 N160	P153-A156 PolarHBondContact O-N 2.92Å; P153-A156 VanDerWaalsContact O-N 3.08Å; I154-A156 PolarHBondContact O-N 3Å; I154-A156 VanDerWaalsContact O-N 3.14Å; A156-N160 PolarHBondContact O-N 3.32Å
157	S	50	Low	57.8	Low	58 Å²	58	103.8 Å²	103.8	41%	0.406	54%	0.535	S	S	.	.	H	α-helix	trans	-78.4	-37	175	178.3	0	0	0	0	112.2	I154 N160 K161	I154-S157 CarbonylContact O-C 3.59Å; I154-S157 WeakPolarHBondContact O-CA 3.31Å; I154-S157 PolarHBondContact O-N 3.42Å; S157-N160 PolarHBondContact O-N 2.94Å; S157-K161 WeakPolarHBondContact O-CG 3.36Å; S157-K161 PolarHBondContact O-N 2.92Å; S157-K161 VanDerWaalsContact O-N 3.13Å
158	D	52.8	Low	59.3	Low	66 Å²	66	99.5 Å²	99.5	35%	0.353	53%	0.528	S	S	.	.	H	α-helix	trans	-72.9	-33.1	175.8	-78.5	-8.9	0	0	0	111.5	I154 N160 K161 D162	I154-D158 PolarHBondContact O-N 3.22Å; D158-N160 VanDerWaalsContact C-N 3.35Å; D158-N160 PolarHBondContact O-N 3.3Å; D158-K161 PolarHBondContact O-N 3Å; D158-K161 IonicContact OD1-NZ 3.65Å; D158-K161 PolarHBondContact OD1-NZ 3.2Å; D158-D162 WeakPolarHBondContact O-CB 3.38Å; D158-D162 PolarHBondContact O-N 3.45Å
159	Q	55.9	Low	60.8	Low	133 Å²	133	93.7 Å²	93.7	62%	0.621	52%	0.519	S	S	*	.	H	α-helix	trans	-58.6	-44	169.2	-84	177.5	1.1	0	0	112.3	T155 D162 T163	T155-Q159 WeakPolarHBondContact O-CB 3.38Å; T155-Q159 VanDerWaalsContact O-CG 3.25Å; T155-Q159 WeakPolarHBondContact O-CG 3.42Å; T155-Q159 PolarHBondContact O-N 3Å; Q159-D162 PolarHBondContact O-N 3.09Å; Q159-T163 WeakPolarHBondContact O-CG2 3.44Å; Q159-T163 PolarHBondContact O-N 2.94Å; Q159-T163 PolarHBondContact O-OG1 3.3Å
160	N	59.4	Low	62.4	Low	101 Å²	101	94.5 Å²	94.5	54%	0.54	52%	0.515	S	S	.	.	H	α-helix	trans	-61.7	-45.6	174.7	-81.3	-3.6	0	0	0	111.4	A156 S157 D158 D162 T163 E164	A156-N160 PolarHBondContact O-N 3.32Å; S157-N160 PolarHBondContact O-N 2.94Å; D158-N160 VanDerWaalsContact C-N 3.35Å; D158-N160 PolarHBondContact O-N 3.3Å; N160-D162 PolarHBondContact O-N 3.27Å; N160-T163 PolarHBondContact O-N 3.06Å; N160-T163 PolarHBondContact O-OG1 3.46Å; N160-E164 WeakPolarHBondContact O-CG 3.46Å; N160-E164 PolarHBondContact O-N 3.44Å
161	K	69.6	Low	64.5	Low	83 Å²	83	90.6 Å²	90.6	36%	0.361	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-40.1	175.9	-66.5	173	-155.4	154.9	0	112.7	S157 D158 T163 E164 H165	S157-K161 WeakPolarHBondContact O-CG 3.36Å; S157-K161 PolarHBondContact O-N 2.92Å; S157-K161 VanDerWaalsContact O-N 3.13Å; D158-K161 PolarHBondContact O-N 3Å; D158-K161 IonicContact OD1-NZ 3.65Å; D158-K161 PolarHBondContact OD1-NZ 3.2Å; K161-T163 VanDerWaalsContact C-N 3.33Å; K161-T163 PolarHBondContact O-N 3.49Å; K161-E164 PolarHBondContact O-N 2.99Å; K161-H165 WeakPolarHBondContact O-CB 3.3Å; K161-H165 PolarHBondContact O-CD2 2.9Å; K161-H165 PolarHBondContact O-N 3.04Å
162	D	61.8	Low	66.7	Low	107 Å²	107	92.9 Å²	92.9	57%	0.572	51%	0.507	S	S	*	.	H	α-helix	trans	-64.8	-38.2	176.1	-76.1	-20.7	0	0	0	110.8	D158 Q159 N160 H165 L166	D158-D162 WeakPolarHBondContact O-CB 3.38Å; D158-D162 PolarHBondContact O-N 3.45Å; Q159-D162 PolarHBondContact O-N 3.09Å; N160-D162 PolarHBondContact O-N 3.27Å; D162-H165 PolarHBondContact O-N 3.5Å; D162-L166 VanDerWaalsContact O-CB 3.31Å; D162-L166 WeakPolarHBondContact O-CB 3.15Å; D162-L166 PolarHBondContact O-N 2.85Å
163	T	70.6	Confident	68.7	Low	69 Å²	69	98.7 Å²	98.7	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-70.2	-33.6	172.2	63.5	0	0	0	0	113.4	Q159 N160 K161 L166 R167	Q159-T163 WeakPolarHBondContact O-CG2 3.44Å; Q159-T163 PolarHBondContact O-N 2.94Å; Q159-T163 PolarHBondContact O-OG1 3.3Å; N160-T163 PolarHBondContact O-N 3.06Å; N160-T163 PolarHBondContact O-OG1 3.46Å; K161-T163 VanDerWaalsContact C-N 3.33Å; K161-T163 PolarHBondContact O-N 3.49Å; T163-L166 PolarHBondContact O-N 3.26Å; T163-R167 VanDerWaalsContact O-CB 3.31Å; T163-R167 WeakPolarHBondContact O-CB 3.33Å; T163-R167 PolarHBondContact O-N 2.98Å
164	E	76.2	Confident	71	Confident	111 Å²	111	97.3 Å²	97.3	52%	0.519	51%	0.508	S	S	.	.	H	α-helix	trans	-69	-40.5	173.5	-73.8	169	-175.7	0	0	111	N160 K161 R167 A168	N160-E164 WeakPolarHBondContact O-CG 3.46Å; N160-E164 PolarHBondContact O-N 3.44Å; K161-E164 PolarHBondContact O-N 2.99Å; E164-R167 PolarHBondContact O-N 3.31Å; E164-A168 VanDerWaalsContact O-CB 3.25Å; E164-A168 WeakPolarHBondContact O-CB 3.32Å; E164-A168 PolarHBondContact O-N 3.32Å
165	H	75.9	Confident	73.1	Confident	123 Å²	123	98.1 Å²	98.1	57%	0.569	51%	0.509	S	S	*	.	H	α-helix	trans	-66.5	-39.3	172.6	-70.6	-41	0	0	0	112.2	K161 D162 A169	K161-H165 WeakPolarHBondContact O-CB 3.3Å; K161-H165 PolarHBondContact O-CD2 2.9Å; K161-H165 PolarHBondContact O-N 3.04Å; D162-H165 PolarHBondContact O-N 3.5Å; H165-A169 VanDerWaalsContact O-CB 3.22Å; H165-A169 WeakPolarHBondContact O-CB 3.37Å; H165-A169 PolarHBondContact O-N 3.02Å
166	L	83.2	Confident	74.8	Confident	126 Å²	126	95.6 Å²	95.6	66%	0.66	50%	0.497	S	S	*	.	H	α-helix	trans	-64.2	-44.7	174.1	-165.9	83	0	0	0	111	D162 T163 A169 Q170	D162-L166 VanDerWaalsContact O-CB 3.31Å; D162-L166 WeakPolarHBondContact O-CB 3.15Å; D162-L166 PolarHBondContact O-N 2.85Å; T163-L166 PolarHBondContact O-N 3.26Å; L166-A169 PolarHBondContact O-N 3.08Å; L166-Q170 WeakPolarHBondContact O-CB 3.32Å; L166-Q170 PolarHBondContact O-N 3.48Å
167	R	87.1	Confident	76.5	Confident	146 Å²	146	94.5 Å²	94.5	55%	0.551	48%	0.484	S	S	*	.	H	α-helix	trans	-63.2	-47.6	176.1	-172.1	-175.5	-61.1	152.2	5.8	111.4	T163 E164 A169 Q170 E171	T163-R167 VanDerWaalsContact O-CB 3.31Å; T163-R167 WeakPolarHBondContact O-CB 3.33Å; T163-R167 PolarHBondContact O-N 2.98Å; E164-R167 PolarHBondContact O-N 3.31Å; R167-A169 VanDerWaalsContact C-N 3.29Å; R167-A169 PolarHBondContact O-N 3.36Å; R167-Q170 WeakPolarHBondContact O-CB 3.34Å; R167-Q170 PolarHBondContact O-N 2.93Å; R167-Q170 VanDerWaalsContact O-N 3.16Å; R167-E171 WeakPolarHBondContact CG-OE1 3.23Å; R167-E171 WeakPolarHBondContact O-CB 2.98Å; R167-E171 WeakPolarHBondContact O-CG 3.41Å; R167-E171 PolarHBondContact O-N 3.16Å
168	A	85.3	Confident	78.4	Confident	46 Å²	46	96.6 Å²	96.6	38%	0.38	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-34.6	176.4	0	0	0	0	0	112.4	E164 N172	E164-A168 VanDerWaalsContact O-CB 3.25Å; E164-A168 WeakPolarHBondContact O-CB 3.32Å; E164-A168 PolarHBondContact O-N 3.32Å; A168-N172 WeakPolarHBondContact O-CB 3.35Å; A168-N172 PolarHBondContact O-N 2.79Å
169	A	83.1	Confident	80	Confident	58 Å²	58	98.6 Å²	98.6	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-68.9	-40	173.2	0	0	0	0	0	112.1	H165 L166 R167 N172 W173	H165-A169 VanDerWaalsContact O-CB 3.22Å; H165-A169 WeakPolarHBondContact O-CB 3.37Å; H165-A169 PolarHBondContact O-N 3.02Å; L166-A169 PolarHBondContact O-N 3.08Å; R167-A169 VanDerWaalsContact C-N 3.29Å; R167-A169 PolarHBondContact O-N 3.36Å; A169-N172 PolarHBondContact O-N 3.02Å; A169-W173 WeakPolarHBondContact O-CB 3.25Å; A169-W173 PolarHBondContact O-N 3.27Å
170	Q	83.5	Confident	81.3	Confident	129 Å²	129	96.9 Å²	96.9	60%	0.603	49%	0.49	S	S	*	.	H	α-helix	trans	-64.1	-45.9	174	-173.8	176.4	-0.2	0	0	111.3	L166 R167 N172 W173 T174	L166-Q170 WeakPolarHBondContact O-CB 3.32Å; L166-Q170 PolarHBondContact O-N 3.48Å; R167-Q170 WeakPolarHBondContact O-CB 3.34Å; R167-Q170 PolarHBondContact O-N 2.93Å; R167-Q170 VanDerWaalsContact O-N 3.16Å; Q170-N172 PolarHBondContact O-N 2.91Å; Q170-W173 PolarHBondContact O-N 2.84Å; Q170-W173 VanDerWaalsContact O-N 3.16Å; Q170-T174 PolarHBondContact O-N 3.16Å; Q170-T174 PolarHBondContact O-OG1 3.48Å
171	E	88.6	Confident	82.5	Confident	91 Å²	91	97.4 Å²	97.4	43%	0.425	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-37.6	175.3	-72.7	174.8	-155.4	0	0	112.6	R167 T174 K175	R167-E171 WeakPolarHBondContact CG-OE1 3.23Å; R167-E171 WeakPolarHBondContact O-CB 2.98Å; R167-E171 WeakPolarHBondContact O-CG 3.41Å; R167-E171 PolarHBondContact O-N 3.16Å; E171-T174 WeakPolarHBondContact CA-OG1 3.48Å; E171-T174 PolarHBondContact O-OG1 3Å; E171-K175 WeakPolarHBondContact O-CB 3.42Å; E171-K175 WeakPolarHBondContact O-CD 3.39Å; E171-K175 WeakPolarHBondContact O-CG 3.44Å; E171-K175 PolarHBondContact O-N 2.92Å
172	N	89.4	Confident	83.3	Confident	110 Å²	110	96.4 Å²	96.4	59%	0.588	49%	0.486	S	S	*	.	H	α-helix	trans	-68.6	-36.6	172.4	-97.6	-3.1	0	0	0	112.1	A168 A169 Q170 K175 A176	A168-N172 WeakPolarHBondContact O-CB 3.35Å; A168-N172 PolarHBondContact O-N 2.79Å; A169-N172 PolarHBondContact O-N 3.02Å; Q170-N172 PolarHBondContact O-N 2.91Å; N172-K175 PolarHBondContact O-N 3.42Å; N172-A176 VanDerWaalsContact O-CB 3.3Å; N172-A176 WeakPolarHBondContact O-CB 3.46Å; N172-A176 PolarHBondContact O-N 3.02Å
173	W	81.8	Confident	84.2	Confident	174 Å²	174	95.5 Å²	95.5	66%	0.659	48%	0.48	S	S	*	.	H	α-helix	trans	-66.5	-43.5	176.3	-174	79.1	0	0	0	111.2	A169 Q170 K175 A176 T177	A169-W173 WeakPolarHBondContact O-CB 3.25Å; A169-W173 PolarHBondContact O-N 3.27Å; Q170-W173 PolarHBondContact O-N 2.84Å; Q170-W173 VanDerWaalsContact O-N 3.16Å; W173-K175 VanDerWaalsContact C-N 3.35Å; W173-K175 PolarHBondContact O-N 3.14Å; W173-A176 PolarHBondContact O-N 3.47Å; W173-T177 HydrophobicContact CD2-CG2 4.27Å; W173-T177 HydrophobicContact CH2-CG2 4.23Å; W173-T177 HydrophobicContact CZ2-CG2 3.94Å; W173-T177 PolarHBondContact O-N 2.9Å; W173-T177 PolarHBondContact O-OG1 2.87Å; W173-T177 VanDerWaalsContact O-OG1 3.14Å
174	T	90.3	Very high	84.8	Confident	67 Å²	67	96.2 Å²	96.2	41%	0.411	48%	0.479	S	S	.	.	H	α-helix	trans	-64.1	-36.6	174.2	52.4	0	0	0	0	112.8	Q170 E171 T177 Q178	Q170-T174 PolarHBondContact O-N 3.16Å; Q170-T174 PolarHBondContact O-OG1 3.48Å; E171-T174 WeakPolarHBondContact CA-OG1 3.48Å; E171-T174 PolarHBondContact O-OG1 3Å; T174-T177 WeakPolarHBondContact CA-OG1 3.45Å; T174-T177 PolarHBondContact O-OG1 2.92Å; T174-Q178 VanDerWaalsContact O-CB 3.3Å; T174-Q178 WeakPolarHBondContact O-CB 3.4Å; T174-Q178 PolarHBondContact O-N 3.33Å
175	K	91.8	Very high	84.9	Confident	106 Å²	106	98.4 Å²	98.4	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-68.1	-38.4	173.6	-72.9	163.6	-171.5	164.7	0	111.9	E171 N172 W173 Q178 M179	E171-K175 WeakPolarHBondContact O-CB 3.42Å; E171-K175 WeakPolarHBondContact O-CD 3.39Å; E171-K175 WeakPolarHBondContact O-CG 3.44Å; E171-K175 PolarHBondContact O-N 2.92Å; N172-K175 PolarHBondContact O-N 3.42Å; W173-K175 VanDerWaalsContact C-N 3.35Å; W173-K175 PolarHBondContact O-N 3.14Å; K175-Q178 PolarHBondContact O-N 3.14Å; K175-M179 WeakPolarHBondContact O-CB 3.41Å; K175-M179 WeakPolarHBondContact O-CG 3.31Å; K175-M179 PolarHBondContact O-N 2.7Å
176	A	85.8	Confident	85.1	Confident	40 Å²	40	98.8 Å²	98.8	33%	0.331	49%	0.489	S	S	.	.	H	α-helix	trans	-68.6	-39	177.2	0	0	0	0	0	112.3	N172 W173 L180	N172-A176 VanDerWaalsContact O-CB 3.3Å; N172-A176 WeakPolarHBondContact O-CB 3.46Å; N172-A176 PolarHBondContact O-N 3.02Å; W173-A176 PolarHBondContact O-N 3.47Å; A176-L180 WeakPolarHBondContact O-CG 3.49Å; A176-L180 PolarHBondContact O-N 3.48Å
177	T	84.5	Confident	84.4	Confident	40 Å²	40	100.1 Å²	100.1	25%	0.245	49%	0.489	C	S	.	.	H	α-helix	trans	-69	-40.9	172.6	51.2	0	0	0	0	111.7	W173 T174 M179 L180 E181	W173-T177 HydrophobicContact CD2-CG2 4.27Å; W173-T177 HydrophobicContact CH2-CG2 4.23Å; W173-T177 HydrophobicContact CZ2-CG2 3.94Å; W173-T177 PolarHBondContact O-N 2.9Å; W173-T177 PolarHBondContact O-OG1 2.87Å; W173-T177 VanDerWaalsContact O-OG1 3.14Å; T174-T177 WeakPolarHBondContact CA-OG1 3.45Å; T174-T177 PolarHBondContact O-OG1 2.92Å; T177-M179 PolarHBondContact O-N 2.95Å; T177-L180 WeakPolarHBondContact O-CB 3.46Å; T177-L180 PolarHBondContact O-N 2.99Å; T177-L180 VanDerWaalsContact O-N 3.14Å; T177-E181 WeakPolarHBondContact O-CG 3.39Å; T177-E181 PolarHBondContact O-N 3.29Å
178	Q	89.9	Confident	83.2	Confident	102 Å²	102	95.8 Å²	95.8	48%	0.477	49%	0.491	S	S	.	.	H	α-helix	trans	-60.2	-44.9	173.7	-178.7	-177.6	-12.1	0	0	111.9	T174 K175 L180 E181 E182	T174-Q178 VanDerWaalsContact O-CB 3.3Å; T174-Q178 WeakPolarHBondContact O-CB 3.4Å; T174-Q178 PolarHBondContact O-N 3.33Å; K175-Q178 PolarHBondContact O-N 3.14Å; Q178-L180 VanDerWaalsContact C-N 3.29Å; Q178-L180 PolarHBondContact O-N 3.45Å; Q178-E181 PolarHBondContact O-N 2.98Å; Q178-E182 WeakPolarHBondContact CG-OE1 3.43Å; Q178-E182 PolarHBondContact NE2-OE1 2.9Å; Q178-E182 WeakPolarHBondContact O-CB 3.5Å; Q178-E182 WeakPolarHBondContact O-CG 3.4Å; Q178-E182 PolarHBondContact O-N 2.91Å
179	M	86.6	Confident	81.8	Confident	108 Å²	108	98.3 Å²	98.3	53%	0.532	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-34.7	174.9	-74.9	-172.2	-55.2	0	0	112.2	K175 T177 E182 I183	K175-M179 WeakPolarHBondContact O-CB 3.41Å; K175-M179 WeakPolarHBondContact O-CG 3.31Å; K175-M179 PolarHBondContact O-N 2.7Å; T177-M179 PolarHBondContact O-N 2.95Å; M179-E182 PolarHBondContact O-N 2.9Å; M179-I183 WeakPolarHBondContact O-CB 3.39Å; M179-I183 WeakPolarHBondContact O-CD1 3.35Å; M179-I183 WeakPolarHBondContact O-CG1 3.31Å; M179-I183 PolarHBondContact O-N 3.38Å
180	L	82.1	Confident	80	Confident	98 Å²	98	100.2 Å²	100.2	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-42.8	173	-77.3	164.5	0	0	0	111.4	A176 T177 Q178 E182 I183 E184	A176-L180 WeakPolarHBondContact O-CG 3.49Å; A176-L180 PolarHBondContact O-N 3.48Å; T177-L180 WeakPolarHBondContact O-CB 3.46Å; T177-L180 PolarHBondContact O-N 2.99Å; T177-L180 VanDerWaalsContact O-N 3.14Å; Q178-L180 VanDerWaalsContact C-N 3.29Å; Q178-L180 PolarHBondContact O-N 3.45Å; L180-E182 VanDerWaalsContact C-N 3.34Å; L180-E182 PolarHBondContact O-N 3.09Å; L180-I183 PolarHBondContact O-N 2.88Å; L180-E184 WeakPolarHBondContact O-CB 3.2Å; L180-E184 VanDerWaalsContact O-CG 3.31Å; L180-E184 WeakPolarHBondContact O-CG 3.44Å; L180-E184 PolarHBondContact O-N 2.94Å
181	E	85.3	Confident	78.2	Confident	111 Å²	111	98.6 Å²	98.6	52%	0.519	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-32.1	174.9	-70.8	171.9	-163.3	0	0	113	T177 Q178 R185	T177-E181 WeakPolarHBondContact O-CG 3.39Å; T177-E181 PolarHBondContact O-N 3.29Å; Q178-E181 PolarHBondContact O-N 2.98Å; E181-R185 VanDerWaalsContact O-CB 3.28Å; E181-R185 WeakPolarHBondContact O-CB 3.36Å; E181-R185 PolarHBondContact O-N 3.08Å; E181-R185 VanDerWaalsContact O-N 3.13Å
182	E	86.5	Confident	75.9	Confident	62 Å²	62	98.5 Å²	98.5	29%	0.29	52%	0.517	S	S	.	.	H	α-helix	trans	-70.3	-45.3	171.9	-78.4	164.4	-171.8	0	0	110.8	Q178 M179 L180 E184 R185 D186	Q178-E182 WeakPolarHBondContact CG-OE1 3.43Å; Q178-E182 PolarHBondContact NE2-OE1 2.9Å; Q178-E182 WeakPolarHBondContact O-CB 3.5Å; Q178-E182 WeakPolarHBondContact O-CG 3.4Å; Q178-E182 PolarHBondContact O-N 2.91Å; M179-E182 PolarHBondContact O-N 2.9Å; L180-E182 VanDerWaalsContact C-N 3.34Å; L180-E182 PolarHBondContact O-N 3.09Å; E182-E184 PolarHBondContact O-N 3.4Å; E182-R185 WeakPolarHBondContact O-CB 3.48Å; E182-R185 PolarHBondContact O-N 2.93Å; E182-R185 VanDerWaalsContact O-N 3.17Å; E182-D186 WeakPolarHBondContact O-CB 3.44Å; E182-D186 PolarHBondContact O-N 3.12Å
183	I	81.4	Confident	73.7	Confident	88 Å²	88	100.1 Å²	100.1	45%	0.451	53%	0.531	S	S	.	.	H	α-helix	trans	-62.1	-42.8	173.3	-71.1	164.3	0	0	0	111.2	M179 L180 R185 D186 F187	M179-I183 WeakPolarHBondContact O-CB 3.39Å; M179-I183 WeakPolarHBondContact O-CD1 3.35Å; M179-I183 WeakPolarHBondContact O-CG1 3.31Å; M179-I183 PolarHBondContact O-N 3.38Å; L180-I183 PolarHBondContact O-N 2.88Å; I183-R185 PolarHBondContact O-N 3.21Å; I183-D186 PolarHBondContact O-N 2.95Å; I183-F187 HydrophobicContact CG2-CD2 3.75Å; I183-F187 HydrophobicContact CG2-CE2 4.03Å; I183-F187 WeakPolarHBondContact O-CB 3.48Å; I183-F187 VanDerWaalsContact O-CD2 3.24Å; I183-F187 WeakPolarHBondContact O-CD2 3.49Å; I183-F187 PolarHBondContact O-N 2.85Å
184	E	82.4	Confident	71.4	Confident	84 Å²	84	94.6 Å²	94.6	39%	0.393	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-33.9	176	-77.1	175.9	-174.5	0	0	112	L180 E182 G188 I189	L180-E184 WeakPolarHBondContact O-CB 3.2Å; L180-E184 VanDerWaalsContact O-CG 3.31Å; L180-E184 WeakPolarHBondContact O-CG 3.44Å; L180-E184 PolarHBondContact O-N 2.94Å; E182-E184 PolarHBondContact O-N 3.4Å; E184-G188 CarbonylContact O-C 3.56Å; E184-G188 PolarHBondContact O-N 2.9Å; E184-I189 PolarHBondContact O-N 3.41Å
185	R	79.6	Confident	68.7	Low	158 Å²	158	98.3 Å²	98.3	60%	0.596	54%	0.543	S	S	*	.	H	α-helix	trans	-73.4	-47	176	-166.2	-173.8	-49.3	131.5	12.9	112.3	E181 E182 I183 G188	E181-R185 VanDerWaalsContact O-CB 3.28Å; E181-R185 WeakPolarHBondContact O-CB 3.36Å; E181-R185 PolarHBondContact O-N 3.08Å; E181-R185 VanDerWaalsContact O-N 3.13Å; E182-R185 WeakPolarHBondContact O-CB 3.48Å; E182-R185 PolarHBondContact O-N 2.93Å; E182-R185 VanDerWaalsContact O-N 3.17Å; I183-R185 PolarHBondContact O-N 3.21Å; R185-G188 PolarHBondContact O-N 3.49Å
186	D	78.4	Confident	66	Low	130 Å²	130	99.1 Å²	99.1	70%	0.695	56%	0.558	S	S	*	*	H	α-helix	trans	-70.2	-34.7	-177.6	-68	-10	0	0	0	112.2	E182 I183 G188	E182-D186 WeakPolarHBondContact O-CB 3.44Å; E182-D186 PolarHBondContact O-N 3.12Å; I183-D186 PolarHBondContact O-N 2.95Å; D186-G188 VanDerWaalsContact C-N 3.32Å
187	F	69.1	Low	64.1	Low	154 Å²	154	106.3 Å²	106.3	68%	0.675	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	1.1	174.7	-73.3	-100.7	0	0	0	113.1	I183 I189	I183-F187 HydrophobicContact CG2-CD2 3.75Å; I183-F187 HydrophobicContact CG2-CE2 4.03Å; I183-F187 WeakPolarHBondContact O-CB 3.48Å; I183-F187 VanDerWaalsContact O-CD2 3.24Å; I183-F187 WeakPolarHBondContact O-CD2 3.49Å; I183-F187 PolarHBondContact O-N 2.85Å; F187-I189 HydrophobicContact CB-CD1 4.03Å; F187-I189 HydrophobicContact CB-CG1 3.92Å; F187-I189 PolarHBondContact O-N 3.23Å; F187-I189 VanDerWaalsContact O-N 3.15Å
188	G	61.1	Low	62.2	Low	56 Å²	56	112.7 Å²	112.7	58%	0.577	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.4	14.7	179.3	0	0	0	0	0	114.8	E184 R185 D186 S190	E184-G188 CarbonylContact O-C 3.56Å; E184-G188 PolarHBondContact O-N 2.9Å; R185-G188 PolarHBondContact O-N 3.49Å; D186-G188 VanDerWaalsContact C-N 3.32Å; G188-S190 PolarHBondContact O-N 3.46Å
189	I	56.9	Low	60.1	Low	99 Å²	99	116 Å²	116	51%	0.508	63%	0.625	S	S	.	*			trans	-83.1	70.4	-179.3	-47.2	178	0	0	0	108.2	E184 F187 C191	E184-I189 PolarHBondContact O-N 3.41Å; F187-I189 HydrophobicContact CB-CD1 4.03Å; F187-I189 HydrophobicContact CB-CG1 3.92Å; F187-I189 PolarHBondContact O-N 3.23Å; F187-I189 VanDerWaalsContact O-N 3.15Å; I189-C191 VanDerWaalsContact C-N 3.34Å; I189-C191 PolarHBondContact O-N 3.43Å
190	S	44.9	Very low	58	Low	97 Å²	97	117.1 Å²	117.1	68%	0.678	63%	0.629	S	S	*	*			trans	-65.9	94.9	169.9	50.2	0	0	0	0	109.8	G188 S192	G188-S190 PolarHBondContact O-N 3.46Å; S190-S192 PolarHBondContact O-N 3.18Å
191	C	46.2	Very low	56.4	Low	95 Å²	95	119.8 Å²	119.8	64%	0.642	64%	0.643	S	S	*	*			trans	-69.2	48.6	163	-77.4	0	0	0	0	111.2	I189 V193	I189-C191 VanDerWaalsContact C-N 3.34Å; I189-C191 PolarHBondContact O-N 3.43Å; C191-V193 PolarHBondContact O-N 2.87Å
192	S	39.8	Very low	54.5	Low	89 Å²	89	121 Å²	121	62%	0.622	65%	0.652	S	S	*	*			trans	-62.1	124.3	159.1	64.2	0	0	0	0	107.2	S190 G194	S190-S192 PolarHBondContact O-N 3.18Å; S192-G194 PolarHBondContact O-N 2.89Å
193	V	42.8	Very low	52.6	Low	144 Å²	144	122.9 Å²	122.9	87%	0.873	67%	0.665	S	S	*	*			trans	-70	74.2	162.7	178.2	0	0	0	0	107.1	C191 M195	C191-V193 PolarHBondContact O-N 2.87Å; V193-M195 PolarHBondContact O-N 3.48Å
194	G	33.7	Very low	50.9	Low	58 Å²	58	125.4 Å²	125.4	60%	0.598	67%	0.673	S	S	*	*			trans	-82.3	86.4	-178.5	0	0	0	0	0	109.7	S192 P196	S192-G194 PolarHBondContact O-N 2.89Å; G194-P196 WeakPolarHBondContact O-CD 3.46Å
195	M	33.9	Very low	49.6	Very low	146 Å²	146	125.9 Å²	125.9	72%	0.719	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-51.3	126	163.9	-74.1	-73.8	-72	0	0	109.6	V193 K197	V193-M195 PolarHBondContact O-N 3.48Å; M195-K197 PolarHBondContact O-N 3.35Å
196	P	35.7	Very low	48.3	Very low	122 Å²	122	123.4 Å²	123.4	79%	0.792	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-59.9	126	167.3	-20.2	32.7	0	0	0	109.2	G194	G194-P196 WeakPolarHBondContact O-CD 3.46Å
197	K	45.6	Very low	47.1	Very low	191 Å²	191	122.8 Å²	122.8	83%	0.83	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-77	157.4	170.5	-75.3	-179.1	174.8	177.4	0	110.1	M195	M195-K197 PolarHBondContact O-N 3.35Å
198	E	43.5	Very low	46.2	Very low	175 Å²	175	121.7 Å²	121.7	82%	0.818	67%	0.669	S	S	*	*	S	Bend	trans	67.8	93.6	175.9	-58.2	171.1	154.7	0	0	111.6
199	Q	46.5	Very low	46	Very low	171 Å²	171	124.8 Å²	124.8	80%	0.799	67%	0.667	S	S	*	*	S	Bend		-157.1	-8.2	83.1	-137.1	72.5	50.4	0	0	116.1
200	H	42.5	Very low	45.7	Very low	132 Å²	132	126.4 Å²	126.4	61%	0.611	67%	0.671	S	S	*	*			trans	-110.2	65.1	-166.6	-73	-89.5	0	0	0	114.3	D203	H200-D203 IonicContact CE1-OD2 3.96Å; H200-D203 PolarHBondContact CE1-OD2 3Å; H200-D203 IonicContact CG-OD2 3.85Å; H200-D203 IonicContact ND1-OD2 2.7Å; H200-D203 PolarHBondContact ND1-OD2 3.13Å
201	L	49.1	Very low	45.9	Very low	154 Å²	154	126.8 Å²	126.8	81%	0.806	66%	0.663	S	S	*	*	S	Bend	trans	-87.2	-24	174.2	-143.8	82.6	0	0	0	113.8
202	D	45.7	Very low	46.3	Very low	136 Å²	136	125 Å²	125	73%	0.727	65%	0.651	S	S	*	*	H	α-helix	trans	-79.6	-44.1	179.1	-90.3	-32.3	0	0	0	112.7	F204 L205	D202-F204 PolarHBondContact O-N 3.02Å; D202-L205 PolarHBondContact O-N 2.93Å; D202-L205 VanDerWaalsContact O-N 3.12Å
203	D	46.4	Very low	46.9	Very low	102 Å²	102	124.7 Å²	124.7	55%	0.545	65%	0.645	S	S	.	*	H	α-helix	trans	-64.6	-27	-174.8	-65.4	-33.9	0	0	0	113.5	H200 L205 L207	H200-D203 IonicContact CE1-OD2 3.96Å; H200-D203 PolarHBondContact CE1-OD2 3Å; H200-D203 IonicContact CG-OD2 3.85Å; H200-D203 IonicContact ND1-OD2 2.7Å; H200-D203 PolarHBondContact ND1-OD2 3.13Å; D203-L205 VanDerWaalsContact C-N 3.35Å; D203-L207 PolarHBondContact O-N 3.16Å; D203-L207 VanDerWaalsContact O-N 3.17Å
204	F	46.3	Very low	47.2	Very low	141 Å²	141	123.2 Å²	123.2	62%	0.618	63%	0.632	S	S	*	*	H	α-helix	trans	-67	-35.4	176.8	-108.8	-88.1	0	0	0	112.4	D202 D206 L207 E208	D202-F204 PolarHBondContact O-N 3.02Å; F204-D206 VanDerWaalsContact C-N 3.34Å; F204-D206 PolarHBondContact O-N 2.94Å; F204-L207 PolarHBondContact O-N 3.29Å; F204-E208 WeakPolarHBondContact O-CB 3.25Å; F204-E208 PolarHBondContact O-N 3.27Å
205	L	54.9	Low	47.9	Very low	93 Å²	93	129 Å²	129	49%	0.487	64%	0.636	S	S	.	*	H	α-helix	trans	-74	-23.8	-177.9	-69.1	171.7	0	0	0	112.8	D202 D203 K209	D202-L205 PolarHBondContact O-N 2.93Å; D202-L205 VanDerWaalsContact O-N 3.12Å; D203-L205 VanDerWaalsContact C-N 3.35Å; L205-K209 WeakPolarHBondContact O-CD 3.3Å; L205-K209 WeakPolarHBondContact O-CE 3.37Å; L205-K209 VanDerWaalsContact O-CG 3.29Å; L205-K209 WeakPolarHBondContact O-CG 3.39Å
206	D	51.2	Low	48.8	Very low	106 Å²	106	128.3 Å²	128.3	57%	0.567	64%	0.635	S	S	*	*	H	α-helix	trans	-86.5	-31.6	172.2	-90.6	4	0	0	0	112.7	F204 K209 H210	F204-D206 VanDerWaalsContact C-N 3.34Å; F204-D206 PolarHBondContact O-N 2.94Å; D206-K209 IonicContact OD1-NZ 2.62Å; D206-K209 PolarHBondContact OD1-NZ 3.37Å; D206-H210 PolarHBondContact O-N 2.95Å; D206-H210 VanDerWaalsContact O-N 3.17Å
207	L	53.6	Low	49.4	Very low	118 Å²	118	128 Å²	128	62%	0.618	63%	0.627	S	S	*	*	H	α-helix	trans	-67.2	-40.3	173.6	-164.9	64.7	0	0	0	111.9	D203 F204 K209 H210 E211	D203-L207 PolarHBondContact O-N 3.16Å; D203-L207 VanDerWaalsContact O-N 3.17Å; F204-L207 PolarHBondContact O-N 3.29Å; L207-K209 PolarHBondContact O-N 3.14Å; L207-H210 PolarHBondContact O-N 3.37Å; L207-H210 VanDerWaalsContact O-N 3.15Å; L207-E211 PolarHBondContact O-N 3.16Å
208	E	50.9	Low	49.6	Very low	131 Å²	131	124.7 Å²	124.7	61%	0.612	62%	0.616	S	S	*	*	H	α-helix	trans	-65.1	-37	177.8	-170.5	171.4	-155.9	0	0	112.5	F204 E211 S212	F204-E208 WeakPolarHBondContact O-CB 3.25Å; F204-E208 PolarHBondContact O-N 3.27Å; E208-E211 PolarHBondContact O-N 2.83Å; E208-S212 PolarHBondContact O-N 3.44Å
209	K	56.8	Low	50	Low	121 Å²	121	121 Å²	121	53%	0.526	61%	0.607	S	S	.	*	H	α-helix	trans	-60.5	-46.1	170.3	-69	166	-157.9	155	0	110.8	L205 D206 L207 E211 S212 V213	L205-K209 WeakPolarHBondContact O-CD 3.3Å; L205-K209 WeakPolarHBondContact O-CE 3.37Å; L205-K209 VanDerWaalsContact O-CG 3.29Å; L205-K209 WeakPolarHBondContact O-CG 3.39Å; D206-K209 IonicContact OD1-NZ 2.62Å; D206-K209 PolarHBondContact OD1-NZ 3.37Å; L207-K209 PolarHBondContact O-N 3.14Å; K209-E211 VanDerWaalsContact C-N 3.33Å; K209-E211 PolarHBondContact O-N 3.48Å; K209-S212 PolarHBondContact O-N 3.03Å; K209-S212 PolarHBondContact O-OG 2.87Å; K209-V213 PolarHBondContact O-N 3.22Å
210	H	49.3	Very low	50.1	Low	132 Å²	132	117.2 Å²	117.2	61%	0.611	60%	0.6	S	S	*	*	H	α-helix	trans	-66.2	-35.9	-179.6	-146.2	-82.6	0	0	0	112.1	D206 L207 V213 L214	D206-H210 PolarHBondContact O-N 2.95Å; D206-H210 VanDerWaalsContact O-N 3.17Å; L207-H210 PolarHBondContact O-N 3.37Å; L207-H210 VanDerWaalsContact O-N 3.15Å; H210-V213 PolarHBondContact O-N 3.42Å; H210-L214 PolarHBondContact O-N 3.33Å
211	E	49.5	Very low	50.3	Low	106 Å²	106	116 Å²	116	50%	0.495	59%	0.594	S	S	.	*	H	α-helix	trans	-67.7	-38.4	174.5	-131.6	-159.4	-142.8	0	0	112.5	L207 E208 K209 V213 L214 R215	L207-E211 PolarHBondContact O-N 3.16Å; E208-E211 PolarHBondContact O-N 2.83Å; K209-E211 VanDerWaalsContact C-N 3.33Å; K209-E211 PolarHBondContact O-N 3.48Å; E211-V213 VanDerWaalsContact C-N 3.32Å; E211-V213 PolarHBondContact O-N 3.45Å; E211-L214 PolarHBondContact O-N 2.91Å; E211-R215 VanDerWaalsContact O-CB 3.28Å; E211-R215 WeakPolarHBondContact O-CB 3.37Å; E211-R215 PolarHBondContact O-N 2.88Å; E211-R215 IonicContact OE2-CZ 3.45Å; E211-R215 IonicContact OE2-NH2 3.9Å; E211-R215 PolarHBondContact OE2-NH2 3.1Å
212	S	54.9	Low	50.3	Low	56 Å²	56	113.6 Å²	113.6	39%	0.392	58%	0.582	S	S	.	*	H	α-helix	trans	-63.2	-37.7	175.9	78.9	0	0	0	0	112.4	E208 K209 R215 N216	E208-S212 PolarHBondContact O-N 3.44Å; K209-S212 PolarHBondContact O-N 3.03Å; K209-S212 PolarHBondContact O-OG 2.87Å; S212-R215 PolarHBondContact O-N 3.16Å; S212-N216 VanDerWaalsContact O-CG 3.28Å; S212-N216 PolarHBondContact O-N 2.9Å; S212-N216 VanDerWaalsContact O-N 3.11Å; S212-N216 PolarHBondContact O-ND2 2.85Å
213	V	52.2	Low	50.6	Low	84 Å²	84	111.5 Å²	111.5	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-70	-39	174.9	174.6	0	0	0	0	111	K209 H210 E211 N217	K209-V213 PolarHBondContact O-N 3.22Å; H210-V213 PolarHBondContact O-N 3.42Å; E211-V213 VanDerWaalsContact C-N 3.32Å; E211-V213 PolarHBondContact O-N 3.45Å; V213-N217 PolarHBondContact O-N 2.89Å; V213-N217 PolarHBondContact O-ND2 3.3Å
214	L	49.4	Very low	50.8	Low	113 Å²	113	112.4 Å²	112.4	59%	0.592	57%	0.571	S	S	*	*	H	α-helix	trans	-65.6	-40.5	175.6	-138.8	76.2	0	0	0	111.8	H210 E211 N217	H210-L214 PolarHBondContact O-N 3.33Å; E211-L214 PolarHBondContact O-N 2.91Å; L214-N217 PolarHBondContact O-N 3.29Å
215	R	48.1	Very low	50.9	Low	178 Å²	178	111 Å²	111	67%	0.672	57%	0.57	S	S	*	*	H	α-helix	trans	-65.5	-38	179.7	-163.2	178.5	-60.5	-144.1	4.1	112.6	E211 S212 N217	E211-R215 VanDerWaalsContact O-CB 3.28Å; E211-R215 WeakPolarHBondContact O-CB 3.37Å; E211-R215 PolarHBondContact O-N 2.88Å; E211-R215 IonicContact OE2-CZ 3.45Å; E211-R215 IonicContact OE2-NH2 3.9Å; E211-R215 PolarHBondContact OE2-NH2 3.1Å; S212-R215 PolarHBondContact O-N 3.16Å; R215-N217 VanDerWaalsContact C-N 3.3Å; R215-N217 PolarHBondContact O-N 3.05Å
216	N	52.1	Low	50.9	Low	133 Å²	133	113.1 Å²	113.1	71%	0.711	58%	0.578	S	S	*	*	H	α-helix	trans	-72.9	-19.1	176.8	-71.6	-20.1	0	0	0	113.8	S212	S212-N216 VanDerWaalsContact O-CG 3.28Å; S212-N216 PolarHBondContact O-N 2.9Å; S212-N216 VanDerWaalsContact O-N 3.11Å; S212-N216 PolarHBondContact O-ND2 2.85Å
217	N	49.4	Very low	51	Low	116 Å²	116	114.6 Å²	114.6	62%	0.62	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	4.7	-179.2	-77.2	-54.4	0	0	0	114.3	V213 L214 R215 P219	V213-N217 PolarHBondContact O-N 2.89Å; V213-N217 PolarHBondContact O-ND2 3.3Å; L214-N217 PolarHBondContact O-N 3.29Å; R215-N217 VanDerWaalsContact C-N 3.3Å; R215-N217 PolarHBondContact O-N 3.05Å; N217-P219 VanDerWaalsContact O-CD 3.27Å; N217-P219 WeakPolarHBondContact O-CD 3.35Å
218	M	48.8	Very low	50.8	Low	120 Å²	120	111.1 Å²	111.1	59%	0.591	56%	0.563	S	S	*	*			trans	-116.5	56.3	-177.7	-75.1	-63.8	-70.3	0	0	114.9	S220 H221	M218-S220 VanDerWaalsContact C-N 3.28Å; M218-S220 PolarHBondContact O-N 2.87Å; M218-H221 HydrophobicContact CE-CB 4.3Å
219	P	52.2	Low	51	Low	97 Å²	97	108.4 Å²	108.4	63%	0.63	56%	0.557	S	S	*	*	H	α-helix	trans	-68.9	-24.6	174.5	29.7	-34.4	0	0	0	113	N217 H221	N217-P219 VanDerWaalsContact O-CD 3.27Å; N217-P219 WeakPolarHBondContact O-CD 3.35Å; P219-H221 PolarHBondContact O-N 3.33Å
220	S	48.8	Very low	51	Low	93 Å²	93	105.7 Å²	105.7	65%	0.65	55%	0.553	S	S	*	*	H	α-helix	trans	-69.3	-24.3	-168.8	-170.7	0	0	0	0	115.7	M218	M218-S220 VanDerWaalsContact C-N 3.28Å; M218-S220 PolarHBondContact O-N 2.87Å
221	H	46.3	Very low	51.3	Low	106 Å²	106	104 Å²	104	49%	0.491	55%	0.549	S	S	.	.	H	α-helix	trans	-96.8	-24.2	-170.2	-161.5	44.4	0	0	0	113.4	M218 P219 E224 L225	M218-H221 HydrophobicContact CE-CB 4.3Å; P219-H221 PolarHBondContact O-N 3.33Å; H221-E224 IonicContact CE1-OE2 2.69Å; H221-E224 IonicContact ND1-OE2 2.74Å; H221-E224 PolarHBondContact ND1-OE2 2.85Å; H221-E224 WeakPolarHBondContact O-CB 3.2Å; H221-E224 PolarHBondContact O-N 3.45Å; H221-L225 PolarHBondContact O-N 3.43Å
222	N	49.4	Very low	51.9	Low	104 Å²	104	104.5 Å²	104.5	56%	0.556	55%	0.554	S	S	*	*	H	α-helix	trans	-75.1	-35.5	178.5	-156.7	22.6	0	0	0	111.9	E224 L225 Q226	N222-E224 PolarHBondContact O-N 2.85Å; N222-L225 PolarHBondContact O-N 3.4Å; N222-Q226 PolarHBondContact O-N 2.88Å; N222-Q226 VanDerWaalsContact O-N 3.13Å
223	D	53	Low	52	Low	92 Å²	92	109.8 Å²	109.8	49%	0.492	57%	0.57	S	S	.	*	H	α-helix	trans	-59.6	-27.6	170.7	-86.2	3.2	0	0	0	112.8	R227	D223-R227 VanDerWaalsContact O-CB 3.28Å; D223-R227 WeakPolarHBondContact O-CB 3.28Å; D223-R227 PolarHBondContact O-N 2.68Å
224	E	49.8	Very low	52.1	Low	120 Å²	120	108.9 Å²	108.9	56%	0.561	57%	0.567	S	S	*	*	H	α-helix	trans	-78.8	-40	-178.4	-157	165.8	-144.6	0	0	111.4	H221 N222 R227 A228	H221-E224 IonicContact CE1-OE2 2.69Å; H221-E224 IonicContact ND1-OE2 2.74Å; H221-E224 PolarHBondContact ND1-OE2 2.85Å; H221-E224 WeakPolarHBondContact O-CB 3.2Å; H221-E224 PolarHBondContact O-N 3.45Å; N222-E224 PolarHBondContact O-N 2.85Å; E224-R227 PolarHBondContact O-N 2.76Å; E224-A228 PolarHBondContact O-N 2.81Å
225	L	49.4	Very low	52.6	Low	113 Å²	113	109.5 Å²	109.5	59%	0.592	57%	0.571	S	S	*	*	H	α-helix	trans	-66.1	-36.3	171.3	-93.7	82.8	0	0	0	112.7	H221 N222 R227 P229	H221-L225 PolarHBondContact O-N 3.43Å; N222-L225 PolarHBondContact O-N 3.4Å; L225-R227 VanDerWaalsContact C-N 3.33Å; L225-P229 WeakPolarHBondContact O-CD 3.32Å
226	Q	53.5	Low	53.5	Low	137 Å²	137	105.1 Å²	105.1	64%	0.64	56%	0.558	S	S	*	*	H	α-helix	trans	-74.2	-21.8	176.3	-67.6	-166.5	14.9	0	0	113.5	N222 P229	N222-Q226 PolarHBondContact O-N 2.88Å; N222-Q226 VanDerWaalsContact O-N 3.13Å; Q226-P229 WeakPolarHBondContact O-CD 3.3Å; Q226-P229 WeakPolarHBondContact O-CG 3.43Å
227	R	52.7	Low	54.1	Low	137 Å²	137	102.7 Å²	102.7	52%	0.517	55%	0.545	S	S	.	.	H	α-helix	trans	-84.9	-19.4	176.9	-162	172.9	-62.1	144.7	6.8	113.5	D223 E224 L225 S230 N231	D223-R227 VanDerWaalsContact O-CB 3.28Å; D223-R227 WeakPolarHBondContact O-CB 3.28Å; D223-R227 PolarHBondContact O-N 2.68Å; E224-R227 PolarHBondContact O-N 2.76Å; L225-R227 VanDerWaalsContact C-N 3.33Å; R227-S230 PolarHBondContact O-OG 2.87Å; R227-N231 VanDerWaalsContact O-CG 3.27Å; R227-N231 PolarHBondContact O-N 3.46Å; R227-N231 VanDerWaalsContact O-N 3.12Å
228	A	51	Low	54.7	Low	45 Å²	45	101.8 Å²	101.8	37%	0.372	54%	0.537	S	S	.	.	H	α-helix	trans	-57.7	-50.2	174.1	0	0	0	0	0	114.4	E224 S230 N231 I232	E224-A228 PolarHBondContact O-N 2.81Å; A228-S230 PolarHBondContact O-N 3.3Å; A228-N231 PolarHBondContact O-N 3.23Å; A228-I232 WeakPolarHBondContact O-CG1 3.44Å; A228-I232 PolarHBondContact O-N 3.39Å
229	P	55.2	Low	55.7	Low	73 Å²	73	101.4 Å²	101.4	47%	0.474	53%	0.532	S	S	.	.	H	α-helix	trans	-64.6	-36.1	179.9	24	-34.6	0	0	0	113.6	L225 Q226 I232 F233	L225-P229 WeakPolarHBondContact O-CD 3.32Å; Q226-P229 WeakPolarHBondContact O-CD 3.3Å; Q226-P229 WeakPolarHBondContact O-CG 3.43Å; P229-I232 PolarHBondContact O-N 2.84Å; P229-F233 PolarHBondContact O-N 2.91Å
230	S	55.5	Low	56.1	Low	64 Å²	64	100.4 Å²	100.4	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-37.1	174.4	47.4	0	0	0	0	112.4	R227 A228 S234	R227-S230 PolarHBondContact O-OG 2.87Å; A228-S230 PolarHBondContact O-N 3.3Å; S230-S234 WeakPolarHBondContact O-CB 3.43Å; S230-S234 PolarHBondContact O-N 2.98Å
231	N	56	Low	57.2	Low	97 Å²	97	100.6 Å²	100.6	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-68.7	-37.8	175.8	-72.3	-8.4	0	0	0	111.7	R227 A228 S234 L235	R227-N231 VanDerWaalsContact O-CG 3.27Å; R227-N231 PolarHBondContact O-N 3.46Å; R227-N231 VanDerWaalsContact O-N 3.12Å; A228-N231 PolarHBondContact O-N 3.23Å; N231-S234 PolarHBondContact O-N 2.91Å; N231-L235 WeakPolarHBondContact O-CB 3.36Å; N231-L235 PolarHBondContact O-N 2.98Å
232	I	61.8	Low	57.9	Low	117 Å²	117	100 Å²	100	60%	0.6	51%	0.514	S	S	*	.	H	α-helix	trans	-64.3	-45	175.6	-68.1	163.7	0	0	0	110.9	A228 P229 S234 L235 E236	A228-I232 WeakPolarHBondContact O-CG1 3.44Å; A228-I232 PolarHBondContact O-N 3.39Å; P229-I232 PolarHBondContact O-N 2.84Å; I232-S234 PolarHBondContact O-N 3.23Å; I232-L235 PolarHBondContact O-N 2.87Å; I232-E236 PolarHBondContact O-N 3.47Å
233	F	57.2	Low	58.6	Low	166 Å²	166	101 Å²	101	73%	0.728	52%	0.518	S	S	*	.	H	α-helix	trans	-61.6	-42.3	173.9	-103.2	-87.6	0	0	0	112.4	P229 L235 E236 D237	P229-F233 PolarHBondContact O-N 2.91Å; F233-L235 VanDerWaalsContact C-N 3.33Å; F233-L235 PolarHBondContact O-N 3.41Å; F233-E236 PolarHBondContact O-N 2.68Å; F233-D237 VanDerWaalsContact O-CB 3.32Å; F233-D237 WeakPolarHBondContact O-CB 3.37Å; F233-D237 PolarHBondContact O-N 2.97Å
234	S	55.5	Low	58.4	Low	65 Å²	65	103.3 Å²	103.3	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-36.1	176.6	-170.6	0	0	0	0	112.7	S230 N231 I232 E238	S230-S234 WeakPolarHBondContact O-CB 3.43Å; S230-S234 PolarHBondContact O-N 2.98Å; N231-S234 PolarHBondContact O-N 2.91Å; I232-S234 PolarHBondContact O-N 3.23Å; S234-E238 WeakPolarHBondContact O-CB 3.42Å; S234-E238 WeakPolarHBondContact O-CG 3.33Å; S234-E238 PolarHBondContact O-N 2.94Å
235	L	60.2	Low	58.7	Low	127 Å²	127	103.1 Å²	103.1	67%	0.665	53%	0.528	S	S	*	.	H	α-helix	trans	-77.1	-34.1	-178.4	-143.9	159.3	0	0	0	111.4	N231 I232 F233 K239	N231-L235 WeakPolarHBondContact O-CB 3.36Å; N231-L235 PolarHBondContact O-N 2.98Å; I232-L235 PolarHBondContact O-N 2.87Å; F233-L235 VanDerWaalsContact C-N 3.33Å; F233-L235 PolarHBondContact O-N 3.41Å; L235-K239 WeakPolarHBondContact O-CB 3.49Å; L235-K239 PolarHBondContact O-N 3.2Å
236	E	65.4	Low	59	Low	85 Å²	85	100.2 Å²	100.2	40%	0.397	52%	0.52	S	S	.	.	H	α-helix	trans	-69.6	-36.9	171.4	-163.4	63.7	-152.9	0	0	111.4	I232 F233 K239 N240	I232-E236 PolarHBondContact O-N 3.47Å; F233-E236 PolarHBondContact O-N 2.68Å; E236-K239 PolarHBondContact O-N 3.03Å; E236-K239 WeakPolarHBondContact OE1-CE 3.34Å; E236-K239 IonicContact OE1-NZ 2.7Å; E236-K239 PolarHBondContact OE1-NZ 3.06Å; E236-K239 IonicContact OE2-NZ 2.85Å; E236-K239 PolarHBondContact OE2-NZ 3.01Å; E236-N240 WeakPolarHBondContact O-CB 3.43Å; E236-N240 PolarHBondContact O-N 3.36Å; E236-N240 PolarHBondContact O-ND2 3.34Å
237	D	64.8	Low	58.9	Low	83 Å²	83	95.8 Å²	95.8	44%	0.444	51%	0.511	S	S	.	.	H	α-helix	trans	-70.1	-39.3	174.7	-166.5	50.8	0	0	0	112.4	F233 N240 K241	F233-D237 VanDerWaalsContact O-CB 3.32Å; F233-D237 WeakPolarHBondContact O-CB 3.37Å; F233-D237 PolarHBondContact O-N 2.97Å; D237-N240 PolarHBondContact O-N 3.31Å; D237-K241 VanDerWaalsContact O-CG 3.28Å; D237-K241 WeakPolarHBondContact O-CG 3.48Å; D237-K241 PolarHBondContact O-N 2.98Å; D237-K241 WeakPolarHBondContact OD2-CE 3.41Å; D237-K241 IonicContact OD2-NZ 3.59Å; D237-K241 PolarHBondContact OD2-NZ 3.36Å
238	E	62.8	Low	58.8	Low	96 Å²	96	93.1 Å²	93.1	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-42.6	168.9	-76.9	-59.2	113	0	0	112.2	S234 N240 K241 V242	S234-E238 WeakPolarHBondContact O-CB 3.42Å; S234-E238 WeakPolarHBondContact O-CG 3.33Å; S234-E238 PolarHBondContact O-N 2.94Å; E238-N240 VanDerWaalsContact C-N 3.32Å; E238-N240 PolarHBondContact O-N 2.84Å; E238-K241 PolarHBondContact O-N 3.47Å; E238-K241 WeakPolarHBondContact OE1-CD 3.42Å; E238-K241 IonicContact OE1-NZ 3.87Å; E238-K241 PolarHBondContact OE1-NZ 2.96Å; E238-V242 WeakPolarHBondContact O-CB 3.49Å; E238-V242 VanDerWaalsContact O-CG2 3.3Å; E238-V242 WeakPolarHBondContact O-CG2 3.31Å; E238-V242 PolarHBondContact O-N 3.37Å
239	K	68.4	Low	58.5	Low	113 Å²	113	96.9 Å²	96.9	49%	0.491	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-39.8	173.9	171.1	-176.1	158.5	-152.8	0	111.7	L235 E236 V242 L243	L235-K239 WeakPolarHBondContact O-CB 3.49Å; L235-K239 PolarHBondContact O-N 3.2Å; E236-K239 PolarHBondContact O-N 3.03Å; E236-K239 WeakPolarHBondContact OE1-CE 3.34Å; E236-K239 IonicContact OE1-NZ 2.7Å; E236-K239 PolarHBondContact OE1-NZ 3.06Å; E236-K239 IonicContact OE2-NZ 2.85Å; E236-K239 PolarHBondContact OE2-NZ 3.01Å; K239-V242 PolarHBondContact O-N 3.2Å; K239-L243 WeakPolarHBondContact O-CB 3.5Å; K239-L243 PolarHBondContact O-N 2.9Å
240	N	61.9	Low	58.1	Low	76 Å²	76	101.7 Å²	101.7	41%	0.406	53%	0.53	S	S	.	.	H	α-helix	trans	-69	-40.1	175.5	-72.9	-33.3	0	0	0	111.9	E236 D237 E238 L243 H244	E236-N240 WeakPolarHBondContact O-CB 3.43Å; E236-N240 PolarHBondContact O-N 3.36Å; E236-N240 PolarHBondContact O-ND2 3.34Å; D237-N240 PolarHBondContact O-N 3.31Å; E238-N240 VanDerWaalsContact C-N 3.32Å; E238-N240 PolarHBondContact O-N 2.84Å; N240-L243 PolarHBondContact O-N 3.37Å; N240-H244 WeakPolarHBondContact O-CB 3.27Å; N240-H244 PolarHBondContact O-N 3.46Å
241	K	71	Confident	57.3	Low	97 Å²	97	102 Å²	102	42%	0.422	54%	0.537	S	S	.	.	H	α-helix	trans	-61	-45.4	170.5	-71.4	163.9	-162.2	154.6	0	111.5	D237 E238 L243 H244 L245	D237-K241 VanDerWaalsContact O-CG 3.28Å; D237-K241 WeakPolarHBondContact O-CG 3.48Å; D237-K241 PolarHBondContact O-N 2.98Å; D237-K241 WeakPolarHBondContact OD2-CE 3.41Å; D237-K241 IonicContact OD2-NZ 3.59Å; D237-K241 PolarHBondContact OD2-NZ 3.36Å; E238-K241 PolarHBondContact O-N 3.47Å; E238-K241 WeakPolarHBondContact OE1-CD 3.42Å; E238-K241 IonicContact OE1-NZ 3.87Å; E238-K241 PolarHBondContact OE1-NZ 2.96Å; K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 2.88Å; K241-H244 CarbonylContact O-C 3.6Å; K241-H244 PolarHBondContact O-N 3.15Å; K241-L245 WeakPolarHBondContact O-CB 3.36Å; K241-L245 PolarHBondContact O-N 2.87Å
242	V	61.6	Low	56.4	Low	93 Å²	93	107.6 Å²	107.6	56%	0.564	55%	0.551	S	S	*	*	H	α-helix	trans	-63.4	-37.7	175.9	169	0	0	0	0	111.5	E238 K239 L245 A246	E238-V242 WeakPolarHBondContact O-CB 3.49Å; E238-V242 VanDerWaalsContact O-CG2 3.3Å; E238-V242 WeakPolarHBondContact O-CG2 3.31Å; E238-V242 PolarHBondContact O-N 3.37Å; K239-V242 PolarHBondContact O-N 3.2Å; V242-L245 PolarHBondContact O-N 3.23Å; V242-A246 WeakPolarHBondContact O-CB 3.44Å; V242-A246 PolarHBondContact O-N 2.91Å
243	L	63.2	Low	55.3	Low	124 Å²	124	111.5 Å²	111.5	65%	0.649	56%	0.558	S	S	*	*	H	α-helix	trans	-65.6	-41.3	174.1	-160.4	77.6	0	0	0	111.5	K239 N240 K241 A246 G247	K239-L243 WeakPolarHBondContact O-CB 3.5Å; K239-L243 PolarHBondContact O-N 2.9Å; N240-L243 PolarHBondContact O-N 3.37Å; K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 2.88Å; L243-A246 PolarHBondContact O-N 2.97Å; L243-G247 PolarHBondContact O-N 3.36Å
244	H	48.6	Very low	54.5	Low	141 Å²	141	108.5 Å²	108.5	65%	0.653	56%	0.558	S	S	*	*	H	α-helix	trans	-69.1	-38.8	176.7	-150.5	-76.4	0	0	0	111.8	N240 K241 G247 L248	N240-H244 WeakPolarHBondContact O-CB 3.27Å; N240-H244 PolarHBondContact O-N 3.46Å; K241-H244 CarbonylContact O-C 3.6Å; K241-H244 PolarHBondContact O-N 3.15Å; H244-G247 PolarHBondContact O-N 2.96Å; H244-L248 WeakPolarHBondContact O-CG 3.27Å; H244-L248 PolarHBondContact O-N 2.71Å
245	L	56.4	Low	53.3	Low	117 Å²	117	112.1 Å²	112.1	61%	0.613	57%	0.572	S	S	*	*	H	α-helix	trans	-68.6	-39.6	175	-138.5	72.9	0	0	0	111.1	K241 V242 G247 L248 H249	K241-L245 WeakPolarHBondContact O-CB 3.36Å; K241-L245 PolarHBondContact O-N 2.87Å; V242-L245 PolarHBondContact O-N 3.23Å; L245-G247 VanDerWaalsContact C-N 3.35Å; L245-L248 PolarHBondContact O-N 2.91Å; L245-H249 WeakPolarHBondContact O-CB 3.42Å; L245-H249 PolarHBondContact O-N 3.3Å
246	A	56.7	Low	51.9	Low	51 Å²	51	115 Å²	115	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-68.4	-32.1	173.3	0	0	0	0	0	112.6	V242 L243 H249 K250	V242-A246 WeakPolarHBondContact O-CB 3.44Å; V242-A246 PolarHBondContact O-N 2.91Å; L243-A246 PolarHBondContact O-N 2.97Å; A246-H249 PolarHBondContact O-N 2.9Å; A246-K250 PolarHBondContact O-N 2.83Å
247	G	51.9	Low	50.2	Low	44 Å²	44	119.5 Å²	119.5	45%	0.454	59%	0.592	S	S	.	*	H	α-helix	trans	-62.8	-49.2	168.6	0	0	0	0	0	111.9	L243 H244 L245 H249 K250 A251	L243-G247 PolarHBondContact O-N 3.36Å; H244-G247 PolarHBondContact O-N 2.96Å; L245-G247 VanDerWaalsContact C-N 3.35Å; G247-H249 VanDerWaalsContact C-N 3.31Å; G247-H249 PolarHBondContact O-N 3.49Å; G247-K250 PolarHBondContact O-N 3.44Å; G247-A251 PolarHBondContact O-N 3.43Å
248	L	49.7	Very low	48.8	Very low	81 Å²	81	121 Å²	121	42%	0.424	61%	0.609	S	S	.	*	H	α-helix	trans	-60.2	-39.5	172.8	-75.6	160.3	0	0	0	111.9	H244 L245 K250 A251 W252	H244-L248 WeakPolarHBondContact O-CG 3.27Å; H244-L248 PolarHBondContact O-N 2.71Å; L245-L248 PolarHBondContact O-N 2.91Å; L248-K250 PolarHBondContact O-N 2.75Å; L248-A251 WeakPolarHBondContact O-CB 3.46Å; L248-A251 PolarHBondContact O-N 2.84Å; L248-W252 PolarHBondContact O-N 3.24Å; L248-W252 VanDerWaalsContact O-N 3.14Å
249	H	45.3	Very low	47.4	Very low	125 Å²	125	122.2 Å²	122.2	58%	0.579	63%	0.625	S	S	*	*	H	α-helix	trans	-66.8	-18.3	179.2	-138.3	-76.2	0	0	0	113.9	L245 A246 G247 R253	L245-H249 WeakPolarHBondContact O-CB 3.42Å; L245-H249 PolarHBondContact O-N 3.3Å; A246-H249 PolarHBondContact O-N 2.9Å; G247-H249 VanDerWaalsContact C-N 3.31Å; G247-H249 PolarHBondContact O-N 3.49Å; H249-R253 WeakPolarHBondContact O-CG 3.41Å
250	K	45.6	Very low	45.7	Very low	174 Å²	174	121.7 Å²	121.7	76%	0.757	64%	0.636	S	S	*	*	H	α-helix	trans	-82.7	-32.4	168.8	-73.3	-177.6	178.3	-179.5	0	112.7	A246 G247 L248	A246-K250 PolarHBondContact O-N 2.83Å; G247-K250 PolarHBondContact O-N 3.44Å; L248-K250 PolarHBondContact O-N 2.75Å
251	A	39.5	Very low	44.1	Very low	71 Å²	71	129.1 Å²	129.1	59%	0.587	66%	0.66	S	S	*	*	H	α-helix	trans	-70.9	-31.9	176.8	0	0	0	0	0	113	G247 L248 R253	G247-A251 PolarHBondContact O-N 3.43Å; L248-A251 WeakPolarHBondContact O-CB 3.46Å; L248-A251 PolarHBondContact O-N 2.84Å; A251-R253 VanDerWaalsContact C-N 3.33Å; A251-R253 PolarHBondContact O-N 3.34Å
252	W	36.3	Very low	42	Very low	214 Å²	214	134.9 Å²	134.9	81%	0.811	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	6.9	-178.5	-77.6	72.8	0	0	0	115.1	L248	L248-W252 PolarHBondContact O-N 3.24Å; L248-W252 VanDerWaalsContact O-N 3.14Å
253	R	38.8	Very low	41.4	Very low	199 Å²	199	135.6 Å²	135.6	75%	0.751	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	28.7	179.4	-73.1	-76.6	-97.9	-115.4	-5.3	113.1	H249 A251	H249-R253 WeakPolarHBondContact O-CG 3.41Å; A251-R253 VanDerWaalsContact C-N 3.33Å; A251-R253 PolarHBondContact O-N 3.34Å
254	S	40.7	Very low	40.5	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	69%	0.694	S	S	*	*	S	Bend	trans	-129.9	36.9	175.4	-60	0	0	0	0	113.6
255	D	30.2	Very low	39.7	Very low	140 Å²	140	135 Å²	135	75%	0.749	71%	0.705	S	S	*	*	S	Bend	trans	-155.5	127.9	142.1	-131.9	-5.2	0	0	0	115.9
256	R	31.2	Very low	38.5	Very low	189 Å²	189	133 Å²	133	71%	0.713	71%	0.712	S	S	*	*			trans	59.2	148.9	154.7	-51.4	-131.6	-82.1	-141.7	-4.3	124.6
257	F	29.7	Very low	37.3	Very low	178 Å²	178	135.1 Å²	135.1	78%	0.781	73%	0.73	S	S	*	*			trans	85.2	110.3	159.1	-55.9	-64.6	0	0	0	120
258	S	35.5	Very low	36.3	Very low	115 Å²	115	141.1 Å²	141.1	80%	0.804	75%	0.751	S	S	*	*			trans	-60.6	160.2	158.5	-44.9	0	0	0	0	111.7
259	P	33.7	Very low	35.5	Very low	121 Å²	121	142.2 Å²	142.2	79%	0.786	77%	0.765	S	S	*	*				-137	152.2	111.1	35.2	-24.5	0	0	0	115.1
260	S	32.5	Very low	35.7	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	77%	0.772	S	S	*	*			trans	-68.9	139.1	170.8	145.5	0	0	0	0	111.9
261	Y	27.4	Very low	34.9	Very low	231 Å²	231	139.2 Å²	139.2	91%	0.906	77%	0.768	S	S	*	*			trans	-147.3	128	142.9	-96.4	-76.7	0	0	0	112.9
262	R	27.7	Very low	34.5	Very low	218 Å²	218	145.9 Å²	145.9	82%	0.823	78%	0.778	S	S	*	*			trans	-103.8	-176.1	155.6	-146.2	-166.8	-166.5	179.9	6.3	105.3
263	P	49.6	Very low	34.7	Very low	109 Å²	109	140.9 Å²	140.9	71%	0.708	77%	0.773	S	S	*	*			cis	-113.2	-151.7	-26.5	6.1	22.7	0	0	0	109.1
264	P	43.4	Very low	35.3	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	77%	0.771	S	S	*	*			cis	-133.2	168.7	5.6	39.3	-19.4	0	0	0	118.9
265	S	33	Very low	35.4	Very low	126 Å²	126	137.4 Å²	137.4	88%	0.881	77%	0.774	S	S	*	*			trans	-82.5	161.5	173	-37.9	0	0	0	0	112.7
266	G	30.6	Very low	35.3	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	77%	0.773	S	S	*	*			trans	155.6	129.4	148.7	0	0	0	0	0	116.8
267	A	30.6	Very low	35.1	Very low	97 Å²	97	137.5 Å²	137.5	80%	0.802	78%	0.781	S	S	*	*			trans	79.6	137.2	167.2	0	0	0	0	0	117.9
268	L	30.8	Very low	35.9	Very low	170 Å²	170	135 Å²	135	89%	0.89	78%	0.783	S	S	*	*			cis	-178.3	136	-18.5	-110.9	160.1	0	0	0	103.9
269	S	33.1	Very low	35.5	Very low	103 Å²	103	133 Å²	133	72%	0.72	78%	0.78	S	S	*	*			trans	-90.2	164.4	173.6	-169.3	0	0	0	0	110.2
270	P	48.9	Very low	35.4	Very low	113 Å²	113	132.9 Å²	132.9	73%	0.734	78%	0.782	S	S	*	*				-152.2	148.9	100	36.7	-18.4	0	0	0	118.2
271	D	30.1	Very low	35.9	Very low	124 Å²	124	134 Å²	134	66%	0.663	79%	0.787	S	S	*	*			trans	52	147	143	-84	9.1	0	0	0	122.4
272	R	30.5	Very low	36.4	Very low	210 Å²	210	130.3 Å²	130.3	79%	0.792	78%	0.782	S	S	*	*			cis	-156.5	-178.8	7.3	-124.9	-170.7	158.6	86	-6.8	110.7
273	P	41.2	Very low	36.7	Very low	110 Å²	110	127.9 Å²	127.9	71%	0.714	79%	0.785	S	S	*	*			trans	-133.4	-132.6	-131.9	36.6	-7.1	0	0	0	114.3
274	P	51.1	Low	35.9	Very low	110 Å²	110	131.7 Å²	131.7	71%	0.714	79%	0.793	S	S	*	*				-120.9	-162.1	-124.8	46.5	-25.6	0	0	0	112.6
275	P	41.6	Very low	35.3	Very low	118 Å²	118	137 Å²	137	77%	0.766	80%	0.796	S	S	*	*				-121.7	-161.1	51.1	30.4	-7.4	0	0	0	111.3
276	S	29.4	Very low	35.4	Very low	105 Å²	105	142 Å²	142	73%	0.734	80%	0.796	S	S	*	*			cis	-150.8	174.4	15.5	-61.9	0	0	0	0	113.1
277	Y	27.6	Very low	35.3	Very low	227 Å²	227	144.4 Å²	144.4	89%	0.89	80%	0.796	S	S	*	*			trans	-116.1	-173.6	165.9	-90.3	-90.4	0	0	0	109.3
278	P	45.5	Very low	35.3	Very low	125 Å²	125	144.9 Å²	144.9	81%	0.812	79%	0.794	S	S	*	*			cis	-132.7	-170.4	-1.2	28.8	-4.3	0	0	0	114.7
279	G	27.7	Very low	35.5	Very low	72 Å²	72	148.7 Å²	148.7	74%	0.742	80%	0.796	S	S	*	*			trans	-179.8	42.4	172	0	0	0	0	0	121.7
280	S	31.9	Very low	35.2	Very low	119 Å²	119	148.5 Å²	148.5	83%	0.832	80%	0.801	S	S	*	*			trans	-161.7	152.8	162.2	-75.1	0	0	0	0	108
281	P	42.7	Very low	34.3	Very low	126 Å²	126	147.9 Å²	147.9	82%	0.818	81%	0.805	S	S	*	*			cis	-140.6	-157.5	25.2	43.2	-22.5	0	0	0	114.9
282	L	37.9	Very low	34.3	Very low	155 Å²	155	148.2 Å²	148.2	81%	0.812	81%	0.812	S	S	*	*			trans	-67.9	142.5	172.1	-63.8	163	0	0	0	113.6
283	L	32.6	Very low	34.7	Very low	166 Å²	166	143.2 Å²	143.2	87%	0.869	81%	0.806	S	S	*	*				160.9	151.5	115.5	-86	178.5	0	0	0	112.8
284	H	33	Very low	34.1	Very low	190 Å²	190	145.4 Å²	145.4	88%	0.88	81%	0.811	S	S	*	*			trans	-70.3	136.1	169	-70.7	29.5	0	0	0	111.3
285	R	32.2	Very low	33	Very low	236 Å²	236	144.8 Å²	144.8	89%	0.891	81%	0.81	S	S	*	*				-178.2	120.8	108.7	-151.9	171.1	-168.6	-175.7	2.2	113
286	R	33.8	Very low	32.5	Very low	232 Å²	232	147.1 Å²	147.1	88%	0.875	82%	0.815	S	S	*	*			trans	20.2	131.3	154.2	-65.4	-175.2	176	171.7	-1.8	121.9
287	T	29.5	Very low	32.5	Very low	125 Å²	125	146 Å²	146	77%	0.767	82%	0.82	S	S	*	*			trans	-43.7	158.3	145.1	54	0	0	0	0	113.2
288	S	30.6	Very low	32.6	Very low	107 Å²	107	139.2 Å²	139.2	75%	0.748	82%	0.819	S	S	*	*			cis	-158.8	151.9	41.3	-53.7	0	0	0	0	114.1
289	R	33.7	Very low	32.1	Very low	249 Å²	249	141.8 Å²	141.8	94%	0.94	83%	0.826	S	S	*	*			trans	-10.3	144.6	161.2	-59.4	176.9	-178.9	-176	-0.6	117.7
290	A	27.7	Very low	32.3	Very low	99 Å²	99	141.9 Å²	141.9	82%	0.818	83%	0.827	S	S	*	*				-168.6	169.8	63.9	0	0	0	0	0	116
291	A	30.8	Very low	32.5	Very low	100 Å²	100	142.9 Å²	142.9	83%	0.826	83%	0.828	S	S	*	*			trans	66.9	99.7	159.2	0	0	0	0	0	120.6
292	T	28.4	Very low	32.8	Very low	132 Å²	132	141.9 Å²	141.9	81%	0.81	82%	0.822	S	S	*	*			trans	-67.6	158.2	139.3	-6	0	0	0	0	109.4
293	P	40.4	Very low	32.7	Very low	104 Å²	104	143 Å²	143	68%	0.675	83%	0.827	S	S	*	*				-153.5	170.9	72.2	43.7	-24.8	0	0	0	117.4
294	L	28.5	Very low	32.5	Very low	156 Å²	156	138.8 Å²	138.8	82%	0.817	82%	0.824	S	S	*	*			trans	68.3	154.1	164.1	-45.9	-173.9	0	0	0	116.1
295	S	27.2	Very low	32.5	Very low	98 Å²	98	136 Å²	136	69%	0.685	82%	0.824	S	S	*	*			cis	-166.1	160.7	-18.8	-110.2	0	0	0	0	110.3
296	L	30.6	Very low	32.4	Very low	167 Å²	167	131 Å²	131	87%	0.874	82%	0.82	S	S	*	*			trans	54.6	98.2	139.7	-162.5	73.6	0	0	0	120.3
297	G	29.3	Very low	32.8	Very low	82 Å²	82	126.1 Å²	126.1	85%	0.845	82%	0.816	S	S	*	*				61.4	141.3	120.8	0	0	0	0	0	122.6
298	G	31.4	Very low	33.1	Very low	83 Å²	83	126.1 Å²	126.1	86%	0.856	82%	0.819	S	S	*	*			trans	133.8	111.9	156.7	0	0	0	0	0	115
299	D	34.9	Very low	33.2	Very low	179 Å²	179	126.5 Å²	126.5	96%	0.957	82%	0.821	S	S	*	*			trans	-72.6	147.4	168	-66.7	-59.3	0	0	0	111.8
300	G	31.4	Very low	33.4	Very low	75 Å²	75	119.5 Å²	119.5	77%	0.773	81%	0.81	S	S	*	*			trans	171	89.7	174.2	0	0	0	0	0	116.3
301	T	36.1	Very low	34.2	Very low	140 Å²	140	120.5 Å²	120.5	86%	0.859	81%	0.808	S	S	*	*			trans	-59.5	168.4	157.6	15.1	0	0	0	0	112.5
302	P	48.4	Very low	34.4	Very low	104 Å²	104	121.2 Å²	121.2	68%	0.675	81%	0.806	S	S	*	*			cis	-141.3	-173.8	6.9	37.8	-16.6	0	0	0	117.3
303	L	35.9	Very low	35.2	Very low	178 Å²	178	121 Å²	121	93%	0.932	81%	0.807	S	S	*	*			trans	70.8	122.7	154.8	-90.8	132	0	0	0	119.8
304	G	28.1	Very low	35.2	Very low	78 Å²	78	121 Å²	121	80%	0.804	81%	0.809	S	S	*	*			trans	167.6	96.4	167.7	0	0	0	0	0	113.8
305	C	34.8	Very low	36.3	Very low	131 Å²	131	119.9 Å²	119.9	89%	0.885	81%	0.811	S	S	*	*			trans	-91.6	108.9	177.9	169.7	0	0	0	0	111.6
306	V	30.1	Very low	37.9	Very low	133 Å²	133	120.4 Å²	120.4	81%	0.806	81%	0.806	S	S	*	*			trans	-146.9	130.3	159.7	-172.8	0	0	0	0	109.9
307	T	42.1	Very low	39.6	Very low	129 Å²	129	116.1 Å²	116.1	79%	0.791	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.9	131.6	170.3	48	0	0	0	0	111.7
308	P	35.3	Very low	41.3	Very low	125 Å²	125	119.2 Å²	119.2	81%	0.812	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-97.9	125.5	166.9	32	-24.8	0	0	0	112
309	S	31.8	Very low	42.9	Very low	114 Å²	114	122.3 Å²	122.3	80%	0.797	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.6	163.8	173.1	46	0	0	0	0	113.8
310	S	38.6	Very low	45	Very low	103 Å²	103	116 Å²	116	72%	0.72	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-49.4	141.2	173.5	175	0	0	0	0	114.5
311	P	44.1	Very low	47.7	Very low	119 Å²	119	115.3 Å²	115.3	77%	0.773	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-99.2	126.7	164	33.2	-26	0	0	0	112.4
312	C	35	Very low	50.2	Low	115 Å²	115	112.1 Å²	112.1	78%	0.777	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-81.8	151	167.3	-62.6	0	0	0	0	111.4
313	P	45.2	Very low	52.2	Low	127 Å²	127	111.1 Å²	111.1	83%	0.825	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-89.8	142.3	178.2	34.6	-33.2	0	0	0	113.6
314	S	41.3	Very low	54.9	Low	105 Å²	105	108.5 Å²	108.5	73%	0.734	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-76.1	163	175.6	-46.1	0	0	0	0	112.9
315	P	51.9	Low	57.9	Low	132 Å²	132	109.2 Å²	109.2	86%	0.857	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-73.1	140.9	-171.2	29.6	-35.2	0	0	0	113.3
316	I	59	Low	60.6	Low	110 Å²	110	107 Å²	107	56%	0.564	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-82.1	138.2	176.5	-65.3	166.7	0	0	0	109.1	L318 S320	I316-L318 PolarHBondContact O-N 2.94Å; I316-S320 WeakPolarHBondContact CG2-OG 3.45Å
317	S	66.8	Low	63.6	Low	76 Å²	76	107.5 Å²	107.5	53%	0.531	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-60	131.9	-179.9	179.3	0	0	0	0	111.8	E319 S320 E321	S317-E319 VanDerWaalsContact C-N 3.25Å; S317-E319 PolarHBondContact O-N 2.88Å; S317-S320 WeakPolarHBondContact O-CB 3.47Å; S317-S320 PolarHBondContact O-N 2.77Å; S317-S320 PolarHBondContact O-OG 3.03Å; S317-E321 PolarHBondContact O-N 3.41Å
318	L	66.2	Low	65.8	Low	148 Å²	148	103.8 Å²	103.8	78%	0.775	60%	0.602	S	S	*	*	H	α-helix	trans	-55.5	-37.8	-176.8	-69.3	170.8	0	0	0	113	I316 S320 E321 T322	I316-L318 PolarHBondContact O-N 2.94Å; L318-S320 VanDerWaalsContact C-N 3.31Å; L318-S320 PolarHBondContact O-N 3.5Å; L318-E321 WeakPolarHBondContact O-CA 3.35Å; L318-E321 WeakPolarHBondContact O-CB 3.41Å; L318-E321 PolarHBondContact O-N 3.05Å; L318-T322 PolarHBondContact O-N 2.85Å; L318-T322 PolarHBondContact O-OG1 3.49Å
319	E	64.5	Low	68.7	Low	147 Å²	147	101.6 Å²	101.6	69%	0.687	58%	0.583	S	S	*	*	H	α-helix	trans	-63.7	-37.1	178.4	-170	171	-149.7	0	0	112	S317 E321 T322 D323	S317-E319 VanDerWaalsContact C-N 3.25Å; S317-E319 PolarHBondContact O-N 2.88Å; E319-E321 VanDerWaalsContact C-N 3.29Å; E319-E321 PolarHBondContact O-N 3.24Å; E319-T322 WeakPolarHBondContact CA-OG1 3.25Å; E319-T322 PolarHBondContact O-N 3.26Å; E319-T322 PolarHBondContact O-OG1 2.84Å; E319-D323 PolarHBondContact O-N 3.34Å; E319-D323 VanDerWaalsContact O-N 3.13Å
320	S	78.9	Confident	71.7	Confident	46 Å²	46	100.9 Å²	100.9	32%	0.322	57%	0.567	S	S	.	*	H	α-helix	trans	-72.2	-23.6	173.3	75.2	0	0	0	0	112.8	I316 S317 L318 R324	I316-S320 WeakPolarHBondContact CG2-OG 3.45Å; S317-S320 WeakPolarHBondContact O-CB 3.47Å; S317-S320 PolarHBondContact O-N 2.77Å; S317-S320 PolarHBondContact O-OG 3.03Å; L318-S320 VanDerWaalsContact C-N 3.31Å; L318-S320 PolarHBondContact O-N 3.5Å; S320-R324 VanDerWaalsContact O-CG 3.22Å; S320-R324 WeakPolarHBondContact O-CG 3.4Å; S320-R324 PolarHBondContact O-N 3.38Å; S320-R324 VanDerWaalsContact O-N 3.17Å
321	E	87.1	Confident	74.3	Confident	61 Å²	61	103.2 Å²	103.2	29%	0.285	56%	0.56	S	S	.	*	H	α-helix	trans	-78.2	-40.5	173.7	-161.1	60	-152.1	0	0	111.7	S317 L318 E319 D323 R324 L325	S317-E321 PolarHBondContact O-N 3.41Å; L318-E321 WeakPolarHBondContact O-CA 3.35Å; L318-E321 WeakPolarHBondContact O-CB 3.41Å; L318-E321 PolarHBondContact O-N 3.05Å; E319-E321 VanDerWaalsContact C-N 3.29Å; E319-E321 PolarHBondContact O-N 3.24Å; E321-D323 VanDerWaalsContact C-N 3.28Å; E321-D323 PolarHBondContact O-N 3.01Å; E321-R324 WeakPolarHBondContact O-CB 3.34Å; E321-R324 PolarHBondContact O-N 3.22Å; E321-R324 IonicContact OE1-CZ 3.53Å; E321-R324 IonicContact OE1-NE 3.95Å; E321-R324 IonicContact OE1-NH1 3.3Å; E321-R324 PolarHBondContact OE1-NH1 3.07Å; E321-R324 WeakPolarHBondContact OE2-CD 3.24Å; E321-R324 IonicContact OE2-CZ 3.4Å; E321-R324 IonicContact OE2-NE 3.73Å; E321-R324 IonicContact OE2-NH1 2.62Å; E321-R324 PolarHBondContact OE2-NH1 3.17Å; E321-L325 HydrophobicContact CG-CD1 4.47Å; E321-L325 WeakPolarHBondContact O-CG 3.31Å; E321-L325 PolarHBondContact O-N 2.82Å
322	T	88.4	Confident	76.6	Confident	73 Å²	73	102.8 Å²	102.8	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-58.7	-41.1	171.6	44.3	0	0	0	0	111.4	L318 E319 R324 L325 N326	L318-T322 PolarHBondContact O-N 2.85Å; L318-T322 PolarHBondContact O-OG1 3.49Å; E319-T322 WeakPolarHBondContact CA-OG1 3.25Å; E319-T322 PolarHBondContact O-N 3.26Å; E319-T322 PolarHBondContact O-OG1 2.84Å; T322-R324 VanDerWaalsContact C-N 3.32Å; T322-R324 PolarHBondContact O-N 2.89Å; T322-L325 PolarHBondContact O-N 2.8Å; T322-N326 WeakPolarHBondContact O-CB 3.35Å; T322-N326 PolarHBondContact O-N 3.47Å; T322-N326 PolarHBondContact O-ND2 3.36Å
323	D	91.4	Very high	79.5	Confident	83 Å²	83	102 Å²	102	44%	0.444	53%	0.534	S	S	.	.	H	α-helix	trans	-66.9	-30.3	174	-79.7	-7.4	0	0	0	113.7	E319 E321 R327	E319-D323 PolarHBondContact O-N 3.34Å; E319-D323 VanDerWaalsContact O-N 3.13Å; E321-D323 VanDerWaalsContact C-N 3.28Å; E321-D323 PolarHBondContact O-N 3.01Å; D323-R327 WeakPolarHBondContact O-CB 3.22Å; D323-R327 WeakPolarHBondContact O-CG 3.09Å; D323-R327 PolarHBondContact O-N 2.93Å; D323-R327 PolarHBondContact O-NE 3.31Å
324	R	91.5	Very high	81.7	Confident	123 Å²	123	98.1 Å²	98.1	46%	0.464	51%	0.512	S	S	.	.	H	α-helix	trans	-71	-44.4	173.9	-76.5	172.2	66.8	-156.6	-3.4	110.7	S320 E321 T322 R327 C328	S320-R324 VanDerWaalsContact O-CG 3.22Å; S320-R324 WeakPolarHBondContact O-CG 3.4Å; S320-R324 PolarHBondContact O-N 3.38Å; S320-R324 VanDerWaalsContact O-N 3.17Å; E321-R324 WeakPolarHBondContact O-CB 3.34Å; E321-R324 PolarHBondContact O-N 3.22Å; E321-R324 IonicContact OE1-CZ 3.53Å; E321-R324 IonicContact OE1-NE 3.95Å; E321-R324 IonicContact OE1-NH1 3.3Å; E321-R324 PolarHBondContact OE1-NH1 3.07Å; E321-R324 WeakPolarHBondContact OE2-CD 3.24Å; E321-R324 IonicContact OE2-CZ 3.4Å; E321-R324 IonicContact OE2-NE 3.73Å; E321-R324 IonicContact OE2-NH1 2.62Å; E321-R324 PolarHBondContact OE2-NH1 3.17Å; T322-R324 VanDerWaalsContact C-N 3.32Å; T322-R324 PolarHBondContact O-N 2.89Å; R324-R327 PolarHBondContact O-N 3.48Å; R324-C328 PolarHBondContact O-N 2.85Å; R324-C328 PolarHBondContact O-SG 2.93Å; R324-C328 VanDerWaalsContact O-SG 3.35Å
325	L	92.6	Very high	84.1	Confident	93 Å²	93	99.4 Å²	99.4	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-45	177.4	-69.4	172.5	0	0	0	111.8	E321 T322 R327 C328 I329	E321-L325 HydrophobicContact CG-CD1 4.47Å; E321-L325 WeakPolarHBondContact O-CG 3.31Å; E321-L325 PolarHBondContact O-N 2.82Å; T322-L325 PolarHBondContact O-N 2.8Å; L325-R327 VanDerWaalsContact C-N 3.32Å; L325-R327 PolarHBondContact O-N 3.34Å; L325-C328 CarbonylContact O-C 3.55Å; L325-C328 WeakPolarHBondContact O-CA 3.49Å; L325-C328 VanDerWaalsContact O-CB 3.3Å; L325-C328 WeakPolarHBondContact O-CB 3.19Å; L325-C328 PolarHBondContact O-N 2.93Å; L325-I329 WeakPolarHBondContact O-CG1 3.42Å; L325-I329 PolarHBondContact O-N 3.32Å
326	N	91.6	Very high	86.1	Confident	86 Å²	86	97.9 Å²	97.9	46%	0.46	49%	0.486	S	S	.	.	H	α-helix	trans	-57.4	-44.5	173.9	-72.7	-22.4	0	0	0	111.2	T322 C328 I329 E330	T322-N326 WeakPolarHBondContact O-CB 3.35Å; T322-N326 PolarHBondContact O-N 3.47Å; T322-N326 PolarHBondContact O-ND2 3.36Å; N326-C328 VanDerWaalsContact C-N 3.29Å; N326-C328 PolarHBondContact O-N 3.38Å; N326-I329 PolarHBondContact O-N 3.06Å; N326-I329 VanDerWaalsContact O-N 3.14Å; N326-E330 WeakPolarHBondContact O-CG 3.44Å; N326-E330 PolarHBondContact O-N 2.95Å
327	R	92.4	Very high	87.9	Confident	142 Å²	142	98.8 Å²	98.8	54%	0.536	49%	0.488	S	S	.	.	H	α-helix	trans	-66.5	-25.2	173.5	-74.8	177	-72.8	-156.9	-5.4	113.8	D323 R324 L325 R331	D323-R327 WeakPolarHBondContact O-CB 3.22Å; D323-R327 WeakPolarHBondContact O-CG 3.09Å; D323-R327 PolarHBondContact O-N 2.93Å; D323-R327 PolarHBondContact O-NE 3.31Å; R324-R327 PolarHBondContact O-N 3.48Å; L325-R327 VanDerWaalsContact C-N 3.32Å; L325-R327 PolarHBondContact O-N 3.34Å; R327-R331 WeakPolarHBondContact O-CG 3.34Å; R327-R331 PolarHBondContact O-N 3.36Å; R327-R331 PolarHBondContact O-NH1 3.36Å; R327-R331 VanDerWaalsContact O-NH1 3.12Å
328	C	88.6	Confident	89.2	Confident	52 Å²	52	104.7 Å²	104.7	35%	0.351	50%	0.498	S	S	.	.	H	α-helix	trans	-72	-43.6	168.7	-70	0	0	0	0	111.4	R324 L325 N326 R331 L332	R324-C328 PolarHBondContact O-N 2.85Å; R324-C328 PolarHBondContact O-SG 2.93Å; R324-C328 VanDerWaalsContact O-SG 3.35Å; L325-C328 CarbonylContact O-C 3.55Å; L325-C328 WeakPolarHBondContact O-CA 3.49Å; L325-C328 VanDerWaalsContact O-CB 3.3Å; L325-C328 WeakPolarHBondContact O-CB 3.19Å; L325-C328 PolarHBondContact O-N 2.93Å; N326-C328 VanDerWaalsContact C-N 3.29Å; N326-C328 PolarHBondContact O-N 3.38Å; C328-R331 PolarHBondContact O-N 3.22Å; C328-R331 PolarHBondContact SG-NH2 3.07Å; C328-L332 WeakPolarHBondContact O-CG 3.44Å; C328-L332 PolarHBondContact O-N 3.35Å
329	I	95.6	Very high	90.6	Very high	78 Å²	78	102.3 Å²	102.3	40%	0.4	49%	0.486	S	S	.	.	H	α-helix	trans	-60.9	-48	178.5	-69.1	163.1	0	0	0	110.7	L325 N326 R331 L332 K333	L325-I329 WeakPolarHBondContact O-CG1 3.42Å; L325-I329 PolarHBondContact O-N 3.32Å; N326-I329 PolarHBondContact O-N 3.06Å; N326-I329 VanDerWaalsContact O-N 3.14Å; I329-R331 VanDerWaalsContact C-N 3.34Å; I329-R331 PolarHBondContact O-N 3.41Å; I329-L332 CarbonylContact O-C 3.59Å; I329-L332 WeakPolarHBondContact O-CB 3.19Å; I329-L332 PolarHBondContact O-N 3.44Å; I329-L332 VanDerWaalsContact O-N 3.08Å; I329-K333 HydrophobicContact CG2-CD 4.3Å; I329-K333 WeakPolarHBondContact O-CG 3.38Å; I329-K333 PolarHBondContact O-N 3.47Å
330	E	95.1	Very high	92.1	Very high	99 Å²	99	98.5 Å²	98.5	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-64.3	-35.9	177.9	-62.7	-45.6	123.1	0	0	112.7	N326 L332 K333 A334	N326-E330 WeakPolarHBondContact O-CG 3.44Å; N326-E330 PolarHBondContact O-N 2.95Å; E330-L332 VanDerWaalsContact C-N 3.34Å; E330-L332 PolarHBondContact O-N 3.05Å; E330-K333 PolarHBondContact O-N 3.45Å; E330-K333 WeakPolarHBondContact OE1-CE 3.4Å; E330-K333 IonicContact OE1-NZ 3.18Å; E330-K333 PolarHBondContact OE1-NZ 3.45Å; E330-K333 WeakPolarHBondContact OE2-CD 3.36Å; E330-K333 IonicContact OE2-NZ 3.67Å; E330-K333 PolarHBondContact OE2-NZ 3.05Å; E330-A334 WeakPolarHBondContact O-CB 3.38Å; E330-A334 PolarHBondContact O-N 3.23Å
331	R	93.2	Very high	92.9	Very high	152 Å²	152	98.2 Å²	98.2	57%	0.574	47%	0.473	S	S	*	.	H	α-helix	trans	-64.8	-37.3	171.1	-77.7	-169.8	-60.4	-86.7	-1.6	112.5	R327 C328 I329 R335	R327-R331 WeakPolarHBondContact O-CG 3.34Å; R327-R331 PolarHBondContact O-N 3.36Å; R327-R331 PolarHBondContact O-NH1 3.36Å; R327-R331 VanDerWaalsContact O-NH1 3.12Å; C328-R331 PolarHBondContact O-N 3.22Å; C328-R331 PolarHBondContact SG-NH2 3.07Å; I329-R331 VanDerWaalsContact C-N 3.34Å; I329-R331 PolarHBondContact O-N 3.41Å; R331-R335 WeakPolarHBondContact O-CB 3.43Å; R331-R335 PolarHBondContact O-N 3.22Å
332	L	92.4	Very high	93.1	Very high	111 Å²	111	97.4 Å²	97.4	58%	0.581	48%	0.477	S	S	*	.	H	α-helix	trans	-70.1	-40.1	176.7	-73.2	170.4	0	0	0	111.7	C328 I329 E330 R335 N336	C328-L332 WeakPolarHBondContact O-CG 3.44Å; C328-L332 PolarHBondContact O-N 3.35Å; I329-L332 CarbonylContact O-C 3.59Å; I329-L332 WeakPolarHBondContact O-CB 3.19Å; I329-L332 PolarHBondContact O-N 3.44Å; I329-L332 VanDerWaalsContact O-N 3.08Å; E330-L332 VanDerWaalsContact C-N 3.34Å; E330-L332 PolarHBondContact O-N 3.05Å; L332-R335 PolarHBondContact O-N 3.43Å; L332-N336 WeakPolarHBondContact O-CB 3.4Å; L332-N336 PolarHBondContact O-N 3.43Å
333	K	95.5	Very high	93.5	Very high	98 Å²	98	99.5 Å²	99.5	43%	0.426	49%	0.485	S	S	.	.	H	α-helix	trans	-58.9	-53.5	171.8	-72.3	172.6	178.5	172.7	0	111.2	I329 E330 R335 N336 E337	I329-K333 HydrophobicContact CG2-CD 4.3Å; I329-K333 WeakPolarHBondContact O-CG 3.38Å; I329-K333 PolarHBondContact O-N 3.47Å; E330-K333 PolarHBondContact O-N 3.45Å; E330-K333 WeakPolarHBondContact OE1-CE 3.4Å; E330-K333 IonicContact OE1-NZ 3.18Å; E330-K333 PolarHBondContact OE1-NZ 3.45Å; E330-K333 WeakPolarHBondContact OE2-CD 3.36Å; E330-K333 IonicContact OE2-NZ 3.67Å; E330-K333 PolarHBondContact OE2-NZ 3.05Å; K333-R335 VanDerWaalsContact C-N 3.28Å; K333-R335 PolarHBondContact O-N 3.42Å; K333-N336 CarbonylContact O-C 3.57Å; K333-N336 WeakPolarHBondContact O-CA 3.42Å; K333-N336 WeakPolarHBondContact O-CB 3.4Å; K333-N336 PolarHBondContact O-N 2.91Å; K333-E337 WeakPolarHBondContact O-CG 3.46Å; K333-E337 PolarHBondContact O-N 3.31Å
334	A	92.4	Very high	93.7	Very high	45 Å²	45	100.4 Å²	100.4	37%	0.372	49%	0.487	S	S	.	.	H	α-helix	trans	-60.5	-34.6	177.7	0	0	0	0	0	113.1	E330 R338	E330-A334 WeakPolarHBondContact O-CB 3.38Å; E330-A334 PolarHBondContact O-N 3.23Å; A334-R338 WeakPolarHBondContact O-CB 3.36Å; A334-R338 VanDerWaalsContact O-CG 3.29Å; A334-R338 WeakPolarHBondContact O-CG 3.43Å; A334-R338 PolarHBondContact O-N 2.9Å; A334-R338 VanDerWaalsContact O-N 3.14Å
335	R	90.7	Very high	93.8	Very high	133 Å²	133	102.2 Å²	102.2	50%	0.502	49%	0.493	S	S	.	.	H	α-helix	trans	-66.5	-42.4	171.5	-174.7	177.1	-179.1	172.8	2.1	111.3	R331 L332 K333 R338 L339	R331-R335 WeakPolarHBondContact O-CB 3.43Å; R331-R335 PolarHBondContact O-N 3.22Å; L332-R335 PolarHBondContact O-N 3.43Å; K333-R335 VanDerWaalsContact C-N 3.28Å; K333-R335 PolarHBondContact O-N 3.42Å; R335-R338 PolarHBondContact O-N 2.89Å; R335-L339 HydrophobicContact CG-CD1 4.24Å; R335-L339 WeakPolarHBondContact O-CG 3.22Å; R335-L339 PolarHBondContact O-N 3.3Å
336	N	94.6	Very high	93.9	Very high	99 Å²	99	106.8 Å²	106.8	53%	0.529	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-45.4	179.2	-160.7	-21.5	0	0	0	111.3	L332 K333 R338 L339 T340	L332-N336 WeakPolarHBondContact O-CB 3.4Å; L332-N336 PolarHBondContact O-N 3.43Å; K333-N336 CarbonylContact O-C 3.57Å; K333-N336 WeakPolarHBondContact O-CA 3.42Å; K333-N336 WeakPolarHBondContact O-CB 3.4Å; K333-N336 PolarHBondContact O-N 2.91Å; N336-R338 VanDerWaalsContact C-N 3.34Å; N336-R338 PolarHBondContact O-N 3.47Å; N336-L339 PolarHBondContact O-N 3.2Å; N336-L339 VanDerWaalsContact O-N 3.1Å; N336-T340 WeakPolarHBondContact O-CB 3.41Å; N336-T340 PolarHBondContact O-N 3.21Å; N336-T340 PolarHBondContact O-OG1 3.13Å
337	E	96.6	Very high	94.2	Very high	130 Å²	130	107.5 Å²	107.5	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-55.4	-45.1	172.3	-71.6	163.5	-165.6	0	0	112.4	K333 T340 A341	K333-E337 WeakPolarHBondContact O-CG 3.46Å; K333-E337 PolarHBondContact O-N 3.31Å; E337-T340 PolarHBondContact O-N 2.93Å; E337-A341 WeakPolarHBondContact O-CB 3.42Å; E337-A341 PolarHBondContact O-N 3.22Å
338	R	94.3	Very high	94.3	Very high	200 Å²	200	103.1 Å²	103.1	76%	0.755	50%	0.497	S	S	*	.	H	α-helix	trans	-64.5	-38.8	175.6	-73.4	177.2	71.7	103.7	0.3	112.6	A334 R335 N336 A342	A334-R338 WeakPolarHBondContact O-CB 3.36Å; A334-R338 VanDerWaalsContact O-CG 3.29Å; A334-R338 WeakPolarHBondContact O-CG 3.43Å; A334-R338 PolarHBondContact O-N 2.9Å; A334-R338 VanDerWaalsContact O-N 3.14Å; R335-R338 PolarHBondContact O-N 2.89Å; N336-R338 VanDerWaalsContact C-N 3.34Å; N336-R338 PolarHBondContact O-N 3.47Å; R338-A342 WeakPolarHBondContact O-CB 3.33Å; R338-A342 PolarHBondContact O-N 3.43Å
339	L	95.8	Very high	94.5	Very high	97 Å²	97	104.4 Å²	104.4	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-67.2	-46.2	175.5	-73.9	170.4	0	0	0	111.4	R335 N336 A341 A342 L343	R335-L339 HydrophobicContact CG-CD1 4.24Å; R335-L339 WeakPolarHBondContact O-CG 3.22Å; R335-L339 PolarHBondContact O-N 3.3Å; N336-L339 PolarHBondContact O-N 3.2Å; N336-L339 VanDerWaalsContact O-N 3.1Å; L339-A341 VanDerWaalsContact C-N 3.35Å; L339-A341 PolarHBondContact O-N 3.44Å; L339-A342 CarbonylContact O-C 3.59Å; L339-A342 WeakPolarHBondContact O-CB 3.3Å; L339-A342 PolarHBondContact O-N 3.36Å; L339-L343 WeakPolarHBondContact O-CG 3.46Å; L339-L343 PolarHBondContact O-N 2.91Å
340	T	95.4	Very high	94.4	Very high	67 Å²	67	104.2 Å²	104.2	41%	0.411	51%	0.506	S	S	.	.	H	α-helix	trans	-57.8	-46.3	175.2	-59.1	0	0	0	0	111.1	N336 E337 A342 L343 E344	N336-T340 WeakPolarHBondContact O-CB 3.41Å; N336-T340 PolarHBondContact O-N 3.21Å; N336-T340 PolarHBondContact O-OG1 3.13Å; E337-T340 PolarHBondContact O-N 2.93Å; T340-A342 VanDerWaalsContact C-N 3.29Å; T340-A342 PolarHBondContact O-N 3.47Å; T340-L343 PolarHBondContact O-N 3.14Å; T340-E344 PolarHBondContact O-N 3.08Å
341	A	94.7	Very high	94.4	Very high	40 Å²	40	104.4 Å²	104.4	33%	0.331	51%	0.507	S	S	.	.	H	α-helix	trans	-65.3	-30	175.7	0	0	0	0	0	113.1	E337 L339 R345	E337-A341 WeakPolarHBondContact O-CB 3.42Å; E337-A341 PolarHBondContact O-N 3.22Å; L339-A341 VanDerWaalsContact C-N 3.35Å; L339-A341 PolarHBondContact O-N 3.44Å; A341-R345 WeakPolarHBondContact O-CG 3.42Å; A341-R345 PolarHBondContact O-N 3.01Å; A341-R345 PolarHBondContact O-NH1 3.31Å
342	A	93.1	Very high	94.6	Very high	45 Å²	45	101.8 Å²	101.8	37%	0.372	50%	0.501	S	S	.	.	H	α-helix	trans	-73.3	-37.5	173.6	0	0	0	0	0	111.9	R338 L339 T340 R345 R346	R338-A342 WeakPolarHBondContact O-CB 3.33Å; R338-A342 PolarHBondContact O-N 3.43Å; L339-A342 CarbonylContact O-C 3.59Å; L339-A342 WeakPolarHBondContact O-CB 3.3Å; L339-A342 PolarHBondContact O-N 3.36Å; T340-A342 VanDerWaalsContact C-N 3.29Å; T340-A342 PolarHBondContact O-N 3.47Å; A342-R345 PolarHBondContact O-N 3.43Å; A342-R346 WeakPolarHBondContact O-CG 3.42Å; A342-R346 PolarHBondContact O-N 3.17Å
343	L	95.7	Very high	94.6	Very high	117 Å²	117	101.2 Å²	101.2	61%	0.613	50%	0.498	S	S	*	.	H	α-helix	trans	-65.8	-45.9	175.2	-72	171.7	0	0	0	111.9	L339 T340 R345 R346 K347	L339-L343 WeakPolarHBondContact O-CG 3.46Å; L339-L343 PolarHBondContact O-N 2.91Å; T340-L343 PolarHBondContact O-N 3.14Å; L343-R345 VanDerWaalsContact C-N 3.31Å; L343-R345 PolarHBondContact O-N 3.44Å; L343-R346 PolarHBondContact O-N 2.9Å; L343-K347 VanDerWaalsContact O-CB 3.31Å; L343-K347 WeakPolarHBondContact O-CB 3.25Å; L343-K347 PolarHBondContact O-N 3.37Å
344	E	96.4	Very high	94.7	Very high	102 Å²	102	99.5 Å²	99.5	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-34.6	177	-69.9	-56.2	139.7	0	0	112.3	T340 K347 A348	T340-E344 PolarHBondContact O-N 3.08Å; E344-K347 PolarHBondContact O-N 3.38Å; E344-K347 IonicContact OE1-NZ 3.01Å; E344-K347 IonicContact OE2-NZ 3.42Å; E344-K347 PolarHBondContact OE2-NZ 2.9Å; E344-A348 WeakPolarHBondContact O-CB 3.5Å; E344-A348 PolarHBondContact O-N 2.87Å
345	R	94.1	Very high	94.9	Very high	160 Å²	160	102.9 Å²	102.9	60%	0.604	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-51.2	170.5	-72.9	-179.7	-167.8	91.4	-5.6	111.6	A341 A342 L343 K347 A348 D349	A341-R345 WeakPolarHBondContact O-CG 3.42Å; A341-R345 PolarHBondContact O-N 3.01Å; A341-R345 PolarHBondContact O-NH1 3.31Å; A342-R345 PolarHBondContact O-N 3.43Å; L343-R345 VanDerWaalsContact C-N 3.31Å; L343-R345 PolarHBondContact O-N 3.44Å; R345-K347 PolarHBondContact O-N 2.78Å; R345-A348 PolarHBondContact O-N 3.1Å; R345-A348 VanDerWaalsContact O-N 3.1Å; R345-D349 PolarHBondContact O-N 3.39Å
346	R	94.4	Very high	95.1	Very high	190 Å²	190	101.3 Å²	101.3	72%	0.717	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-31.9	178.3	-76.1	-74.7	-68.3	-144.6	-3.7	112.9	A342 L343 S350	A342-R346 WeakPolarHBondContact O-CG 3.42Å; A342-R346 PolarHBondContact O-N 3.17Å; L343-R346 PolarHBondContact O-N 2.9Å; R346-S350 WeakPolarHBondContact O-CB 3.36Å; R346-S350 PolarHBondContact O-N 3.22Å
347	K	97.4	Very high	95.1	Very high	100 Å²	100	100.9 Å²	100.9	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-70.1	-48.7	173.2	176.7	179.5	151.2	-146.1	0	111.2	L343 E344 R345 D349 S350 E351	L343-K347 VanDerWaalsContact O-CB 3.31Å; L343-K347 WeakPolarHBondContact O-CB 3.25Å; L343-K347 PolarHBondContact O-N 3.37Å; E344-K347 PolarHBondContact O-N 3.38Å; E344-K347 IonicContact OE1-NZ 3.01Å; E344-K347 IonicContact OE2-NZ 3.42Å; E344-K347 PolarHBondContact OE2-NZ 2.9Å; R345-K347 PolarHBondContact O-N 2.78Å; K347-D349 VanDerWaalsContact C-N 3.32Å; K347-D349 PolarHBondContact O-N 2.95Å; K347-S350 CarbonylContact O-C 3.57Å; K347-S350 WeakPolarHBondContact O-CB 3.22Å; K347-S350 PolarHBondContact O-N 2.98Å; K347-S350 VanDerWaalsContact O-N 3.11Å; K347-E351 WeakPolarHBondContact CE-OE1 3.4Å; K347-E351 WeakPolarHBondContact CG-OE1 3.41Å; K347-E351 WeakPolarHBondContact O-CG 3.35Å; K347-E351 PolarHBondContact O-N 3.47Å
348	A	94.6	Very high	95.1	Very high	50 Å²	50	97.9 Å²	97.9	41%	0.413	50%	0.496	S	S	.	.	H	α-helix	trans	-59.5	-40.9	174.4	0	0	0	0	0	112.4	E344 R345 E351 Q352	E344-A348 WeakPolarHBondContact O-CB 3.5Å; E344-A348 PolarHBondContact O-N 2.87Å; R345-A348 PolarHBondContact O-N 3.1Å; R345-A348 VanDerWaalsContact O-N 3.1Å; A348-E351 PolarHBondContact O-N 3.21Å; A348-Q352 WeakPolarHBondContact O-CB 3.4Å; A348-Q352 PolarHBondContact O-N 3.39Å
349	D	92.4	Very high	95.1	Very high	79 Å²	79	96.2 Å²	96.2	42%	0.422	49%	0.49	S	S	.	.	H	α-helix	trans	-60.8	-44.3	173.2	-60	-29.8	0	0	0	110.9	R345 K347 Q352 I353	R345-D349 PolarHBondContact O-N 3.39Å; K347-D349 VanDerWaalsContact C-N 3.32Å; K347-D349 PolarHBondContact O-N 2.95Å; D349-Q352 PolarHBondContact O-N 3.18Å; D349-I353 VanDerWaalsContact O-CG1 3.29Å; D349-I353 WeakPolarHBondContact O-CG1 3.36Å; D349-I353 PolarHBondContact O-N 3.11Å
350	S	93.2	Very high	94.9	Very high	75 Å²	75	96.5 Å²	96.5	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-37.9	177.4	-169.7	0	0	0	0	112.7	R346 K347 I353 S354	R346-S350 WeakPolarHBondContact O-CB 3.36Å; R346-S350 PolarHBondContact O-N 3.22Å; K347-S350 CarbonylContact O-C 3.57Å; K347-S350 WeakPolarHBondContact O-CB 3.22Å; K347-S350 PolarHBondContact O-N 2.98Å; K347-S350 VanDerWaalsContact O-N 3.11Å; S350-I353 PolarHBondContact O-N 3.47Å; S350-S354 WeakPolarHBondContact O-CB 3.2Å; S350-S354 PolarHBondContact O-N 2.9Å
351	E	96.3	Very high	94.9	Very high	102 Å²	102	99 Å²	99	48%	0.477	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-40.3	174.1	-73.2	169.8	-170.9	0	0	110.6	K347 A348 S354 L355	K347-E351 WeakPolarHBondContact CE-OE1 3.4Å; K347-E351 WeakPolarHBondContact CG-OE1 3.41Å; K347-E351 WeakPolarHBondContact O-CG 3.35Å; K347-E351 PolarHBondContact O-N 3.47Å; A348-E351 PolarHBondContact O-N 3.21Å; E351-S354 PolarHBondContact O-N 2.88Å; E351-L355 WeakPolarHBondContact O-CB 3.24Å; E351-L355 WeakPolarHBondContact O-CG 3.19Å; E351-L355 PolarHBondContact O-N 2.74Å
352	Q	96.7	Very high	94.9	Very high	97 Å²	97	100.4 Å²	100.4	45%	0.453	51%	0.506	S	S	.	.	H	α-helix	trans	-63.3	-42.3	173.9	-167.1	-168.1	18.1	0	0	112	A348 D349 L355 K356	A348-Q352 WeakPolarHBondContact O-CB 3.4Å; A348-Q352 PolarHBondContact O-N 3.39Å; D349-Q352 PolarHBondContact O-N 3.18Å; Q352-L355 PolarHBondContact O-N 3.4Å; Q352-K356 WeakPolarHBondContact O-CG 3.35Å; Q352-K356 PolarHBondContact O-N 3.14Å
353	I	93.4	Very high	94.8	Very high	100 Å²	100	99.8 Å²	99.8	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-44.6	175.4	-68.7	163.8	0	0	0	110.3	D349 S350 L355 K356 L357	D349-I353 VanDerWaalsContact O-CG1 3.29Å; D349-I353 WeakPolarHBondContact O-CG1 3.36Å; D349-I353 PolarHBondContact O-N 3.11Å; S350-I353 PolarHBondContact O-N 3.47Å; I353-L355 PolarHBondContact O-N 3Å; I353-K356 WeakPolarHBondContact O-CB 3.38Å; I353-K356 PolarHBondContact O-N 2.99Å; I353-K356 VanDerWaalsContact O-N 3.12Å; I353-L357 HydrophobicContact CG2-CD1 4.11Å; I353-L357 HydrophobicContact CG2-CG 4.43Å; I353-L357 WeakPolarHBondContact O-CG 3.48Å; I353-L357 PolarHBondContact O-N 3.2Å
354	S	96.5	Very high	94.7	Very high	62 Å²	62	97.6 Å²	97.6	43%	0.434	49%	0.49	S	S	.	.	H	α-helix	trans	-57.5	-47.4	175.5	-176.2	0	0	0	0	111.8	S350 E351 K356 L357 C358	S350-S354 WeakPolarHBondContact O-CB 3.2Å; S350-S354 PolarHBondContact O-N 2.9Å; E351-S354 PolarHBondContact O-N 2.88Å; S354-K356 VanDerWaalsContact C-N 3.3Å; S354-K356 PolarHBondContact O-N 3.18Å; S354-L357 PolarHBondContact O-N 2.69Å; S354-L357 VanDerWaalsContact O-N 3.13Å; S354-C358 PolarHBondContact O-N 3.25Å; S354-C358 PolarHBondContact O-SG 3.42Å
355	L	95.9	Very high	94.6	Very high	116 Å²	116	95.7 Å²	95.7	61%	0.607	49%	0.488	S	S	*	.	H	α-helix	trans	-63.2	-32.3	175.5	-71.3	171.8	0	0	0	113.4	E351 Q352 I353 R359	E351-L355 WeakPolarHBondContact O-CB 3.24Å; E351-L355 WeakPolarHBondContact O-CG 3.19Å; E351-L355 PolarHBondContact O-N 2.74Å; Q352-L355 PolarHBondContact O-N 3.4Å; I353-L355 PolarHBondContact O-N 3Å; L355-R359 WeakPolarHBondContact O-CD 3.38Å; L355-R359 VanDerWaalsContact O-CG 3.28Å; L355-R359 WeakPolarHBondContact O-CG 3.38Å; L355-R359 PolarHBondContact O-N 3.45Å
356	K	95	Very high	94.6	Very high	99 Å²	99	88.8 Å²	88.8	43%	0.43	47%	0.465	S	S	.	.	H	α-helix	trans	-69.6	-41.6	172.3	-75.5	175.2	176.5	-178.4	0	111.2	Q352 I353 S354 R359 L360	Q352-K356 WeakPolarHBondContact O-CG 3.35Å; Q352-K356 PolarHBondContact O-N 3.14Å; I353-K356 WeakPolarHBondContact O-CB 3.38Å; I353-K356 PolarHBondContact O-N 2.99Å; I353-K356 VanDerWaalsContact O-N 3.12Å; S354-K356 VanDerWaalsContact C-N 3.3Å; S354-K356 PolarHBondContact O-N 3.18Å; K356-R359 PolarHBondContact O-N 3.36Å; K356-L360 WeakPolarHBondContact O-CG 3.33Å; K356-L360 PolarHBondContact O-N 3.02Å
357	L	96	Very high	94.6	Very high	91 Å²	91	84.4 Å²	84.4	48%	0.476	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-51.7	175.9	-71.3	171.1	0	0	0	111.5	I353 S354 R359 L360 E361	I353-L357 HydrophobicContact CG2-CD1 4.11Å; I353-L357 HydrophobicContact CG2-CG 4.43Å; I353-L357 WeakPolarHBondContact O-CG 3.48Å; I353-L357 PolarHBondContact O-N 3.2Å; S354-L357 PolarHBondContact O-N 2.69Å; S354-L357 VanDerWaalsContact O-N 3.13Å; L357-R359 PolarHBondContact O-N 3.2Å; L357-R359 VanDerWaalsContact O-N 3.16Å; L357-L360 PolarHBondContact O-N 3.17Å; L357-E361 WeakPolarHBondContact O-CB 3.34Å; L357-E361 WeakPolarHBondContact O-CG 3.47Å; L357-E361 PolarHBondContact O-N 3.44Å
358	C	94.8	Very high	94.5	Very high	66 Å²	66	85.9 Å²	85.9	45%	0.446	46%	0.463	S	S	.	.	H	α-helix	trans	-56.6	-35.7	178	-62.5	0	0	0	0	112.7	S354 S362	S354-C358 PolarHBondContact O-N 3.25Å; S354-C358 PolarHBondContact O-SG 3.42Å; C358-S362 WeakPolarHBondContact O-CB 3.43Å; C358-S362 PolarHBondContact O-N 2.95Å; C358-S362 VanDerWaalsContact O-N 3.08Å; C358-S362 PolarHBondContact O-OG 3.42Å
359	R	94.7	Very high	94.5	Very high	165 Å²	165	88.3 Å²	88.3	62%	0.623	47%	0.467	S	S	*	.	H	α-helix	trans	-65.6	-53	173.3	-75.5	170.5	-176.8	-104	2.1	111.1	L355 K356 L357 E361 S362 D363	L355-R359 WeakPolarHBondContact O-CD 3.38Å; L355-R359 VanDerWaalsContact O-CG 3.28Å; L355-R359 WeakPolarHBondContact O-CG 3.38Å; L355-R359 PolarHBondContact O-N 3.45Å; K356-R359 PolarHBondContact O-N 3.36Å; L357-R359 PolarHBondContact O-N 3.2Å; L357-R359 VanDerWaalsContact O-N 3.16Å; R359-E361 VanDerWaalsContact C-N 3.3Å; R359-E361 PolarHBondContact O-N 3.4Å; R359-S362 CarbonylContact O-C 3.6Å; R359-S362 WeakPolarHBondContact O-CA 3.23Å; R359-S362 PolarHBondContact O-N 3.1Å; R359-S362 PolarHBondContact O-OG 3.36Å; R359-D363 PolarHBondContact O-N 2.97Å
360	L	92.5	Very high	94.7	Very high	104 Å²	104	85.3 Å²	85.3	55%	0.545	45%	0.454	S	S	.	.	H	α-helix	trans	-60.4	-37.1	179.4	-69.2	171.9	0	0	0	112.7	K356 L357 D363 C364	K356-L360 WeakPolarHBondContact O-CG 3.33Å; K356-L360 PolarHBondContact O-N 3.02Å; L357-L360 PolarHBondContact O-N 3.17Å; L360-D363 PolarHBondContact O-N 2.9Å; L360-C364 WeakPolarHBondContact O-CB 3.26Å; L360-C364 PolarHBondContact O-N 3.13Å; L360-C364 PolarHBondContact O-SG 3.08Å
361	E	95.9	Very high	94.8	Very high	120 Å²	120	86.4 Å²	86.4	56%	0.561	45%	0.453	S	S	*	.	H	α-helix	trans	-63.6	-42.8	172.9	-72.5	170.9	178.7	0	0	111.6	L357 R359 C364 S365	L357-E361 WeakPolarHBondContact O-CB 3.34Å; L357-E361 WeakPolarHBondContact O-CG 3.47Å; L357-E361 PolarHBondContact O-N 3.44Å; R359-E361 VanDerWaalsContact C-N 3.3Å; R359-E361 PolarHBondContact O-N 3.4Å; E361-C364 PolarHBondContact O-N 3.15Å; E361-S365 WeakPolarHBondContact O-CB 3.42Å; E361-S365 PolarHBondContact O-N 2.9Å; E361-S365 PolarHBondContact O-OG 3.32Å
362	S	93.1	Very high	94.8	Very high	68 Å²	68	87.5 Å²	87.5	48%	0.476	45%	0.453	S	S	.	.	H	α-helix	trans	-67.5	-38.9	175.2	73.9	0	0	0	0	112.8	C358 R359 S365 A366	C358-S362 WeakPolarHBondContact O-CB 3.43Å; C358-S362 PolarHBondContact O-N 2.95Å; C358-S362 VanDerWaalsContact O-N 3.08Å; C358-S362 PolarHBondContact O-OG 3.42Å; R359-S362 CarbonylContact O-C 3.6Å; R359-S362 WeakPolarHBondContact O-CA 3.23Å; R359-S362 PolarHBondContact O-N 3.1Å; R359-S362 PolarHBondContact O-OG 3.36Å; S362-S365 PolarHBondContact O-N 3.36Å; S362-A366 VanDerWaalsContact O-CB 3.3Å; S362-A366 WeakPolarHBondContact O-CB 3.3Å; S362-A366 PolarHBondContact O-N 2.87Å
363	D	92.1	Very high	94.7	Very high	33 Å²	33	86.1 Å²	86.1	18%	0.176	44%	0.444	C	S	.	.	H	α-helix	trans	-67.8	-40.2	175.5	-74.2	-47.9	0	0	0	110.9	R359 L360 A366 L367 A471	R359-D363 PolarHBondContact O-N 2.97Å; L360-D363 PolarHBondContact O-N 2.9Å; D363-A366 PolarHBondContact O-N 2.88Å; D363-L367 WeakPolarHBondContact O-CB 3.47Å; D363-L367 VanDerWaalsContact O-CG 3.25Å; D363-L367 WeakPolarHBondContact O-CG 3.34Å; D363-L367 PolarHBondContact O-N 3.38Å; D363-A471 PolarHBondContact OD1-N 3.4Å
364	C	93.6	Very high	94.8	Very high	71 Å²	71	82.8 Å²	82.8	48%	0.48	43%	0.43	S	S	.	.	H	α-helix	trans	-62.7	-44.1	173.2	-71.2	0	0	0	0	111.7	L360 E361 A366 L367 Q368	L360-C364 WeakPolarHBondContact O-CB 3.26Å; L360-C364 PolarHBondContact O-N 3.13Å; L360-C364 PolarHBondContact O-SG 3.08Å; E361-C364 PolarHBondContact O-N 3.15Å; C364-A366 VanDerWaalsContact C-N 3.35Å; C364-L367 PolarHBondContact O-N 3.4Å; C364-Q368 WeakPolarHBondContact O-CG 3.25Å; C364-Q368 PolarHBondContact O-N 3.12Å
365	S	94.8	Very high	94.8	Very high	61 Å²	61	82.8 Å²	82.8	43%	0.427	42%	0.423	S	S	.	.	H	α-helix	trans	-63.7	-40.6	176.9	-55.5	0	0	0	0	111.6	E361 S362 Q368 M369	E361-S365 WeakPolarHBondContact O-CB 3.42Å; E361-S365 PolarHBondContact O-N 2.9Å; E361-S365 PolarHBondContact O-OG 3.32Å; S362-S365 PolarHBondContact O-N 3.36Å; S365-Q368 PolarHBondContact O-N 2.84Å; S365-M369 PolarHBondContact O-N 3.46Å
366	A	94	Very high	94.8	Very high	15 Å²	15	80 Å²	80	12%	0.124	41%	0.407	C	S	.	.	H	α-helix	trans	-62.2	-47.6	173.5	0	0	0	0	0	111.7	S362 D363 C364 Q368 M369 A370 I468	S362-A366 VanDerWaalsContact O-CB 3.3Å; S362-A366 WeakPolarHBondContact O-CB 3.3Å; S362-A366 PolarHBondContact O-N 2.87Å; D363-A366 PolarHBondContact O-N 2.88Å; C364-A366 VanDerWaalsContact C-N 3.35Å; A366-Q368 VanDerWaalsContact C-N 3.33Å; A366-Q368 PolarHBondContact O-N 2.92Å; A366-M369 PolarHBondContact O-N 2.84Å; A366-A370 PolarHBondContact O-N 3.12Å; A366-I468 HydrophobicContact CB-CG2 3.74Å; A366-I468 WeakPolarHBondContact O-CG2 3.48Å
367	L	93.2	Very high	94.8	Very high	98 Å²	98	75.9 Å²	75.9	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-62.9	-36.7	177	-71.6	171.1	0	0	0	112.5	D363 C364 A370 L371	D363-L367 WeakPolarHBondContact O-CB 3.47Å; D363-L367 VanDerWaalsContact O-CG 3.25Å; D363-L367 WeakPolarHBondContact O-CG 3.34Å; D363-L367 PolarHBondContact O-N 3.38Å; C364-L367 PolarHBondContact O-N 3.4Å; L367-A370 PolarHBondContact O-N 2.95Å; L367-L371 WeakPolarHBondContact O-CB 3.38Å; L367-L371 PolarHBondContact O-N 2.98Å
368	Q	96	Very high	94.8	Very high	131 Å²	131	78.6 Å²	78.6	61%	0.612	40%	0.4	S	S	*	.	H	α-helix	trans	-62.4	-46.1	172.5	-75.8	172.7	-4.8	0	0	111.8	C364 S365 A366 A370 L371 R372	C364-Q368 WeakPolarHBondContact O-CG 3.25Å; C364-Q368 PolarHBondContact O-N 3.12Å; S365-Q368 PolarHBondContact O-N 2.84Å; A366-Q368 VanDerWaalsContact C-N 3.33Å; A366-Q368 PolarHBondContact O-N 2.92Å; Q368-A370 VanDerWaalsContact C-N 3.32Å; Q368-A370 PolarHBondContact O-N 2.8Å; Q368-L371 WeakPolarHBondContact O-CB 3.18Å; Q368-L371 PolarHBondContact O-N 2.87Å; Q368-R372 WeakPolarHBondContact O-CG 3.17Å; Q368-R372 PolarHBondContact O-N 3.22Å
369	M	94.9	Very high	94.9	Very high	101 Å²	101	81.4 Å²	81.4	50%	0.498	41%	0.407	S	S	.	.	H	α-helix	trans	-62.8	-37.8	173.8	-68.8	-170.9	-60.7	0	0	112.4	S365 A366 L371 R372 Y373 I468	S365-M369 PolarHBondContact O-N 3.46Å; A366-M369 PolarHBondContact O-N 2.84Å; M369-L371 VanDerWaalsContact C-N 3.29Å; M369-L371 PolarHBondContact O-N 2.8Å; M369-R372 PolarHBondContact O-N 2.91Å; M369-Y373 WeakPolarHBondContact O-CD2 3.17Å; M369-Y373 PolarHBondContact O-N 3.13Å; M369-I468 HydrophobicContact CB-CD1 3.63Å
370	A	95.7	Very high	94.9	Very high	16 Å²	16	73.6 Å²	73.6	13%	0.132	38%	0.378	C	S	.	.	H	α-helix	trans	-67.5	-30.5	176.6	0	0	0	0	0	112.8	A366 L367 Q368 S374 R465 I468	A366-A370 PolarHBondContact O-N 3.12Å; L367-A370 PolarHBondContact O-N 2.95Å; Q368-A370 VanDerWaalsContact C-N 3.32Å; Q368-A370 PolarHBondContact O-N 2.8Å; A370-S374 PolarHBondContact O-N 2.87Å; A370-S374 PolarHBondContact O-OG 3Å; A370-R465 HydrophobicContact CB-CG 4.31Å; A370-I468 HydrophobicContact CB-CB 4.36Å; A370-I468 HydrophobicContact CB-CD1 3.94Å; A370-I468 HydrophobicContact CB-CG2 4.2Å
371	L	94.9	Very high	95.1	Very high	98 Å²	98	73.4 Å²	73.4	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-69.6	-48.3	171.9	-178.6	64.6	0	0	0	110.9	L367 Q368 M369 Y373 S374 E375	L367-L371 WeakPolarHBondContact O-CB 3.38Å; L367-L371 PolarHBondContact O-N 2.98Å; Q368-L371 WeakPolarHBondContact O-CB 3.18Å; Q368-L371 PolarHBondContact O-N 2.87Å; M369-L371 VanDerWaalsContact C-N 3.29Å; M369-L371 PolarHBondContact O-N 2.8Å; L371-Y373 VanDerWaalsContact C-N 3.34Å; L371-Y373 PolarHBondContact O-N 3.31Å; L371-S374 WeakPolarHBondContact CA-OG 3.31Å; L371-S374 CarbonylContact O-C 3.53Å; L371-S374 WeakPolarHBondContact O-CA 3.17Å; L371-S374 PolarHBondContact O-N 2.81Å; L371-S374 PolarHBondContact O-OG 3.23Å; L371-E375 WeakPolarHBondContact O-CG 3.39Å; L371-E375 PolarHBondContact O-N 2.85Å
372	R	96.4	Very high	95.1	Very high	125 Å²	125	69.5 Å²	69.5	47%	0.472	36%	0.363	S	S	.	.	H	α-helix	trans	-53.6	-47	174.7	-70.6	-62.2	-54.1	159.2	2.7	112.2	Q368 M369 S374 E375 E376	Q368-R372 WeakPolarHBondContact O-CG 3.17Å; Q368-R372 PolarHBondContact O-N 3.22Å; M369-R372 PolarHBondContact O-N 2.91Å; R372-S374 VanDerWaalsContact C-N 3.26Å; R372-S374 PolarHBondContact O-N 3.02Å; R372-E375 WeakPolarHBondContact CD-OE2 3.5Å; R372-E375 IonicContact CZ-OE2 2.7Å; R372-E375 IonicContact NE-OE2 3.74Å; R372-E375 IonicContact NH1-OE2 3.09Å; R372-E375 PolarHBondContact NH1-OE2 2.65Å; R372-E375 WeakPolarHBondContact O-CB 3.49Å; R372-E375 PolarHBondContact O-N 2.88Å; R372-E376 IonicContact NH2-OE1 2.98Å; R372-E376 PolarHBondContact NH2-OE1 2.94Å; R372-E376 WeakPolarHBondContact O-CG 3.36Å; R372-E376 PolarHBondContact O-N 3.14Å
373	Y	96	Very high	95.2	Very high	68 Å²	68	71.7 Å²	71.7	27%	0.267	37%	0.365	S	S	.	.	H	α-helix	trans	-66.7	-23	175.3	-67.7	-40	0	0	0	114	M369 L371 C377 L461 E464 R465 I468	M369-Y373 WeakPolarHBondContact O-CD2 3.17Å; M369-Y373 PolarHBondContact O-N 3.13Å; L371-Y373 VanDerWaalsContact C-N 3.34Å; L371-Y373 PolarHBondContact O-N 3.31Å; Y373-C377 WeakPolarHBondContact O-CB 3.49Å; Y373-C377 PolarHBondContact O-N 2.91Å; Y373-C377 VanDerWaalsContact O-N 3.16Å; Y373-C377 PolarHBondContact O-SG 3.45Å; Y373-L461 HydrophobicContact CD1-CD2 3.84Å; Y373-L461 HydrophobicContact CE1-CD2 4.43Å; Y373-E464 HydrophobicContact CD2-CB 4.12Å; Y373-E464 HydrophobicContact CE1-CB 4.42Å; Y373-E464 HydrophobicContact CE2-CB 3.83Å; Y373-R465 HydrophobicContact CD2-CB 4.43Å; Y373-I468 HydrophobicContact CD2-CD1 3.68Å; Y373-I468 HydrophobicContact CE2-CD1 3.7Å; Y373-I468 HydrophobicContact CE2-CG1 4.49Å
374	S	94.6	Very high	95.3	Very high	30 Å²	30	70.9 Å²	70.9	21%	0.21	36%	0.361	C	S	.	.	H	α-helix	trans	-79.3	-35.7	170.1	43.7	0	0	0	0	113.2	A370 L371 R372 C377 E378	A370-S374 PolarHBondContact O-N 2.87Å; A370-S374 PolarHBondContact O-OG 3Å; L371-S374 WeakPolarHBondContact CA-OG 3.31Å; L371-S374 CarbonylContact O-C 3.53Å; L371-S374 WeakPolarHBondContact O-CA 3.17Å; L371-S374 PolarHBondContact O-N 2.81Å; L371-S374 PolarHBondContact O-OG 3.23Å; R372-S374 VanDerWaalsContact C-N 3.26Å; R372-S374 PolarHBondContact O-N 3.02Å; S374-C377 WeakPolarHBondContact O-CB 3.37Å; S374-C377 PolarHBondContact O-N 3.44Å; S374-E378 WeakPolarHBondContact O-CB 3.48Å; S374-E378 PolarHBondContact O-N 3.44Å
375	E	96.6	Very high	95.3	Very high	63 Å²	63	72.5 Å²	72.5	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-50.1	171.5	-66.6	165.8	-177.2	0	0	109.9	L371 R372 C377 E378 E379	L371-E375 WeakPolarHBondContact O-CG 3.39Å; L371-E375 PolarHBondContact O-N 2.85Å; R372-E375 WeakPolarHBondContact CD-OE2 3.5Å; R372-E375 IonicContact CZ-OE2 2.7Å; R372-E375 IonicContact NE-OE2 3.74Å; R372-E375 IonicContact NH1-OE2 3.09Å; R372-E375 PolarHBondContact NH1-OE2 2.65Å; R372-E375 WeakPolarHBondContact O-CB 3.49Å; R372-E375 PolarHBondContact O-N 2.88Å; E375-C377 VanDerWaalsContact C-N 3.27Å; E375-C377 PolarHBondContact O-N 2.89Å; E375-E378 WeakPolarHBondContact O-CA 3.38Å; E375-E378 WeakPolarHBondContact O-CB 3.44Å; E375-E378 PolarHBondContact O-N 2.84Å; E375-E379 WeakPolarHBondContact O-CG 3.37Å; E375-E379 PolarHBondContact O-N 2.94Å
376	E	95.9	Very high	95.3	Very high	58 Å²	58	76.3 Å²	76.3	27%	0.271	37%	0.374	S	S	.	.	H	α-helix	trans	-64.5	-28.2	176.5	-68.5	167.9	-159	0	0	112.7	R372 A380 L461	R372-E376 IonicContact NH2-OE1 2.98Å; R372-E376 PolarHBondContact NH2-OE1 2.94Å; R372-E376 WeakPolarHBondContact O-CG 3.36Å; R372-E376 PolarHBondContact O-N 3.14Å; E376-A380 WeakPolarHBondContact O-CB 3.43Å; E376-A380 PolarHBondContact O-N 3.4Å; E376-L461 HydrophobicContact CB-CD1 3.92Å; E376-L461 HydrophobicContact CB-CD2 4.19Å
377	C	95.1	Very high	95.1	Very high	12 Å²	12	77 Å²	77	8%	0.081	38%	0.375	C	S	.	.	H	α-helix	trans	-68.4	-42.3	169.4	-79.4	0	0	0	0	111.7	Y373 S374 E375 A380 Y381 L461	Y373-C377 WeakPolarHBondContact O-CB 3.49Å; Y373-C377 PolarHBondContact O-N 2.91Å; Y373-C377 VanDerWaalsContact O-N 3.16Å; Y373-C377 PolarHBondContact O-SG 3.45Å; S374-C377 WeakPolarHBondContact O-CB 3.37Å; S374-C377 PolarHBondContact O-N 3.44Å; E375-C377 VanDerWaalsContact C-N 3.27Å; E375-C377 PolarHBondContact O-N 2.89Å; C377-A380 PolarHBondContact O-N 2.97Å; C377-Y381 WeakPolarHBondContact O-CB 3.46Å; C377-Y381 WeakPolarHBondContact O-CD2 3.47Å; C377-Y381 PolarHBondContact O-N 3.31Å; C377-L461 WeakPolarHBondContact SG-CB 3.35Å
378	E	96.1	Very high	95	Very high	148 Å²	148	76.7 Å²	76.7	69%	0.692	37%	0.368	S	S	*	.	H	α-helix	trans	-65.9	-44.9	-178.8	-173.8	173	170.7	0	0	110.9	S374 E375 A380 Y381 G382	S374-E378 WeakPolarHBondContact O-CB 3.48Å; S374-E378 PolarHBondContact O-N 3.44Å; E375-E378 WeakPolarHBondContact O-CA 3.38Å; E375-E378 WeakPolarHBondContact O-CB 3.44Å; E375-E378 PolarHBondContact O-N 2.84Å; E378-A380 PolarHBondContact O-N 3.38Å; E378-Y381 CarbonylContact O-C 3.55Å; E378-Y381 WeakPolarHBondContact O-CB 3.41Å; E378-Y381 PolarHBondContact O-N 3.41Å; E378-Y381 VanDerWaalsContact O-N 3.16Å; E378-G382 PolarHBondContact O-N 3.36Å
379	E	96.2	Very high	94.7	Very high	124 Å²	124	75.7 Å²	75.7	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-54.8	-50.4	171.6	-69.9	173.6	-179.3	0	0	111.3	E375 Y381 G382 E383	E375-E379 WeakPolarHBondContact O-CG 3.37Å; E375-E379 PolarHBondContact O-N 2.94Å; E379-Y381 VanDerWaalsContact C-N 3.31Å; E379-Y381 PolarHBondContact O-N 3.07Å; E379-G382 WeakPolarHBondContact O-CA 3.34Å; E379-G382 PolarHBondContact O-N 3.48Å; E379-G382 VanDerWaalsContact O-N 3.08Å; E379-E383 PolarHBondContact O-N 3.16Å
380	A	95.8	Very high	94.4	Very high	2 Å²	2	72.1 Å²	72.1	2%	0.017	35%	0.349	C	S	.	.	H	α-helix	trans	-65.7	-30.1	178.4	0	0	0	0	0	113.5	E376 C377 E378 L384 L454 I458	E376-A380 WeakPolarHBondContact O-CB 3.43Å; E376-A380 PolarHBondContact O-N 3.4Å; C377-A380 PolarHBondContact O-N 2.97Å; E378-A380 PolarHBondContact O-N 3.38Å; A380-L384 WeakPolarHBondContact O-CB 3.43Å; A380-L384 PolarHBondContact O-N 2.95Å; A380-L384 VanDerWaalsContact O-N 3.16Å; A380-L454 HydrophobicContact CB-CD2 4.29Å; A380-I458 HydrophobicContact CB-CD1 4.26Å; A380-I458 HydrophobicContact CB-CG1 3.72Å
381	Y	96.2	Very high	93.9	Very high	99 Å²	99	74.5 Å²	74.5	39%	0.388	36%	0.357	S	S	.	.	H	α-helix	trans	-70.7	-37.9	170.4	-87.3	-61.4	0	0	0	112	C377 E378 E379 L384 L385 I458 K462	C377-Y381 WeakPolarHBondContact O-CB 3.46Å; C377-Y381 WeakPolarHBondContact O-CD2 3.47Å; C377-Y381 PolarHBondContact O-N 3.31Å; E378-Y381 CarbonylContact O-C 3.55Å; E378-Y381 WeakPolarHBondContact O-CB 3.41Å; E378-Y381 PolarHBondContact O-N 3.41Å; E378-Y381 VanDerWaalsContact O-N 3.16Å; E379-Y381 VanDerWaalsContact C-N 3.31Å; E379-Y381 PolarHBondContact O-N 3.07Å; Y381-L384 HydrophobicContact CD1-CD2 4.48Å; Y381-L384 PolarHBondContact O-N 2.76Å; Y381-L385 WeakPolarHBondContact O-CG 3.38Å; Y381-L385 PolarHBondContact O-N 3.48Å; Y381-I458 HydrophobicContact CD1-CD1 3.83Å; Y381-I458 HydrophobicContact CD2-CD1 4.47Å; Y381-I458 HydrophobicContact CE1-CD1 3.93Å; Y381-I458 HydrophobicContact CE1-CG2 4.23Å; Y381-I458 HydrophobicContact CE2-CG2 3.75Å; Y381-I458 HydrophobicContact CG-CD1 4.12Å; Y381-K462 VanDerWaalsContact OH-CE 3.31Å; Y381-K462 WeakPolarHBondContact OH-CE 3.34Å; Y381-K462 PolarHBondContact OH-NZ 3.32Å
382	G	95.6	Very high	93.5	Very high	38 Å²	38	76.1 Å²	76.1	39%	0.392	37%	0.365	S	S	.	.	H	α-helix	trans	-62.4	-46.6	173.8	0	0	0	0	0	112.5	E378 E379 L384 L385 F386	E378-G382 PolarHBondContact O-N 3.36Å; E379-G382 WeakPolarHBondContact O-CA 3.34Å; E379-G382 PolarHBondContact O-N 3.48Å; E379-G382 VanDerWaalsContact O-N 3.08Å; G382-L384 VanDerWaalsContact C-N 3.3Å; G382-L384 PolarHBondContact O-N 2.86Å; G382-L385 PolarHBondContact O-N 3.01Å; G382-F386 PolarHBondContact O-N 2.77Å
383	E	95	Very high	92.6	Very high	114 Å²	114	77.8 Å²	77.8	53%	0.533	38%	0.378	S	S	.	.	H	α-helix	trans	-59.9	-40.5	173.1	-73.5	-169.4	-151.3	0	0	112.3	E379 F386 L387 L454	E379-E383 PolarHBondContact O-N 3.16Å; E383-F386 PolarHBondContact O-N 3.07Å; E383-L387 WeakPolarHBondContact O-CG 3.33Å; E383-L387 PolarHBondContact O-N 3.41Å; E383-L454 HydrophobicContact CB-CD1 3.87Å; E383-L454 HydrophobicContact CB-CD2 4.13Å
384	L	94.4	Very high	91.4	Very high	17 Å²	17	81.7 Å²	81.7	9%	0.089	40%	0.399	C	S	.	.	H	α-helix	trans	-65.2	-40.8	177.9	-175.3	67	0	0	0	111.7	A380 Y381 G382 L387 Y388 E451 L454 I458	A380-L384 WeakPolarHBondContact O-CB 3.43Å; A380-L384 PolarHBondContact O-N 2.95Å; A380-L384 VanDerWaalsContact O-N 3.16Å; Y381-L384 HydrophobicContact CD1-CD2 4.48Å; Y381-L384 PolarHBondContact O-N 2.76Å; G382-L384 VanDerWaalsContact C-N 3.3Å; G382-L384 PolarHBondContact O-N 2.86Å; L384-L387 PolarHBondContact O-N 2.82Å; L384-Y388 HydrophobicContact CD1-CE2 4.01Å; L384-Y388 HydrophobicContact CD2-CE2 4.34Å; L384-Y388 HydrophobicContact CG-CD2 4.27Å; L384-Y388 HydrophobicContact CG-CE2 3.79Å; L384-Y388 WeakPolarHBondContact O-CD2 3.46Å; L384-Y388 PolarHBondContact O-N 3.35Å; L384-E451 HydrophobicContact CD1-CB 4.47Å; L384-E451 HydrophobicContact CD1-CG 3.45Å; L384-E451 VanDerWaalsContact CD1-CG 3.45Å; L384-L454 HydrophobicContact CB-CD1 4.42Å; L384-L454 HydrophobicContact CD1-CB 4.47Å; L384-I458 HydrophobicContact CD2-CD1 4.14Å
385	L	94.1	Very high	89.3	Confident	105 Å²	105	84.4 Å²	84.4	55%	0.55	42%	0.417	S	S	.	.	H	α-helix	trans	-63	-46.7	173.1	-75.1	168.4	0	0	0	111.5	Y381 G382 L387 Y388 E389	Y381-L385 WeakPolarHBondContact O-CG 3.38Å; Y381-L385 PolarHBondContact O-N 3.48Å; G382-L385 PolarHBondContact O-N 3.01Å; L385-L387 VanDerWaalsContact C-N 3.29Å; L385-L387 PolarHBondContact O-N 3.42Å; L385-Y388 WeakPolarHBondContact O-CA 3.41Å; L385-Y388 WeakPolarHBondContact O-CB 3.5Å; L385-Y388 PolarHBondContact O-N 3.43Å; L385-E389 PolarHBondContact O-N 2.7Å
386	F	94.2	Very high	87.2	Confident	141 Å²	141	86.6 Å²	86.6	62%	0.618	44%	0.437	S	S	*	.	H	α-helix	trans	-57.4	-40.4	176.1	178.7	-98.5	0	0	0	112.3	G382 E383 Y388 E389 A390	G382-F386 PolarHBondContact O-N 2.77Å; E383-F386 PolarHBondContact O-N 3.07Å; F386-Y388 VanDerWaalsContact C-N 3.33Å; F386-Y388 PolarHBondContact O-N 3.03Å; F386-E389 PolarHBondContact O-N 2.77Å; F386-A390 VanDerWaalsContact O-CB 3.27Å; F386-A390 WeakPolarHBondContact O-CB 3.49Å; F386-A390 PolarHBondContact O-N 3.06Å
387	L	90.4	Very high	84.9	Confident	28 Å²	28	89.7 Å²	89.7	15%	0.147	46%	0.462	C	S	.	.	H	α-helix	trans	-63.7	-35.5	173.4	-71.9	179.5	0	0	0	112.9	E383 L384 L385 K391 R450 L454	E383-L387 WeakPolarHBondContact O-CG 3.33Å; E383-L387 PolarHBondContact O-N 3.41Å; L384-L387 PolarHBondContact O-N 2.82Å; L385-L387 VanDerWaalsContact C-N 3.29Å; L385-L387 PolarHBondContact O-N 3.42Å; L387-K391 WeakPolarHBondContact O-CB 3.38Å; L387-K391 VanDerWaalsContact O-CG 3.24Å; L387-K391 WeakPolarHBondContact O-CG 3.5Å; L387-K391 PolarHBondContact O-N 3.04Å; L387-R450 HydrophobicContact CD1-CB 3.98Å; L387-L454 HydrophobicContact CD1-CD1 3.68Å
388	Y	90.3	Very high	82.6	Confident	93 Å²	93	97 Å²	97	37%	0.365	50%	0.499	S	S	.	.	H	α-helix	trans	-71.7	-41.8	174.8	-74.9	-60.5	0	0	0	112.7	L384 L385 F386 A390 K391 L392 E451 R455	L384-Y388 HydrophobicContact CD1-CE2 4.01Å; L384-Y388 HydrophobicContact CD2-CE2 4.34Å; L384-Y388 HydrophobicContact CG-CD2 4.27Å; L384-Y388 HydrophobicContact CG-CE2 3.79Å; L384-Y388 WeakPolarHBondContact O-CD2 3.46Å; L384-Y388 PolarHBondContact O-N 3.35Å; L385-Y388 WeakPolarHBondContact O-CA 3.41Å; L385-Y388 WeakPolarHBondContact O-CB 3.5Å; L385-Y388 PolarHBondContact O-N 3.43Å; F386-Y388 VanDerWaalsContact C-N 3.33Å; F386-Y388 PolarHBondContact O-N 3.03Å; Y388-A390 VanDerWaalsContact C-N 3.35Å; Y388-K391 PolarHBondContact O-N 3.02Å; Y388-L392 WeakPolarHBondContact O-CB 3.45Å; Y388-L392 PolarHBondContact O-N 3.12Å; Y388-E451 PolarHBondContact OH-OE1 3.48Å; Y388-E451 VanDerWaalsContact OH-OE1 3.14Å; Y388-R455 PolarHBondContact OH-NH2 2.82Å
389	E	90.9	Very high	80	Confident	109 Å²	109	97.8 Å²	97.8	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-43.3	174.9	-70.1	178.9	179.1	0	0	111	L385 F386 K391 L392 Q393	L385-E389 PolarHBondContact O-N 2.7Å; F386-E389 PolarHBondContact O-N 2.77Å; E389-K391 PolarHBondContact O-N 2.94Å; E389-L392 WeakPolarHBondContact O-CB 3.42Å; E389-L392 PolarHBondContact O-N 3.39Å; E389-Q393 WeakPolarHBondContact O-CG 3.42Å; E389-Q393 PolarHBondContact O-N 3.5Å
390	A	87.3	Confident	77.6	Confident	26 Å²	26	99.7 Å²	99.7	22%	0.215	52%	0.515	C	S	.	.	H	α-helix	trans	-63.1	-37.7	174.1	0	0	0	0	0	112.7	F386 Y388 Q394	F386-A390 VanDerWaalsContact O-CB 3.27Å; F386-A390 WeakPolarHBondContact O-CB 3.49Å; F386-A390 PolarHBondContact O-N 3.06Å; Y388-A390 VanDerWaalsContact C-N 3.35Å; A390-Q394 VanDerWaalsContact O-CG 3.24Å; A390-Q394 WeakPolarHBondContact O-CG 3.33Å; A390-Q394 PolarHBondContact O-N 3.08Å; A390-Q394 PolarHBondContact O-NE2 3.22Å; A390-Q394 VanDerWaalsContact O-NE2 3.13Å
391	K	86.4	Confident	74.7	Confident	66 Å²	66	107.9 Å²	107.9	29%	0.287	55%	0.553	S	S	.	*	H	α-helix	trans	-65.8	-40.8	172.4	-76.9	173.4	-172.2	-173.4	0	111.6	L387 Y388 E389 Q394 C395 P447 E451	L387-K391 WeakPolarHBondContact O-CB 3.38Å; L387-K391 VanDerWaalsContact O-CG 3.24Å; L387-K391 WeakPolarHBondContact O-CG 3.5Å; L387-K391 PolarHBondContact O-N 3.04Å; Y388-K391 PolarHBondContact O-N 3.02Å; E389-K391 PolarHBondContact O-N 2.94Å; K391-Q394 PolarHBondContact O-N 3.44Å; K391-C395 PolarHBondContact O-N 3.42Å; K391-P447 PolarHBondContact NZ-O 3.3Å; K391-E451 IonicContact NZ-OE2 2.76Å; K391-E451 PolarHBondContact NZ-OE2 3.5Å
392	L	85.8	Confident	71.9	Confident	132 Å²	132	109 Å²	109	69%	0.691	58%	0.575	S	S	*	*	H	α-helix	trans	-65.2	-42.8	178.2	-170.8	72	0	0	0	111.7	Y388 E389 Q394 C395	Y388-L392 WeakPolarHBondContact O-CB 3.45Å; Y388-L392 PolarHBondContact O-N 3.12Å; E389-L392 WeakPolarHBondContact O-CB 3.42Å; E389-L392 PolarHBondContact O-N 3.39Å; L392-Q394 PolarHBondContact O-N 2.86Å; L392-C395 WeakPolarHBondContact O-CB 3.4Å; L392-C395 PolarHBondContact O-N 2.84Å
393	Q	78	Confident	69	Low	161 Å²	161	111.3 Å²	111.3	75%	0.752	59%	0.591	S	S	*	*	H	α-helix	trans	-68.1	-21.1	175.7	-69	177.1	23.4	0	0	113.3	E389	E389-Q393 WeakPolarHBondContact O-CG 3.42Å; E389-Q393 PolarHBondContact O-N 3.5Å
394	Q	70.6	Confident	66.3	Low	149 Å²	149	114.6 Å²	114.6	70%	0.696	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-9.2	173.9	-75.4	169.2	49.9	0	0	113.6	A390 K391 L392 P396	A390-Q394 VanDerWaalsContact O-CG 3.24Å; A390-Q394 WeakPolarHBondContact O-CG 3.33Å; A390-Q394 PolarHBondContact O-N 3.08Å; A390-Q394 PolarHBondContact O-NE2 3.22Å; A390-Q394 VanDerWaalsContact O-NE2 3.13Å; K391-Q394 PolarHBondContact O-N 3.44Å; L392-Q394 PolarHBondContact O-N 2.86Å; Q394-P396 WeakPolarHBondContact O-CD 3.32Å
395	C	50.5	Low	64.2	Low	87 Å²	87	118.5 Å²	118.5	59%	0.588	63%	0.633	S	S	*	*	S	Bend	trans	-78.8	119.5	170.7	-67.2	0	0	0	0	110.3	K391 L392	K391-C395 PolarHBondContact O-N 3.42Å; L392-C395 WeakPolarHBondContact O-CB 3.4Å; L392-C395 PolarHBondContact O-N 2.84Å
396	P	52.6	Low	61.3	Low	109 Å²	109	120 Å²	120	71%	0.708	65%	0.645	S	S	*	*			trans	-64	149.6	173.5	-17.2	30.9	0	0	0	110.6	Q394 L398	Q394-P396 WeakPolarHBondContact O-CD 3.32Å; P396-L398 PolarHBondContact O-N 3.05Å
397	P	48.5	Very low	58.2	Low	123 Å²	123	117.7 Å²	117.7	80%	0.799	65%	0.646	S	S	*	*			trans	-62.6	111.2	173.2	26.4	-33.1	0	0	0	109.3	Q399	P397-Q399 PolarHBondContact O-N 3.12Å; P397-Q399 VanDerWaalsContact O-N 3.13Å
398	L	46.5	Very low	55.4	Low	167 Å²	167	122.7 Å²	122.7	87%	0.874	67%	0.673	S	S	*	*			trans	-61.4	116.3	172.6	-86	163.7	0	0	0	108.7	P396 I400	P396-L398 PolarHBondContact O-N 3.05Å; L398-I400 PolarHBondContact O-N 2.85Å
399	Q	41.5	Very low	52.8	Low	164 Å²	164	126.2 Å²	126.2	77%	0.766	70%	0.695	S	S	*	*			trans	-56.9	112.3	174.9	-72.8	177.9	-14.4	0	0	109.7	P397 H401	P397-Q399 PolarHBondContact O-N 3.12Å; P397-Q399 VanDerWaalsContact O-N 3.13Å; Q399-H401 PolarHBondContact O-N 3.19Å
400	I	45.3	Very low	50.2	Low	164 Å²	164	127 Å²	127	84%	0.841	70%	0.699	S	S	*	*			trans	-69.9	112.3	157.7	-61.4	177.2	0	0	0	105.9	L398 S402	L398-I400 PolarHBondContact O-N 2.85Å; I400-S402 PolarHBondContact O-N 2.84Å; I400-S402 VanDerWaalsContact O-N 3.13Å
401	H	35.2	Very low	47.7	Very low	174 Å²	174	134 Å²	134	81%	0.806	73%	0.726	S	S	*	*			trans	-59.9	115.7	175.2	-67.4	-76.1	0	0	0	110.3	Q399	Q399-H401 PolarHBondContact O-N 3.19Å
402	S	36	Very low	45	Very low	121 Å²	121	136.2 Å²	136.2	85%	0.846	75%	0.75	S	S	*	*			trans	-133.4	137.5	153.8	-166.9	0	0	0	0	107.4	I400	I400-S402 PolarHBondContact O-N 2.84Å; I400-S402 VanDerWaalsContact O-N 3.13Å
403	A	36.2	Very low	42.8	Very low	88 Å²	88	134 Å²	134	73%	0.727	75%	0.751	S	S	*	*			trans	-94.9	153.5	-160.4	0	0	0	0	0	114.2
404	E	37.3	Very low	40.6	Very low	183 Å²	183	135.3 Å²	135.3	86%	0.855	76%	0.757	S	S	*	*			trans	82.8	152.7	150.1	-90.7	-171.3	-152.8	0	0	119.8
405	P	50.3	Low	38.9	Very low	99 Å²	99	135.7 Å²	135.7	64%	0.643	76%	0.764	S	S	*	*				-142.6	-172.2	-107.5	44.7	-26	0	0	0	116.7
406	V	34.1	Very low	38.6	Very low	135 Å²	135	136.9 Å²	136.9	82%	0.818	77%	0.771	S	S	*	*			trans	71.6	135.8	159.6	172.3	0	0	0	0	115.4
407	C	29.4	Very low	38	Very low	94 Å²	94	140.4 Å²	140.4	64%	0.635	78%	0.778	S	S	*	*			cis	-151.9	162.7	2.8	-130.9	0	0	0	0	112.2
408	D	30.4	Very low	37.1	Very low	133 Å²	133	143.8 Å²	143.8	71%	0.711	79%	0.785	S	S	*	*			trans	46	114.9	148.7	-52.5	-29.5	0	0	0	123.2
409	M	36.8	Very low	36.3	Very low	166 Å²	166	139.1 Å²	139.1	82%	0.818	78%	0.778	S	S	*	*				168.2	105.1	106.2	-84.8	-63.2	-78.7	0	0	109.1
410	Q	36.1	Very low	36.2	Very low	127 Å²	127	137.6 Å²	137.6	59%	0.593	78%	0.78	S	S	*	*				92.5	95.8	76.4	-169.4	79.7	-2.3	0	0	114
411	Q	34.1	Very low	35.6	Very low	171 Å²	171	139.4 Å²	139.4	80%	0.799	79%	0.785	S	S	*	*			trans	67.2	152.5	150.6	-59.9	170.8	-29.3	0	0	118.1
412	S	29.7	Very low	36	Very low	113 Å²	113	139.3 Å²	139.3	79%	0.79	78%	0.784	S	S	*	*			cis	-143.3	154.9	5	-176.4	0	0	0	0	111.2
413	A	39.1	Very low	35.9	Very low	85 Å²	85	142 Å²	142	70%	0.702	79%	0.789	S	S	*	*			trans	-74.6	153	166.7	0	0	0	0	0	112.4
414	Q	31.4	Very low	36.1	Very low	189 Å²	189	142.5 Å²	142.5	88%	0.883	79%	0.787	S	S	*	*			trans	-174.2	116.7	131.8	-103.4	166.9	20.5	0	0	112.4
415	N	35.7	Very low	35.8	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	79%	0.787	S	S	*	*			trans	-74.9	153.3	146.5	-95.8	1.2	0	0	0	107.5
416	P	45.1	Very low	35.3	Very low	113 Å²	113	140.8 Å²	140.8	73%	0.734	79%	0.791	S	S	*	*				-149.5	144.7	66.7	37.7	-17.1	0	0	0	118.8
417	E	39.7	Very low	34.9	Very low	183 Å²	183	143.4 Å²	143.4	86%	0.855	79%	0.792	S	S	*	*				29.1	108.2	119.3	-164.5	172.5	-141.4	0	0	119.9
418	M	30.3	Very low	35.1	Very low	193 Å²	193	145.2 Å²	145.2	95%	0.951	80%	0.804	S	S	*	*			trans	-176.2	141.1	141	-86.5	-136.4	-62.8	0	0	108
419	G	29.5	Very low	35.2	Very low	70 Å²	70	144.8 Å²	144.8	72%	0.722	81%	0.807	S	S	*	*			cis	-165.6	176.9	-3.3	0	0	0	0	0	111.8
420	T	37.7	Very low	35.2	Very low	131 Å²	131	142 Å²	142	80%	0.804	81%	0.811	S	S	*	*			trans	-40.5	140.4	173.5	49.3	0	0	0	0	115.9
421	E	33.1	Very low	34.9	Very low	202 Å²	202	139.1 Å²	139.1	94%	0.944	81%	0.814	S	S	*	*			trans	-152.3	125.5	135.7	-117.3	165.8	-137.9	0	0	110.6
422	E	43.3	Very low	34.6	Very low	172 Å²	172	137.6 Å²	137.6	80%	0.804	82%	0.816	S	S	*	*			trans	-92.7	144.7	-176	-57.3	175.7	153.5	0	0	110.6
423	L	34	Very low	34.9	Very low	178 Å²	178	138.6 Å²	138.6	93%	0.932	82%	0.818	S	S	*	*			trans	-133.7	86.8	153.7	-77.7	-179.3	0	0	0	110.3
424	S	40.8	Very low	35.1	Very low	98 Å²	98	143 Å²	143	69%	0.685	82%	0.824	S	S	*	*			trans	-85.3	138.1	162.6	-175.3	0	0	0	0	109.7
425	T	32.1	Very low	35.1	Very low	142 Å²	142	143.3 Å²	143.3	87%	0.871	83%	0.825	S	S	*	*			trans	-128.3	90.3	163.6	57.2	0	0	0	0	109.9
426	S	38	Very low	35.3	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	82%	0.822	S	S	*	*			trans	-110.5	147.7	162.4	61.4	0	0	0	0	109.6
427	F	27.3	Very low	34.7	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.833	83%	0.831	S	S	*	*			trans	-132.3	84.9	177.9	-151.2	-78.9	0	0	0	109.9	T429	F427-T429 HydrophobicContact CE1-CG2 4.14Å
428	C	33	Very low	34.3	Very low	132 Å²	132	141.3 Å²	141.3	89%	0.892	82%	0.82	S	S	*	*			trans	-127.6	118.7	166.4	-82.8	0	0	0	0	108.9
429	T	32.3	Very low	34.6	Very low	125 Å²	125	141 Å²	141	77%	0.767	82%	0.816	S	S	*	*			trans	-78.6	143.9	-176.8	40.3	0	0	0	0	112.7	F427	F427-T429 HydrophobicContact CE1-CG2 4.14Å
430	A	36.3	Very low	34.7	Very low	108 Å²	108	143 Å²	143	89%	0.893	81%	0.814	S	S	*	*			trans	-76.1	162.6	-171	0	0	0	0	0	115.5
431	G	30.5	Very low	34.8	Very low	65 Å²	65	148.6 Å²	148.6	67%	0.67	82%	0.821	S	S	*	*			trans	166.4	107.8	151	0	0	0	0	0	116.6
432	V	28.1	Very low	35.1	Very low	139 Å²	139	146.6 Å²	146.6	84%	0.842	81%	0.811	S	S	*	*			trans	71.2	125.6	145.1	-179	0	0	0	0	116
433	T	35.3	Very low	35.2	Very low	134 Å²	134	149.3 Å²	149.3	82%	0.822	81%	0.814	S	S	*	*			cis	-151.9	161.8	0.9	8.4	0	0	0	0	110.4
434	E	42.8	Very low	35.8	Very low	179 Å²	179	146.1 Å²	146.1	84%	0.836	80%	0.802	S	S	*	*			trans	-63.4	142.4	171.6	-52.9	175.2	143.1	0	0	112.5
435	E	32.2	Very low	36.6	Very low	194 Å²	194	144 Å²	144	91%	0.907	79%	0.786	S	S	*	*			trans	-134.7	129.6	140.6	-81.2	-154.2	165	0	0	111.2
436	T	40.6	Very low	38.5	Very low	126 Å²	126	141.5 Å²	141.5	77%	0.773	77%	0.767	S	S	*	*			trans	-69.6	128.1	-177	-47.4	0	0	0	0	111.9
437	Q	32.9	Very low	40.1	Very low	195 Å²	195	139.4 Å²	139.4	91%	0.911	75%	0.751	S	S	*	*			trans	-146.5	135.1	149.4	-121.9	162.8	79.4	0	0	113.4
438	S	31.1	Very low	42.6	Very low	91 Å²	91	132.9 Å²	132.9	64%	0.636	73%	0.732	S	S	*	*			trans	-98.7	143.6	-158.3	51.9	0	0	0	0	113.9
439	H	35.1	Very low	45.1	Very low	186 Å²	186	131 Å²	131	86%	0.861	71%	0.713	S	S	*	*			trans	61.8	86.3	145.6	-71	38.5	0	0	0	117.4
440	T	32.9	Very low	47.8	Very low	111 Å²	111	129.9 Å²	129.9	68%	0.681	70%	0.695	S	S	*	*			trans	-115.2	114.8	139.8	-56	0	0	0	0	108.9	H442	T440-H442 WeakPolarHBondContact CG2-NE2 3.32Å; T440-H442 PolarHBondContact O-CD2 2.67Å; T440-H442 PolarHBondContact O-N 3.01Å
441	R	38.4	Very low	50.4	Low	250 Å²	250	126.2 Å²	126.2	94%	0.943	66%	0.659	S	S	*	*			trans	-72.1	76.6	177.9	-170.6	-173.8	-163.6	177.3	6.3	109.4	R443	R441-R443 PolarHBondContact O-N 3.42Å
442	H	39.4	Very low	53.4	Low	159 Å²	159	125.9 Å²	125.9	74%	0.736	65%	0.65	S	S	*	*			trans	-65.1	100.3	176.7	-81.2	-80.4	0	0	0	110	T440 T444	T440-H442 WeakPolarHBondContact CG2-NE2 3.32Å; T440-H442 PolarHBondContact O-CD2 2.67Å; T440-H442 PolarHBondContact O-N 3.01Å; H442-T444 PolarHBondContact O-N 3.25Å
443	R	45.4	Very low	56.5	Low	229 Å²	229	123.5 Å²	123.5	86%	0.864	63%	0.632	S	S	*	*			trans	-43.9	121.1	158.8	-168.2	-177.1	-156.3	166.2	3.6	106.9	R441 P445	R441-R443 PolarHBondContact O-N 3.42Å; R443-P445 VanDerWaalsContact O-CD 3.25Å; R443-P445 WeakPolarHBondContact O-CD 3.47Å
444	T	48	Very low	59.4	Low	111 Å²	111	117.6 Å²	117.6	68%	0.681	60%	0.595	S	S	*	*			trans	-50.6	115.1	175.7	40.4	0	0	0	0	108.2	H442	H442-T444 PolarHBondContact O-N 3.25Å
445	P	56.8	Low	61.8	Low	54 Å²	54	115.1 Å²	115.1	35%	0.351	58%	0.578	S	S	.	*			trans	-61.3	144.5	-178	18.3	-26.5	0	0	0	109.2	R443 D449 R450	R443-P445 VanDerWaalsContact O-CD 3.25Å; R443-P445 WeakPolarHBondContact O-CD 3.47Å; P445-D449 HydrophobicContact CB-CB 4.12Å; P445-R450 HydrophobicContact CB-CG 4Å; P445-R450 HydrophobicContact CG-CG 3.75Å; P445-R450 PolarHBondContact O-NE 3.06Å; P445-R450 PolarHBondContact O-NH2 3.01Å
446	D	71.8	Confident	64.9	Low	89 Å²	89	111.7 Å²	111.7	48%	0.476	56%	0.562	S	S	.	*			trans	-56.9	144.3	179.3	-172.9	73	0	0	0	109.6	A448 D449 R450	D446-A448 PolarHBondContact O-N 3.39Å; D446-A448 VanDerWaalsContact OD2-CB 3.23Å; D446-A448 WeakPolarHBondContact OD2-CB 3.46Å; D446-A448 PolarHBondContact OD2-N 3.04Å; D446-D449 HydrophobicContact CB-CB 4.31Å; D446-D449 WeakPolarHBondContact CB-OD2 3.29Å; D446-D449 WeakPolarHBondContact O-CA 3.46Å; D446-D449 WeakPolarHBondContact O-CB 3.49Å; D446-D449 PolarHBondContact O-N 2.92Å; D446-R450 PolarHBondContact O-N 3.48Å
447	P	72.1	Confident	67.5	Low	61 Å²	61	109.5 Å²	109.5	40%	0.396	54%	0.543	S	S	.	.	H	α-helix	trans	-57.7	-17.8	177.3	21.5	-34.4	0	0	0	114.1	K391 E451	K391-P447 PolarHBondContact NZ-O 3.3Å; P447-E451 PolarHBondContact O-N 2.93Å
448	A	79.9	Confident	70.5	Confident	52 Å²	52	100.5 Å²	100.5	43%	0.43	50%	0.501	S	S	.	.	H	α-helix	trans	-77	-43.7	167.3	0	0	0	0	0	112.6	D446 R450 E451 A452	D446-A448 PolarHBondContact O-N 3.39Å; D446-A448 VanDerWaalsContact OD2-CB 3.23Å; D446-A448 WeakPolarHBondContact OD2-CB 3.46Å; D446-A448 PolarHBondContact OD2-N 3.04Å; A448-R450 VanDerWaalsContact C-N 3.33Å; A448-R450 PolarHBondContact O-N 3.38Å; A448-E451 PolarHBondContact O-N 3.5Å; A448-A452 PolarHBondContact O-N 3.31Å
449	D	86.3	Confident	73.6	Confident	94 Å²	94	100.5 Å²	100.5	50%	0.503	49%	0.491	S	S	.	.	H	α-helix	trans	-60.3	-42.6	176	-66	-28.6	0	0	0	111.3	P445 D446 E451 A452 I453	P445-D449 HydrophobicContact CB-CB 4.12Å; D446-D449 HydrophobicContact CB-CB 4.31Å; D446-D449 WeakPolarHBondContact CB-OD2 3.29Å; D446-D449 WeakPolarHBondContact O-CA 3.46Å; D446-D449 WeakPolarHBondContact O-CB 3.49Å; D446-D449 PolarHBondContact O-N 2.92Å; D449-E451 PolarHBondContact O-N 3.02Å; D449-A452 PolarHBondContact O-N 2.91Å; D449-I453 WeakPolarHBondContact O-CD1 3.36Å; D449-I453 VanDerWaalsContact O-CG1 3.26Å; D449-I453 WeakPolarHBondContact O-CG1 3.46Å; D449-I453 PolarHBondContact O-N 3.5Å
450	R	88.1	Confident	76.5	Confident	101 Å²	101	97.6 Å²	97.6	38%	0.381	47%	0.473	S	S	.	.	H	α-helix	trans	-60.3	-44.8	176	-66.8	-176.8	-166	-150.5	2	112.2	L387 P445 D446 A448 A452 I453 L454	L387-R450 HydrophobicContact CD1-CB 3.98Å; P445-R450 HydrophobicContact CB-CG 4Å; P445-R450 HydrophobicContact CG-CG 3.75Å; P445-R450 PolarHBondContact O-NE 3.06Å; P445-R450 PolarHBondContact O-NH2 3.01Å; D446-R450 PolarHBondContact O-N 3.48Å; A448-R450 VanDerWaalsContact C-N 3.33Å; A448-R450 PolarHBondContact O-N 3.38Å; R450-A452 VanDerWaalsContact C-N 3.32Å; R450-A452 PolarHBondContact O-N 3.16Å; R450-I453 PolarHBondContact O-N 3.01Å; R450-L454 PolarHBondContact O-N 3.33Å
451	E	91.4	Very high	79.5	Confident	30 Å²	30	92.8 Å²	92.8	14%	0.14	44%	0.443	C	S	.	.	H	α-helix	trans	-62	-41.6	178.3	-162	-162.4	124.8	0	0	111.4	L384 Y388 K391 P447 A448 D449 L454 R455	L384-E451 HydrophobicContact CD1-CB 4.47Å; L384-E451 HydrophobicContact CD1-CG 3.45Å; L384-E451 VanDerWaalsContact CD1-CG 3.45Å; Y388-E451 PolarHBondContact OH-OE1 3.48Å; Y388-E451 VanDerWaalsContact OH-OE1 3.14Å; K391-E451 IonicContact NZ-OE2 2.76Å; K391-E451 PolarHBondContact NZ-OE2 3.5Å; P447-E451 PolarHBondContact O-N 2.93Å; A448-E451 PolarHBondContact O-N 3.5Å; D449-E451 PolarHBondContact O-N 3.02Å; E451-L454 PolarHBondContact O-N 3.13Å; E451-R455 WeakPolarHBondContact O-CB 3.38Å; E451-R455 VanDerWaalsContact O-CG 3.27Å; E451-R455 WeakPolarHBondContact O-CG 3.45Å; E451-R455 PolarHBondContact O-N 3.29Å; E451-R455 IonicContact OE1-CZ 2.84Å; E451-R455 IonicContact OE1-NE 2.91Å; E451-R455 PolarHBondContact OE1-NE 2.71Å; E451-R455 IonicContact OE1-NH2 2.77Å; E451-R455 PolarHBondContact OE1-NH2 3.49Å
452	A	92.4	Very high	82.2	Confident	58 Å²	58	84.7 Å²	84.7	48%	0.479	41%	0.414	S	S	.	.	H	α-helix	trans	-64.5	-41.7	176.4	0	0	0	0	0	112.3	A448 D449 R450 Q456	A448-A452 PolarHBondContact O-N 3.31Å; D449-A452 PolarHBondContact O-N 2.91Å; R450-A452 VanDerWaalsContact C-N 3.32Å; R450-A452 PolarHBondContact O-N 3.16Å; A452-Q456 WeakPolarHBondContact O-CB 3.47Å; A452-Q456 PolarHBondContact O-N 2.79Å
453	I	94.5	Very high	84.8	Confident	90 Å²	90	83.8 Å²	83.8	46%	0.462	40%	0.404	S	S	.	.	H	α-helix	trans	-62.2	-48.1	176.1	-68.7	162.4	0	0	0	110.8	D449 R450 R455 Q456 Q457	D449-I453 WeakPolarHBondContact O-CD1 3.36Å; D449-I453 VanDerWaalsContact O-CG1 3.26Å; D449-I453 WeakPolarHBondContact O-CG1 3.46Å; D449-I453 PolarHBondContact O-N 3.5Å; R450-I453 PolarHBondContact O-N 3.01Å; I453-R455 PolarHBondContact O-N 2.81Å; I453-Q456 WeakPolarHBondContact O-CB 3.27Å; I453-Q456 PolarHBondContact O-N 2.83Å; I453-Q456 VanDerWaalsContact O-N 3.13Å; I453-Q457 PolarHBondContact O-N 3.3Å
454	L	95	Very high	87.1	Confident	10 Å²	10	76.1 Å²	76.1	5%	0.052	38%	0.378	C	S	.	.	H	α-helix	trans	-61.6	-44.6	178.5	-75	169.9	0	0	0	112.1	A380 E383 L384 L387 R450 E451 Q456 Q457 I458	A380-L454 HydrophobicContact CB-CD2 4.29Å; E383-L454 HydrophobicContact CB-CD1 3.87Å; E383-L454 HydrophobicContact CB-CD2 4.13Å; L384-L454 HydrophobicContact CB-CD1 4.42Å; L384-L454 HydrophobicContact CD1-CB 4.47Å; L387-L454 HydrophobicContact CD1-CD1 3.68Å; R450-L454 PolarHBondContact O-N 3.33Å; E451-L454 PolarHBondContact O-N 3.13Å; L454-Q456 VanDerWaalsContact C-N 3.28Å; L454-Q456 PolarHBondContact O-N 3.37Å; L454-Q457 PolarHBondContact O-N 2.82Å; L454-I458 VanDerWaalsContact O-CG1 3.31Å; L454-I458 WeakPolarHBondContact O-CG1 3.46Å; L454-I458 PolarHBondContact O-N 3.16Å
455	R	94.6	Very high	89.2	Confident	126 Å²	126	77.1 Å²	77.1	48%	0.475	37%	0.37	S	S	.	.	H	α-helix	trans	-58.2	-39.9	173.6	-71.5	168.7	178.8	-106.2	14.4	111.9	Y388 E451 I453 E459	Y388-R455 PolarHBondContact OH-NH2 2.82Å; E451-R455 WeakPolarHBondContact O-CB 3.38Å; E451-R455 VanDerWaalsContact O-CG 3.27Å; E451-R455 WeakPolarHBondContact O-CG 3.45Å; E451-R455 PolarHBondContact O-N 3.29Å; E451-R455 IonicContact OE1-CZ 2.84Å; E451-R455 IonicContact OE1-NE 2.91Å; E451-R455 PolarHBondContact OE1-NE 2.71Å; E451-R455 IonicContact OE1-NH2 2.77Å; E451-R455 PolarHBondContact OE1-NH2 3.49Å; I453-R455 PolarHBondContact O-N 2.81Å; R455-E459 PolarHBondContact O-N 3.01Å; R455-E459 VanDerWaalsContact O-N 3.14Å
456	Q	96.4	Very high	90.6	Very high	123 Å²	123	78.1 Å²	78.1	58%	0.575	38%	0.383	S	S	*	.	H	α-helix	trans	-69.7	-36.1	177	-168.2	-175.5	16.4	0	0	112.7	A452 I453 L454 R460	A452-Q456 WeakPolarHBondContact O-CB 3.47Å; A452-Q456 PolarHBondContact O-N 2.79Å; I453-Q456 WeakPolarHBondContact O-CB 3.27Å; I453-Q456 PolarHBondContact O-N 2.83Å; I453-Q456 VanDerWaalsContact O-N 3.13Å; L454-Q456 VanDerWaalsContact C-N 3.28Å; L454-Q456 PolarHBondContact O-N 3.37Å; Q456-R460 WeakPolarHBondContact O-CB 3.44Å; Q456-R460 PolarHBondContact O-N 3.47Å
457	Q	95.6	Very high	91.4	Very high	80 Å²	80	77.7 Å²	77.7	37%	0.374	39%	0.391	S	S	.	.	H	α-helix	trans	-66.5	-47.8	175	176.9	172.8	-20.2	0	0	111.3	I453 L454 E459 R460 L461	I453-Q457 PolarHBondContact O-N 3.3Å; L454-Q457 PolarHBondContact O-N 2.82Å; Q457-E459 VanDerWaalsContact C-N 3.32Å; Q457-E459 PolarHBondContact O-N 2.9Å; Q457-R460 WeakPolarHBondContact O-CA 3.41Å; Q457-R460 VanDerWaalsContact O-CB 3.31Å; Q457-R460 WeakPolarHBondContact O-CB 3.18Å; Q457-R460 PolarHBondContact O-N 2.86Å; Q457-L461 HydrophobicContact CG-CD1 3.87Å; Q457-L461 HydrophobicContact CG-CG 4.39Å; Q457-L461 WeakPolarHBondContact O-CG 3.44Å; Q457-L461 PolarHBondContact O-N 2.91Å
458	I	95.9	Very high	92.2	Very high	5 Å²	5	76.2 Å²	76.2	3%	0.026	38%	0.38	C	S	.	.	H	α-helix	trans	-56.1	-46.4	175	-70.2	162.4	0	0	0	110.9	A380 Y381 L384 L454 R460 L461 K462	A380-I458 HydrophobicContact CB-CD1 4.26Å; A380-I458 HydrophobicContact CB-CG1 3.72Å; Y381-I458 HydrophobicContact CD1-CD1 3.83Å; Y381-I458 HydrophobicContact CD2-CD1 4.47Å; Y381-I458 HydrophobicContact CE1-CD1 3.93Å; Y381-I458 HydrophobicContact CE1-CG2 4.23Å; Y381-I458 HydrophobicContact CE2-CG2 3.75Å; Y381-I458 HydrophobicContact CG-CD1 4.12Å; L384-I458 HydrophobicContact CD2-CD1 4.14Å; L454-I458 VanDerWaalsContact O-CG1 3.31Å; L454-I458 WeakPolarHBondContact O-CG1 3.46Å; L454-I458 PolarHBondContact O-N 3.16Å; I458-R460 VanDerWaalsContact C-N 3.27Å; I458-R460 PolarHBondContact O-N 3.12Å; I458-L461 PolarHBondContact O-N 2.96Å; I458-K462 HydrophobicContact CG2-CD 4.22Å; I458-K462 WeakPolarHBondContact O-CB 3.35Å; I458-K462 VanDerWaalsContact O-CG 3.27Å; I458-K462 WeakPolarHBondContact O-CG 3.47Å; I458-K462 PolarHBondContact O-N 2.92Å
459	E	95.9	Very high	91.6	Very high	91 Å²	91	78.8 Å²	78.8	43%	0.425	39%	0.393	S	S	.	.	H	α-helix	trans	-67.4	-25.3	176.1	-78.5	-57.5	124.6	0	0	113.6	R455 Q457 K462 R463	R455-E459 PolarHBondContact O-N 3.01Å; R455-E459 VanDerWaalsContact O-N 3.14Å; Q457-E459 VanDerWaalsContact C-N 3.32Å; Q457-E459 PolarHBondContact O-N 2.9Å; E459-K462 WeakPolarHBondContact OE1-CD 3.47Å; E459-K462 IonicContact OE1-NZ 3.19Å; E459-K462 PolarHBondContact OE1-NZ 3.38Å; E459-R463 VanDerWaalsContact C-NH2 3.28Å; E459-R463 WeakPolarHBondContact O-CG 3.47Å; E459-R463 PolarHBondContact O-N 3.16Å; E459-R463 PolarHBondContact O-NE 3.3Å; E459-R463 PolarHBondContact O-NH2 3.41Å; E459-R463 VanDerWaalsContact O-NH2 3.15Å
460	R	96.8	Very high	90.4	Very high	126 Å²	126	77 Å²	77	48%	0.475	39%	0.387	S	S	.	.	H	α-helix	trans	-71.7	-54.4	172.9	-171.2	-165	-56.3	-166.8	2.5	110.9	Q456 Q457 I458 K462 R463 E464	Q456-R460 WeakPolarHBondContact O-CB 3.44Å; Q456-R460 PolarHBondContact O-N 3.47Å; Q457-R460 WeakPolarHBondContact O-CA 3.41Å; Q457-R460 VanDerWaalsContact O-CB 3.31Å; Q457-R460 WeakPolarHBondContact O-CB 3.18Å; Q457-R460 PolarHBondContact O-N 2.86Å; I458-R460 VanDerWaalsContact C-N 3.27Å; I458-R460 PolarHBondContact O-N 3.12Å; R460-K462 VanDerWaalsContact C-N 3.3Å; R460-K462 PolarHBondContact O-N 3.33Å; R460-R463 CarbonylContact O-C 3.6Å; R460-R463 WeakPolarHBondContact O-CA 3.5Å; R460-R463 WeakPolarHBondContact O-CB 3.09Å; R460-R463 PolarHBondContact O-N 3.02Å; R460-E464 VanDerWaalsContact CD-OE1 3.3Å; R460-E464 WeakPolarHBondContact CD-OE1 3.33Å; R460-E464 HydrophobicContact CG-CG 4.49Å; R460-E464 WeakPolarHBondContact CG-OE1 3.11Å; R460-E464 PolarHBondContact O-N 3.46Å
461	L	95.8	Very high	89	Confident	10 Å²	10	75.1 Å²	75.1	5%	0.052	39%	0.393	C	S	.	.	H	α-helix	trans	-60.3	-38.7	-178.7	-66.8	168.1	0	0	0	111.6	Y373 E376 C377 Q457 I458 R463 E464 R465	Y373-L461 HydrophobicContact CD1-CD2 3.84Å; Y373-L461 HydrophobicContact CE1-CD2 4.43Å; E376-L461 HydrophobicContact CB-CD1 3.92Å; E376-L461 HydrophobicContact CB-CD2 4.19Å; C377-L461 WeakPolarHBondContact SG-CB 3.35Å; Q457-L461 HydrophobicContact CG-CD1 3.87Å; Q457-L461 HydrophobicContact CG-CG 4.39Å; Q457-L461 WeakPolarHBondContact O-CG 3.44Å; Q457-L461 PolarHBondContact O-N 2.91Å; I458-L461 PolarHBondContact O-N 2.96Å; L461-R463 PolarHBondContact O-N 3.39Å; L461-E464 PolarHBondContact O-N 3.3Å; L461-R465 VanDerWaalsContact O-CB 3.27Å; L461-R465 WeakPolarHBondContact O-CB 3.34Å; L461-R465 PolarHBondContact O-N 3.34Å
462	K	93.9	Very high	87.3	Confident	79 Å²	79	82.9 Å²	82.9	34%	0.343	43%	0.426	S	S	.	.	H	α-helix	trans	-59.9	-41.7	170.6	-75.9	175.6	-172.9	170	0	113.3	Y381 I458 E459 R460 A466	Y381-K462 VanDerWaalsContact OH-CE 3.31Å; Y381-K462 WeakPolarHBondContact OH-CE 3.34Å; Y381-K462 PolarHBondContact OH-NZ 3.32Å; I458-K462 HydrophobicContact CG2-CD 4.22Å; I458-K462 WeakPolarHBondContact O-CB 3.35Å; I458-K462 VanDerWaalsContact O-CG 3.27Å; I458-K462 WeakPolarHBondContact O-CG 3.47Å; I458-K462 PolarHBondContact O-N 2.92Å; E459-K462 WeakPolarHBondContact OE1-CD 3.47Å; E459-K462 IonicContact OE1-NZ 3.19Å; E459-K462 PolarHBondContact OE1-NZ 3.38Å; R460-K462 VanDerWaalsContact C-N 3.3Å; R460-K462 PolarHBondContact O-N 3.33Å; K462-A466 VanDerWaalsContact O-CB 3.24Å; K462-A466 WeakPolarHBondContact O-CB 3.46Å; K462-A466 PolarHBondContact O-N 3Å
463	R	94.4	Very high	85.3	Confident	140 Å²	140	86.1 Å²	86.1	53%	0.528	44%	0.443	S	S	.	.	H	α-helix	trans	-69.7	-39.7	177.1	-83.3	179.8	-80.5	102.3	-1.5	111.9	E459 R460 L461 A466 A467	E459-R463 VanDerWaalsContact C-NH2 3.28Å; E459-R463 WeakPolarHBondContact O-CG 3.47Å; E459-R463 PolarHBondContact O-N 3.16Å; E459-R463 PolarHBondContact O-NE 3.3Å; E459-R463 PolarHBondContact O-NH2 3.41Å; E459-R463 VanDerWaalsContact O-NH2 3.15Å; R460-R463 CarbonylContact O-C 3.6Å; R460-R463 WeakPolarHBondContact O-CA 3.5Å; R460-R463 WeakPolarHBondContact O-CB 3.09Å; R460-R463 PolarHBondContact O-N 3.02Å; L461-R463 PolarHBondContact O-N 3.39Å; R463-A466 PolarHBondContact O-N 2.89Å; R463-A467 WeakPolarHBondContact O-CB 3.28Å; R463-A467 PolarHBondContact O-N 2.94Å
464	E	92.8	Very high	82.6	Confident	69 Å²	69	84.1 Å²	84.1	32%	0.322	44%	0.444	S	S	.	.	H	α-helix	trans	-65.9	-44.2	176.5	-74	161.5	177.5	0	0	110.8	Y373 R460 L461 A466 A467 I468	Y373-E464 HydrophobicContact CD2-CB 4.12Å; Y373-E464 HydrophobicContact CE1-CB 4.42Å; Y373-E464 HydrophobicContact CE2-CB 3.83Å; R460-E464 VanDerWaalsContact CD-OE1 3.3Å; R460-E464 WeakPolarHBondContact CD-OE1 3.33Å; R460-E464 HydrophobicContact CG-CG 4.49Å; R460-E464 WeakPolarHBondContact CG-OE1 3.11Å; R460-E464 PolarHBondContact O-N 3.46Å; L461-E464 PolarHBondContact O-N 3.3Å; E464-A466 PolarHBondContact O-N 3.18Å; E464-A467 WeakPolarHBondContact O-CB 3.5Å; E464-A467 PolarHBondContact O-N 2.85Å; E464-I468 PolarHBondContact O-N 2.85Å
465	R	92.1	Very high	80.4	Confident	131 Å²	131	90.2 Å²	90.2	49%	0.494	48%	0.484	S	S	.	.	H	α-helix	trans	-60.2	-41.6	169.8	-174.6	179	173.4	-143.7	-1.4	112.8	A370 Y373 L461 A467 I468	A370-R465 HydrophobicContact CB-CG 4.31Å; Y373-R465 HydrophobicContact CD2-CB 4.43Å; L461-R465 VanDerWaalsContact O-CB 3.27Å; L461-R465 WeakPolarHBondContact O-CB 3.34Å; L461-R465 PolarHBondContact O-N 3.34Å; R465-A467 VanDerWaalsContact C-N 3.28Å; R465-A467 PolarHBondContact O-N 3.45Å; R465-I468 PolarHBondContact O-N 3.06Å
466	A	87.4	Confident	78.1	Confident	76 Å²	76	88.3 Å²	88.3	63%	0.628	50%	0.503	S	S	*	.	H	α-helix	trans	-70.7	-22.2	177.6	0	0	0	0	0	113.6	K462 R463 E464 I468	K462-A466 VanDerWaalsContact O-CB 3.24Å; K462-A466 WeakPolarHBondContact O-CB 3.46Å; K462-A466 PolarHBondContact O-N 3Å; R463-A466 PolarHBondContact O-N 2.89Å; E464-A466 PolarHBondContact O-N 3.18Å; A466-I468 VanDerWaalsContact C-N 3.32Å
467	A	88.6	Confident	75.2	Confident	79 Å²	79	85.8 Å²	85.8	65%	0.653	50%	0.503	S	S	*	.	H	α-helix	trans	-75.4	-21.9	172	0	0	0	0	0	112.5	R463 E464 R465 C469	R463-A467 WeakPolarHBondContact O-CB 3.28Å; R463-A467 PolarHBondContact O-N 2.94Å; E464-A467 WeakPolarHBondContact O-CB 3.5Å; E464-A467 PolarHBondContact O-N 2.85Å; R465-A467 VanDerWaalsContact C-N 3.28Å; R465-A467 PolarHBondContact O-N 3.45Å; A467-C469 VanDerWaalsContact C-N 3.32Å; A467-C469 PolarHBondContact O-N 3.41Å
468	I	88.2	Confident	72.4	Confident	31 Å²	31	89.5 Å²	89.5	16%	0.159	52%	0.521	C	S	.	.			trans	-76	86.3	170.3	-56.2	174	0	0	0	109.2	A366 M369 A370 Y373 E464 R465 A466 P470	A366-I468 HydrophobicContact CB-CG2 3.74Å; A366-I468 WeakPolarHBondContact O-CG2 3.48Å; M369-I468 HydrophobicContact CB-CD1 3.63Å; A370-I468 HydrophobicContact CB-CB 4.36Å; A370-I468 HydrophobicContact CB-CD1 3.94Å; A370-I468 HydrophobicContact CB-CG2 4.2Å; Y373-I468 HydrophobicContact CD2-CD1 3.68Å; Y373-I468 HydrophobicContact CE2-CD1 3.7Å; Y373-I468 HydrophobicContact CE2-CG1 4.49Å; E464-I468 PolarHBondContact O-N 2.85Å; R465-I468 PolarHBondContact O-N 3.06Å; A466-I468 VanDerWaalsContact C-N 3.32Å; I468-P470 WeakPolarHBondContact O-CD 3.24Å
469	C	67	Low	69.6	Low	105 Å²	105	94.4 Å²	94.4	71%	0.709	55%	0.551	S	S	*	*			trans	-83.4	106.8	165.2	-72.1	0	0	0	0	109.4	A467	A467-C469 VanDerWaalsContact C-N 3.32Å; A467-C469 PolarHBondContact O-N 3.41Å
470	P	62.4	Low	66.7	Low	56 Å²	56	100.7 Å²	100.7	36%	0.364	57%	0.571	S	S	.	*			trans	-58.3	145.7	161	27.4	-34.3	0	0	0	108.6	I468 K472	I468-P470 WeakPolarHBondContact O-CD 3.24Å; P470-K472 PolarHBondContact O-N 2.81Å
471	A	58.5	Low	63.8	Low	62 Å²	62	102.2 Å²	102.2	51%	0.512	59%	0.588	S	S	.	*			trans	-68.5	92.7	-174.4	0	0	0	0	0	110.2	D363 P473	D363-A471 PolarHBondContact OD1-N 3.4Å; A471-P473 WeakPolarHBondContact O-CD 3.49Å
472	K	55.8	Low	61	Low	193 Å²	193	107 Å²	107	84%	0.839	62%	0.621	S	S	*	*			trans	-50.3	125.9	177.6	-84	-174.9	176.1	176.9	0	109.4	P470 G474	P470-K472 PolarHBondContact O-N 2.81Å; K472-G474 PolarHBondContact O-N 2.89Å
473	P	50.7	Low	58.2	Low	127 Å²	127	108.7 Å²	108.7	83%	0.825	64%	0.644	S	S	*	*			trans	-60.5	101.3	168.9	-21.5	33.1	0	0	0	108.6	A471 P475	A471-P473 WeakPolarHBondContact O-CD 3.49Å; P473-P475 WeakPolarHBondContact O-CD 3.41Å
474	G	37	Very low	55.1	Low	47 Å²	47	111.1 Å²	111.1	49%	0.485	66%	0.661	S	S	.	*			trans	-64.2	123.5	175.1	0	0	0	0	0	108.8	K472 G476 A477	K472-G474 PolarHBondContact O-N 2.89Å; G474-G476 PolarHBondContact O-N 2.91Å; G474-A477 PolarHBondContact O-N 3.4Å
475	P	47.8	Very low	52	Low	139 Å²	139	114.4 Å²	114.4	90%	0.903	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	111.6	176.4	25.9	-32.6	0	0	0	108.8	P473	P473-P475 WeakPolarHBondContact O-CD 3.41Å
476	G	46.8	Very low	49.1	Very low	85 Å²	85	111.4 Å²	111.4	88%	0.876	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.3	18.9	175.7	0	0	0	0	0	117.1	G474	G474-G476 PolarHBondContact O-N 2.91Å
477	A	36.8	Very low	46.3	Very low	70 Å²	70	117.3 Å²	117.3	58%	0.579	71%	0.71	S	S	*	*			trans	-115.9	38	174.9	0	0	0	0	0	114.5	G474 V479	G474-A477 PolarHBondContact O-N 3.4Å; A477-V479 PolarHBondContact O-N 3.43Å
478	E	35.3	Very low	43.7	Very low	159 Å²	159	117.8 Å²	117.8	74%	0.743	71%	0.714	S	S	*	*			trans	-67.1	90.3	148.8	-79.2	-155.9	139.6	0	0	107.7	R480	E478-R480 VanDerWaalsContact C-N 3.29Å; E478-R480 PolarHBondContact O-N 3.32Å
479	V	37.2	Very low	40.9	Very low	108 Å²	108	123.2 Å²	123.2	66%	0.655	75%	0.748	S	S	*	*			trans	-65.4	93	174.1	179.3	0	0	0	0	108.1	A477 L481	A477-V479 PolarHBondContact O-N 3.43Å; V479-L481 VanDerWaalsContact C-N 3.29Å; V479-L481 HydrophobicContact CG1-CD2 3.59Å; V479-L481 HydrophobicContact CG1-CG 3.92Å; V479-L481 PolarHBondContact O-N 2.91Å
480	R	34.7	Very low	39.1	Very low	222 Å²	222	121.4 Å²	121.4	84%	0.838	75%	0.748	S	S	*	*			trans	-60.2	95	157.9	-74.7	-172.9	173.9	-167.2	-0.7	107.8	E478 S482	E478-R480 VanDerWaalsContact C-N 3.29Å; E478-R480 PolarHBondContact O-N 3.32Å; R480-S482 PolarHBondContact O-N 2.95Å
481	L	37.8	Very low	37.7	Very low	159 Å²	159	124.5 Å²	124.5	83%	0.832	77%	0.766	S	S	*	*	S	Bend	trans	-71	64.4	162.4	-66.4	-179.4	0	0	0	109.3	V479	V479-L481 VanDerWaalsContact C-N 3.29Å; V479-L481 HydrophobicContact CG1-CD2 3.59Å; V479-L481 HydrophobicContact CG1-CG 3.92Å; V479-L481 PolarHBondContact O-N 2.91Å
482	S	36.4	Very low	36.7	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	78%	0.783	S	S	*	*			trans	-166	53.8	177.9	-74.5	0	0	0	0	110.6	R480	R480-S482 PolarHBondContact O-N 2.95Å
483	S	34.7	Very low	35.4	Very low	116 Å²	116	135 Å²	135	81%	0.811	79%	0.787	S	S	*	*			trans	-170.2	94.4	145.8	-148.5	0	0	0	0	110.7
484	E	29.4	Very low	34.3	Very low	191 Å²	191	131.8 Å²	131.8	89%	0.893	78%	0.777	S	S	*	*			trans	-104.4	98.1	168.5	-174.8	171.4	-144.7	0	0	108.6
485	T	27.8	Very low	34.3	Very low	138 Å²	138	137.4 Å²	137.4	85%	0.847	79%	0.79	S	S	*	*			trans	174.4	129.7	156.7	-79.4	0	0	0	0	109.2
486	G	30.9	Very low	33.4	Very low	68 Å²	68	139.1 Å²	139.1	70%	0.701	79%	0.788	S	S	*	*			trans	106.8	86.2	151	0	0	0	0	0	118.2
487	Q	29.5	Very low	32.7	Very low	200 Å²	200	141.9 Å²	141.9	94%	0.935	78%	0.78	S	S	*	*			trans	81.6	126.4	133.6	-146.1	161.8	9.3	0	0	119.4
488	A	32.4	Very low	33.1	Very low	88 Å²	88	147 Å²	147	73%	0.727	79%	0.789	S	S	*	*			trans	-90.7	162.5	177.6	0	0	0	0	0	112.7
489	V	29.6	Very low	32.8	Very low	145 Å²	145	145.9 Å²	145.9	88%	0.879	79%	0.788	S	S	*	*				167.3	128.3	127.7	153.6	0	0	0	0	111.2
490	G	29.3	Very low	33	Very low	68 Å²	68	147.8 Å²	147.8	70%	0.701	80%	0.795	S	S	*	*			trans	72.3	160.1	158	0	0	0	0	0	117.6
491	T	34.3	Very low	33.5	Very low	121 Å²	121	141.2 Å²	141.2	74%	0.742	78%	0.783	S	S	*	*			cis	-151.7	136.6	-2.2	-53.8	0	0	0	0	111.4	W493	T491-W493 PolarHBondContact O-N 2.94Å
492	R	36.2	Very low	33.9	Very low	231 Å²	231	140.9 Å²	140.9	87%	0.872	78%	0.775	S	S	*	*			trans	-31	114.8	158.7	174.6	-159.3	-165.7	-179.1	5.7	115.8
493	W	28.1	Very low	34.5	Very low	244 Å²	244	140.3 Å²	140.3	92%	0.924	77%	0.769	S	S	*	*			trans	-154	153.2	144	-64.9	104.8	0	0	0	106.8	T491	T491-W493 PolarHBondContact O-N 2.94Å
494	G	28.8	Very low	35.5	Very low	59 Å²	59	138.7 Å²	138.7	61%	0.608	76%	0.755	S	S	*	*			cis	155.2	101.1	4.4	0	0	0	0	0	108.8	M496	G494-M496 PolarHBondContact O-N 3.4Å
495	H	36	Very low	36.9	Very low	166 Å²	166	133.9 Å²	133.9	77%	0.769	73%	0.733	S	S	*	*			trans	-6.5	107.5	168.6	-172.9	-70.5	0	0	0	118.1
496	M	29.1	Very low	38.8	Very low	174 Å²	174	130.2 Å²	130.2	86%	0.857	71%	0.713	S	S	*	*			trans	-130.1	109.1	152.1	-64.6	-164.9	88.1	0	0	106.7	G494	G494-M496 PolarHBondContact O-N 3.4Å
497	M	32.7	Very low	41	Very low	143 Å²	143	134.4 Å²	134.4	70%	0.704	71%	0.712	S	S	*	*				69.8	129.2	91.6	-80.1	-59.6	-166	0	0	113.9	D499	M497-D499 PolarHBondContact O-N 2.95Å
498	K	45.2	Very low	43.3	Very low	177 Å²	177	134.2 Å²	134.2	77%	0.77	70%	0.703	S	S	*	*			trans	-90.1	91.4	-169.7	175.3	-172.6	173.7	-178.4	0	109.4	N500	K498-N500 PolarHBondContact O-N 3.39Å
499	D	29.6	Very low	45.6	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	69%	0.692	S	S	*	*			trans	-87.4	96.4	172.8	-73.9	-19.5	0	0	0	111.2	M497 S501	M497-D499 PolarHBondContact O-N 2.95Å; D499-S501 VanDerWaalsContact C-N 3.33Å; D499-S501 PolarHBondContact O-N 3.1Å; D499-S501 VanDerWaalsContact O-N 3.1Å
500	N	39.8	Very low	48.2	Very low	148 Å²	148	134.8 Å²	134.8	79%	0.791	68%	0.678	S	S	*	*			trans	-74.6	81.5	164.3	-91.1	6	0	0	0	109.4	K498	K498-N500 PolarHBondContact O-N 3.39Å
501	S	46.6	Very low	50.8	Low	85 Å²	85	133.6 Å²	133.6	59%	0.594	66%	0.662	S	S	*	*			trans	-152	25.7	-179.3	60.3	0	0	0	0	116.2	D499 P503	D499-S501 VanDerWaalsContact C-N 3.33Å; D499-S501 PolarHBondContact O-N 3.1Å; D499-S501 VanDerWaalsContact O-N 3.1Å; S501-P503 VanDerWaalsContact C-CD 3.48Å; S501-P503 VanDerWaalsContact O-CD 3.25Å; S501-P503 WeakPolarHBondContact O-CD 3.23Å
502	K	44.9	Very low	53.2	Low	152 Å²	152	130.4 Å²	130.4	66%	0.661	65%	0.645	S	S	*	*			trans	-106.8	89.3	179.1	-77.7	-170.6	160.8	-160.3	0	115.5	E505	K502-E505 WeakPolarHBondContact CD-OE2 3.43Å; K502-E505 WeakPolarHBondContact CE-OE2 3.38Å; K502-E505 IonicContact NZ-OE1 2.72Å; K502-E505 PolarHBondContact NZ-OE1 3.4Å; K502-E505 IonicContact NZ-OE2 3.64Å; K502-E505 PolarHBondContact NZ-OE2 2.81Å
503	P	49.9	Very low	55.7	Low	97 Å²	97	124.7 Å²	124.7	63%	0.63	63%	0.631	S	S	*	*			trans	-117.2	24.2	153.5	40	-32.4	0	0	0	117.5	S501	S501-P503 VanDerWaalsContact C-CD 3.48Å; S501-P503 VanDerWaalsContact O-CD 3.25Å; S501-P503 WeakPolarHBondContact O-CD 3.23Å
504	P	55.5	Low	58.6	Low	82 Å²	82	119.5 Å²	119.5	53%	0.532	62%	0.615	S	S	.	*	S	Bend	trans	-98.4	-26	169.8	36.6	-33	0	0	0	114.4	K507 R508	P504-K507 PolarHBondContact O-N 3.5Å; P504-R508 PolarHBondContact O-N 2.84Å; P504-R508 VanDerWaalsContact O-N 3.17Å
505	E	58.5	Low	61.5	Low	90 Å²	90	124.3 Å²	124.3	42%	0.421	62%	0.616	S	S	.	*	H	α-helix	trans	-66.2	-46.9	-168.7	-121.3	157.2	-149.8	0	0	112.5	K502 K507 R508 E509	K502-E505 WeakPolarHBondContact CD-OE2 3.43Å; K502-E505 WeakPolarHBondContact CE-OE2 3.38Å; K502-E505 IonicContact NZ-OE1 2.72Å; K502-E505 PolarHBondContact NZ-OE1 3.4Å; K502-E505 IonicContact NZ-OE2 3.64Å; K502-E505 PolarHBondContact NZ-OE2 2.81Å; E505-K507 VanDerWaalsContact C-N 3.28Å; E505-K507 PolarHBondContact O-N 3.03Å; E505-R508 WeakPolarHBondContact O-CB 3.41Å; E505-R508 PolarHBondContact O-N 2.84Å; E505-E509 WeakPolarHBondContact O-CG 3.25Å; E505-E509 PolarHBondContact O-N 3.24Å
506	S	68.4	Low	64.2	Low	61 Å²	61	122.2 Å²	122.2	43%	0.427	61%	0.606	S	S	.	*	H	α-helix	trans	-66.8	-25.5	179.5	70.9	0	0	0	0	114.2	K510	S506-K510 WeakPolarHBondContact O-CB 3.44Å; S506-K510 WeakPolarHBondContact O-CD 3.4Å; S506-K510 WeakPolarHBondContact O-CG 3.49Å; S506-K510 PolarHBondContact O-N 3.39Å
507	K	75.4	Confident	67.3	Low	156 Å²	156	119.3 Å²	119.3	68%	0.678	59%	0.594	S	S	*	*	H	α-helix	trans	-73.4	-38.9	172.5	-68	-179.8	-178.4	174.9	0	111	P504 E505 A511	P504-K507 PolarHBondContact O-N 3.5Å; E505-K507 VanDerWaalsContact C-N 3.28Å; E505-K507 PolarHBondContact O-N 3.03Å; K507-A511 PolarHBondContact O-N 2.79Å
508	R	77.9	Confident	70.1	Confident	196 Å²	196	116.9 Å²	116.9	74%	0.74	58%	0.583	S	S	*	*	H	α-helix	trans	-67.1	-43.4	174.6	-174.5	179.5	179.7	179.5	0.4	111.6	P504 E505 A511 S512	P504-R508 PolarHBondContact O-N 2.84Å; P504-R508 VanDerWaalsContact O-N 3.17Å; E505-R508 WeakPolarHBondContact O-CB 3.41Å; E505-R508 PolarHBondContact O-N 2.84Å; R508-A511 PolarHBondContact O-N 2.82Å; R508-S512 PolarHBondContact O-N 3.29Å; R508-S512 PolarHBondContact O-OG 3.28Å
509	E	82.3	Confident	72.3	Confident	109 Å²	109	111.1 Å²	111.1	51%	0.509	57%	0.565	S	S	.	*	H	α-helix	trans	-60.5	-47.1	174.4	-71.7	162.4	-176.2	0	0	111.4	E505 A511 S512 L513	E505-E509 WeakPolarHBondContact O-CG 3.25Å; E505-E509 PolarHBondContact O-N 3.24Å; E509-A511 VanDerWaalsContact C-N 3.32Å; E509-A511 PolarHBondContact O-N 3.38Å; E509-S512 PolarHBondContact O-N 3.23Å; E509-L513 WeakPolarHBondContact O-CG 3.49Å; E509-L513 PolarHBondContact O-N 2.85Å
510	K	82.9	Confident	75.3	Confident	135 Å²	135	108.4 Å²	108.4	59%	0.587	55%	0.553	S	S	*	*	H	α-helix	trans	-56.9	-44	173	-76.4	172	-178.5	-173.1	0	112.1	S506 L513 F514	S506-K510 WeakPolarHBondContact O-CB 3.44Å; S506-K510 WeakPolarHBondContact O-CD 3.4Å; S506-K510 WeakPolarHBondContact O-CG 3.49Å; S506-K510 PolarHBondContact O-N 3.39Å; K510-L513 PolarHBondContact O-N 2.76Å; K510-F514 WeakPolarHBondContact O-CD2 3.33Å; K510-F514 PolarHBondContact O-N 3.46Å
511	A	84.3	Confident	77.9	Confident	43 Å²	43	109.9 Å²	109.9	36%	0.355	55%	0.547	S	S	.	.	H	α-helix	trans	-63.2	-44.7	176.2	0	0	0	0	0	112.2	K507 R508 E509 L513 F514 Y515	K507-A511 PolarHBondContact O-N 2.79Å; R508-A511 PolarHBondContact O-N 2.82Å; E509-A511 VanDerWaalsContact C-N 3.32Å; E509-A511 PolarHBondContact O-N 3.38Å; A511-L513 PolarHBondContact O-N 3.27Å; A511-F514 PolarHBondContact O-N 3.15Å; A511-Y515 WeakPolarHBondContact O-CD2 3.4Å; A511-Y515 PolarHBondContact O-N 3.41Å
512	S	84.8	Confident	80	Confident	55 Å²	55	109.3 Å²	109.3	39%	0.385	54%	0.535	S	S	.	.	H	α-helix	trans	-58.2	-45.8	174.6	-63.4	0	0	0	0	111.9	R508 E509 F514 Y515 E516	R508-S512 PolarHBondContact O-N 3.29Å; R508-S512 PolarHBondContact O-OG 3.28Å; E509-S512 PolarHBondContact O-N 3.23Å; S512-F514 VanDerWaalsContact C-N 3.32Å; S512-F514 PolarHBondContact O-N 2.85Å; S512-Y515 PolarHBondContact O-N 3.3Å; S512-Y515 VanDerWaalsContact O-N 3.11Å; S512-E516 PolarHBondContact O-N 3.13Å
513	L	89.5	Confident	82.2	Confident	110 Å²	110	107 Å²	107	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-62	-36.8	176.9	-70.3	170.5	0	0	0	112.4	E509 K510 A511 L517	E509-L513 WeakPolarHBondContact O-CG 3.49Å; E509-L513 PolarHBondContact O-N 2.85Å; K510-L513 PolarHBondContact O-N 2.76Å; A511-L513 PolarHBondContact O-N 3.27Å; L513-L517 VanDerWaalsContact O-CB 3.24Å; L513-L517 WeakPolarHBondContact O-CB 3.5Å; L513-L517 PolarHBondContact O-N 3.33Å
514	F	88.6	Confident	83.7	Confident	135 Å²	135	106.9 Å²	106.9	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-65.8	-41.4	171.9	-77.8	-60.9	0	0	0	112.4	K510 A511 S512 L517 I518	K510-F514 WeakPolarHBondContact O-CD2 3.33Å; K510-F514 PolarHBondContact O-N 3.46Å; A511-F514 PolarHBondContact O-N 3.15Å; S512-F514 VanDerWaalsContact C-N 3.32Å; S512-F514 PolarHBondContact O-N 2.85Å; F514-L517 PolarHBondContact O-N 2.9Å; F514-I518 WeakPolarHBondContact O-CB 3.27Å; F514-I518 WeakPolarHBondContact O-CD1 3.28Å; F514-I518 WeakPolarHBondContact O-CG1 3.48Å; F514-I518 PolarHBondContact O-N 3.44Å
515	Y	88.4	Confident	85.2	Confident	161 Å²	161	105.7 Å²	105.7	63%	0.631	51%	0.513	S	S	*	.	H	α-helix	trans	-63.4	-43.3	175	-80.5	-67.9	0	0	0	112.3	A511 S512 I518 S519	A511-Y515 WeakPolarHBondContact O-CD2 3.4Å; A511-Y515 PolarHBondContact O-N 3.41Å; S512-Y515 PolarHBondContact O-N 3.3Å; S512-Y515 VanDerWaalsContact O-N 3.11Å; Y515-I518 PolarHBondContact O-N 2.9Å; Y515-S519 PolarHBondContact O-N 3.34Å
516	E	93.8	Very high	86.8	Confident	121 Å²	121	106.8 Å²	106.8	57%	0.565	52%	0.521	S	S	*	.	H	α-helix	trans	-63.5	-45.7	175.4	-73.3	177.8	-168.3	0	0	111.7	S512 I518 S519 V520	S512-E516 PolarHBondContact O-N 3.13Å; E516-I518 VanDerWaalsContact C-N 3.31Å; E516-I518 PolarHBondContact O-N 3.47Å; E516-S519 WeakPolarHBondContact O-CB 3.25Å; E516-S519 PolarHBondContact O-N 2.93Å; E516-S519 VanDerWaalsContact O-N 3.14Å; E516-V520 WeakPolarHBondContact O-CG2 3.38Å; E516-V520 PolarHBondContact O-N 2.87Å
517	L	94.6	Very high	87.9	Confident	114 Å²	114	108.7 Å²	108.7	60%	0.597	53%	0.526	S	S	*	.	H	α-helix	trans	-61.2	-38.6	176.7	-177.6	63.5	0	0	0	112.2	L513 F514 R521	L513-L517 VanDerWaalsContact O-CB 3.24Å; L513-L517 WeakPolarHBondContact O-CB 3.5Å; L513-L517 PolarHBondContact O-N 3.33Å; F514-L517 PolarHBondContact O-N 2.9Å; L517-R521 WeakPolarHBondContact O-CB 3.26Å; L517-R521 PolarHBondContact O-N 3.31Å
518	I	90.6	Very high	88.7	Confident	92 Å²	92	107.7 Å²	107.7	47%	0.472	52%	0.518	S	S	.	.	H	α-helix	trans	-68.1	-41.7	174.6	-69.2	164.7	0	0	0	110.7	F514 Y515 E516 R521 E522	F514-I518 WeakPolarHBondContact O-CB 3.27Å; F514-I518 WeakPolarHBondContact O-CD1 3.28Å; F514-I518 WeakPolarHBondContact O-CG1 3.48Å; F514-I518 PolarHBondContact O-N 3.44Å; Y515-I518 PolarHBondContact O-N 2.9Å; E516-I518 VanDerWaalsContact C-N 3.31Å; E516-I518 PolarHBondContact O-N 3.47Å; I518-R521 PolarHBondContact O-N 3.49Å; I518-E522 PolarHBondContact O-N 2.89Å
519	S	91.1	Very high	89.2	Confident	56 Å²	56	101 Å²	101	39%	0.392	51%	0.505	S	S	.	.	H	α-helix	trans	-60.5	-53.3	175.8	-160.5	0	0	0	0	111.1	Y515 E516 R521 E522 E523	Y515-S519 PolarHBondContact O-N 3.34Å; E516-S519 WeakPolarHBondContact O-CB 3.25Å; E516-S519 PolarHBondContact O-N 2.93Å; E516-S519 VanDerWaalsContact O-N 3.14Å; S519-R521 PolarHBondContact O-N 3.33Å; S519-E522 CarbonylContact O-C 3.54Å; S519-E522 WeakPolarHBondContact O-CA 3.35Å; S519-E522 PolarHBondContact O-N 3.25Å; S519-E523 WeakPolarHBondContact O-CB 3.18Å; S519-E523 WeakPolarHBondContact O-CG 3.33Å; S519-E523 PolarHBondContact O-N 3.22Å; S519-E523 PolarHBondContact OG-OE1 2.89Å
520	V	92.6	Very high	89.5	Confident	78 Å²	78	100 Å²	100	47%	0.473	50%	0.503	S	S	.	.	H	α-helix	trans	-58.6	-36.3	177.3	172.9	0	0	0	0	111.3	E516 M524	E516-V520 WeakPolarHBondContact O-CG2 3.38Å; E516-V520 PolarHBondContact O-N 2.87Å; V520-M524 HydrophobicContact CG1-CG 4.36Å; V520-M524 WeakPolarHBondContact O-CB 3.38Å; V520-M524 WeakPolarHBondContact O-CG 3.12Å; V520-M524 PolarHBondContact O-N 3.34Å
521	R	96.2	Very high	90.1	Very high	180 Å²	180	98.1 Å²	98.1	68%	0.679	50%	0.498	S	S	*	.	H	α-helix	trans	-67.4	-40.7	173.7	-179.3	-179.8	174.2	-83.3	3.3	112.8	L517 I518 S519 S525	L517-R521 WeakPolarHBondContact O-CB 3.26Å; L517-R521 PolarHBondContact O-N 3.31Å; I518-R521 PolarHBondContact O-N 3.49Å; S519-R521 PolarHBondContact O-N 3.33Å; R521-S525 WeakPolarHBondContact O-CB 3.29Å; R521-S525 PolarHBondContact O-N 3.41Å; R521-S525 VanDerWaalsContact O-N 3.13Å
522	E	89.2	Confident	90.5	Very high	73 Å²	73	104 Å²	104	34%	0.341	51%	0.511	S	S	.	.	H	α-helix	trans	-66.7	-47.3	174.1	-71.5	-153.4	157.7	0	0	110.6	I518 S519 M524 S525 D526 R657 R661	I518-E522 PolarHBondContact O-N 2.89Å; S519-E522 CarbonylContact O-C 3.54Å; S519-E522 WeakPolarHBondContact O-CA 3.35Å; S519-E522 PolarHBondContact O-N 3.25Å; E522-M524 PolarHBondContact O-N 3.11Å; E522-S525 CarbonylContact O-C 3.57Å; E522-S525 WeakPolarHBondContact O-CA 3.33Å; E522-S525 WeakPolarHBondContact O-CB 3.46Å; E522-S525 PolarHBondContact O-N 3.21Å; E522-S525 PolarHBondContact O-OG 2.83Å; E522-D526 PolarHBondContact O-N 2.92Å; E522-R657 IonicContact OE1-NH2 2.67Å; E522-R661 IonicContact OE1-NH2 3.92Å; E522-R661 PolarHBondContact OE1-NH2 3.04Å; E522-R661 IonicContact OE2-NH2 3.86Å; E522-R661 PolarHBondContact OE2-NH2 2.93Å
523	E	92.1	Very high	90.9	Very high	104 Å²	104	105.4 Å²	105.4	49%	0.486	51%	0.514	S	S	.	.	H	α-helix	trans	-58.7	-46	176.9	-70.4	164	-133.7	0	0	112.1	S519 S525 D526 L527	S519-E523 WeakPolarHBondContact O-CB 3.18Å; S519-E523 WeakPolarHBondContact O-CG 3.33Å; S519-E523 PolarHBondContact O-N 3.22Å; S519-E523 PolarHBondContact OG-OE1 2.89Å; E523-S525 PolarHBondContact O-N 3.48Å; E523-D526 PolarHBondContact O-N 3.27Å; E523-L527 WeakPolarHBondContact O-CB 3.41Å; E523-L527 WeakPolarHBondContact O-CG 3.32Å; E523-L527 PolarHBondContact O-N 3.31Å
524	M	81.4	Confident	91	Very high	94 Å²	94	105.6 Å²	105.6	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-59.9	-32.6	171.7	-80.9	-95.8	-100.6	0	0	112.6	V520 E522 R528	V520-M524 HydrophobicContact CG1-CG 4.36Å; V520-M524 WeakPolarHBondContact O-CB 3.38Å; V520-M524 WeakPolarHBondContact O-CG 3.12Å; V520-M524 PolarHBondContact O-N 3.34Å; E522-M524 PolarHBondContact O-N 3.11Å; M524-R528 WeakPolarHBondContact O-CD 3.48Å; M524-R528 WeakPolarHBondContact O-CG 3.48Å; M524-R528 PolarHBondContact O-N 3.02Å; M524-R528 VanDerWaalsContact O-N 3.12Å
525	S	86.6	Confident	91.1	Very high	57 Å²	57	103.7 Å²	103.7	40%	0.399	50%	0.503	S	S	.	.	H	α-helix	trans	-73.8	-38.2	176.3	81.3	0	0	0	0	112.4	R521 E522 E523 R528 A529	R521-S525 WeakPolarHBondContact O-CB 3.29Å; R521-S525 PolarHBondContact O-N 3.41Å; R521-S525 VanDerWaalsContact O-N 3.13Å; E522-S525 CarbonylContact O-C 3.57Å; E522-S525 WeakPolarHBondContact O-CA 3.33Å; E522-S525 WeakPolarHBondContact O-CB 3.46Å; E522-S525 PolarHBondContact O-N 3.21Å; E522-S525 PolarHBondContact O-OG 2.83Å; E523-S525 PolarHBondContact O-N 3.48Å; S525-R528 PolarHBondContact O-N 3.47Å; S525-A529 PolarHBondContact O-N 2.67Å
526	D	91.3	Very high	91.2	Very high	113 Å²	113	102 Å²	102	60%	0.604	50%	0.498	S	S	*	.	H	α-helix	trans	-69.8	-39.5	175.3	-80.9	-19	0	0	0	111.4	E522 E523 A529 L530	E522-D526 PolarHBondContact O-N 2.92Å; E523-D526 PolarHBondContact O-N 3.27Å; D526-A529 WeakPolarHBondContact O-CB 3.4Å; D526-A529 PolarHBondContact O-N 3.03Å; D526-L530 WeakPolarHBondContact O-CB 3.43Å; D526-L530 PolarHBondContact O-N 3.17Å
527	L	92.1	Very high	91.1	Very high	100 Å²	100	99.9 Å²	99.9	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-61.3	-43.8	172.3	-73.7	173.6	0	0	0	111.9	E523 A529 L530 I531	E523-L527 WeakPolarHBondContact O-CB 3.41Å; E523-L527 WeakPolarHBondContact O-CG 3.32Å; E523-L527 PolarHBondContact O-N 3.31Å; L527-A529 VanDerWaalsContact C-N 3.3Å; L527-A529 PolarHBondContact O-N 3.28Å; L527-L530 PolarHBondContact O-N 3.42Å; L527-I531 VanDerWaalsContact O-CG1 3.29Å; L527-I531 WeakPolarHBondContact O-CG1 3.37Å; L527-I531 PolarHBondContact O-N 2.95Å
528	R	92.9	Very high	90.9	Very high	135 Å²	135	99 Å²	99	51%	0.509	48%	0.484	S	S	.	.	H	α-helix	trans	-62.4	-36.8	173.7	-71.1	166	-162.6	157.1	4.9	112.2	M524 S525 R532	M524-R528 WeakPolarHBondContact O-CD 3.48Å; M524-R528 WeakPolarHBondContact O-CG 3.48Å; M524-R528 PolarHBondContact O-N 3.02Å; M524-R528 VanDerWaalsContact O-N 3.12Å; S525-R528 PolarHBondContact O-N 3.47Å; R528-R532 WeakPolarHBondContact O-CB 3.48Å; R528-R532 VanDerWaalsContact O-CG 3.32Å; R528-R532 WeakPolarHBondContact O-CG 3.29Å; R528-R532 PolarHBondContact O-N 3.42Å; R528-R532 VanDerWaalsContact O-N 3.12Å
529	A	87.4	Confident	90.8	Very high	56 Å²	56	99.6 Å²	99.6	46%	0.463	48%	0.48	S	S	.	.	H	α-helix	trans	-67.8	-39.4	175	0	0	0	0	0	111.9	S525 D526 L527 L533	S525-A529 PolarHBondContact O-N 2.67Å; D526-A529 WeakPolarHBondContact O-CB 3.4Å; D526-A529 PolarHBondContact O-N 3.03Å; L527-A529 VanDerWaalsContact C-N 3.3Å; L527-A529 PolarHBondContact O-N 3.28Å; A529-L533 PolarHBondContact O-N 3.43Å
530	L	90	Very high	90.5	Very high	88 Å²	88	101.3 Å²	101.3	46%	0.461	49%	0.492	S	S	.	.	H	α-helix	trans	-66.9	-43.9	176.1	-176.7	61.6	0	0	0	112.1	D526 L527 R532 L533 K534	D526-L530 WeakPolarHBondContact O-CB 3.43Å; D526-L530 PolarHBondContact O-N 3.17Å; L527-L530 PolarHBondContact O-N 3.42Å; L530-R532 PolarHBondContact O-N 3.38Å; L530-L533 WeakPolarHBondContact O-CB 3.44Å; L530-L533 PolarHBondContact O-N 3.48Å; L530-L533 VanDerWaalsContact O-N 3.12Å; L530-K534 WeakPolarHBondContact O-CG 3.15Å; L530-K534 PolarHBondContact O-N 2.88Å
531	I	94.6	Very high	90.4	Very high	95 Å²	95	103.9 Å²	103.9	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-56.5	-52	174.1	-70.6	163.6	0	0	0	109.9	L527 L533 K534 E535	L527-I531 VanDerWaalsContact O-CG1 3.29Å; L527-I531 WeakPolarHBondContact O-CG1 3.37Å; L527-I531 PolarHBondContact O-N 2.95Å; I531-L533 PolarHBondContact O-N 3.15Å; I531-K534 PolarHBondContact O-N 2.94Å; I531-E535 HydrophobicContact CG2-CG 4.33Å; I531-E535 WeakPolarHBondContact CG2-OE1 3.33Å; I531-E535 WeakPolarHBondContact O-CG 3.45Å; I531-E535 PolarHBondContact O-N 2.9Å
532	R	92.9	Very high	90.2	Very high	168 Å²	168	100.1 Å²	100.1	63%	0.634	49%	0.492	S	S	*	.	H	α-helix	trans	-60.3	-27	177	-74.3	172.2	171.7	177.2	-4.9	113.9	R528 L530 K536	R528-R532 WeakPolarHBondContact O-CB 3.48Å; R528-R532 VanDerWaalsContact O-CG 3.32Å; R528-R532 WeakPolarHBondContact O-CG 3.29Å; R528-R532 PolarHBondContact O-N 3.42Å; R528-R532 VanDerWaalsContact O-N 3.12Å; L530-R532 PolarHBondContact O-N 3.38Å; R532-K536 WeakPolarHBondContact O-CG 3.4Å; R532-K536 PolarHBondContact O-N 2.9Å
533	L	93.3	Very high	90	Very high	84 Å²	84	104.7 Å²	104.7	44%	0.44	51%	0.506	S	S	.	.	H	α-helix	trans	-75.4	-46.5	172.9	-179.1	62.1	0	0	0	110.8	A529 L530 I531 E535 K536 E537	A529-L533 PolarHBondContact O-N 3.43Å; L530-L533 WeakPolarHBondContact O-CB 3.44Å; L530-L533 PolarHBondContact O-N 3.48Å; L530-L533 VanDerWaalsContact O-N 3.12Å; I531-L533 PolarHBondContact O-N 3.15Å; L533-E535 VanDerWaalsContact C-N 3.35Å; L533-E535 PolarHBondContact O-N 2.72Å; L533-K536 WeakPolarHBondContact O-CA 3.48Å; L533-K536 WeakPolarHBondContact O-CB 3.47Å; L533-K536 PolarHBondContact O-N 3.3Å; L533-E537 PolarHBondContact O-N 3.4Å
534	K	90.9	Very high	89.9	Confident	114 Å²	114	101.9 Å²	101.9	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-36.9	177	-67.6	-51.7	-173.2	179.8	0	112.9	L530 I531 K536 E537 L538	L530-K534 WeakPolarHBondContact O-CG 3.15Å; L530-K534 PolarHBondContact O-N 2.88Å; I531-K534 PolarHBondContact O-N 2.94Å; K534-K536 PolarHBondContact O-N 3.05Å; K534-E537 WeakPolarHBondContact CD-OE2 3.21Å; K534-E537 WeakPolarHBondContact CE-OE2 3.42Å; K534-E537 IonicContact NZ-OE1 2.59Å; K534-E537 IonicContact NZ-OE2 2.71Å; K534-E537 PolarHBondContact NZ-OE2 2.82Å; K534-E537 PolarHBondContact O-N 3.42Å; K534-L538 VanDerWaalsContact O-CB 3.24Å; K534-L538 WeakPolarHBondContact O-CB 3.45Å; K534-L538 PolarHBondContact O-N 3.41Å
535	E	90.7	Very high	90.3	Very high	94 Å²	94	101.6 Å²	101.6	44%	0.439	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-27.5	170	-71.7	170.2	174	0	0	113.6	I531 L533 R539	I531-E535 HydrophobicContact CG2-CG 4.33Å; I531-E535 WeakPolarHBondContact CG2-OE1 3.33Å; I531-E535 WeakPolarHBondContact O-CG 3.45Å; I531-E535 PolarHBondContact O-N 2.9Å; L533-E535 VanDerWaalsContact C-N 3.35Å; L533-E535 PolarHBondContact O-N 2.72Å; E535-R539 WeakPolarHBondContact O-CB 3.19Å; E535-R539 WeakPolarHBondContact O-CG 3.23Å; E535-R539 PolarHBondContact O-N 3.35Å; E535-R539 PolarHBondContact O-NE 2.82Å
536	K	91.4	Very high	90.2	Very high	125 Å²	125	103.7 Å²	103.7	54%	0.543	51%	0.51	S	S	.	.	H	α-helix	trans	-81.7	-42.8	174.6	-73.6	173	-178.2	-177.3	0	111.2	R532 L533 K534 R539 C540	R532-K536 WeakPolarHBondContact O-CG 3.4Å; R532-K536 PolarHBondContact O-N 2.9Å; L533-K536 WeakPolarHBondContact O-CA 3.48Å; L533-K536 WeakPolarHBondContact O-CB 3.47Å; L533-K536 PolarHBondContact O-N 3.3Å; K534-K536 PolarHBondContact O-N 3.05Å; K536-R539 PolarHBondContact O-N 2.85Å; K536-C540 PolarHBondContact O-N 3.4Å; K536-C540 PolarHBondContact O-SG 3.38Å
537	E	91.3	Very high	89.7	Confident	78 Å²	78	99.9 Å²	99.9	36%	0.364	50%	0.498	S	S	.	.	H	α-helix	trans	-59.5	-47.6	174.6	-70.6	174.4	-170.7	0	0	111.3	L533 K534 R539 C540 L541	L533-E537 PolarHBondContact O-N 3.4Å; K534-E537 WeakPolarHBondContact CD-OE2 3.21Å; K534-E537 WeakPolarHBondContact CE-OE2 3.42Å; K534-E537 IonicContact NZ-OE1 2.59Å; K534-E537 IonicContact NZ-OE2 2.71Å; K534-E537 PolarHBondContact NZ-OE2 2.82Å; K534-E537 PolarHBondContact O-N 3.42Å; E537-R539 PolarHBondContact O-N 2.88Å; E537-C540 WeakPolarHBondContact O-CB 3.26Å; E537-C540 PolarHBondContact O-N 3.17Å; E537-L541 WeakPolarHBondContact O-CG 3.31Å; E537-L541 PolarHBondContact O-N 3.46Å
538	L	90.8	Very high	89.4	Confident	96 Å²	96	100 Å²	100	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-57.7	-48.9	176.1	-178.8	146.1	0	0	0	111.4	K534 C540 L541 E542	K534-L538 VanDerWaalsContact O-CB 3.24Å; K534-L538 WeakPolarHBondContact O-CB 3.45Å; K534-L538 PolarHBondContact O-N 3.41Å; L538-C540 PolarHBondContact O-N 3.44Å; L538-L541 WeakPolarHBondContact O-CB 3.36Å; L538-L541 PolarHBondContact O-N 3.4Å; L538-L541 VanDerWaalsContact O-N 3.11Å; L538-E542 VanDerWaalsContact CD2-CD 3.43Å; L538-E542 HydrophobicContact CD2-CG 4.16Å; L538-E542 WeakPolarHBondContact CD2-OE1 3.46Å; L538-E542 WeakPolarHBondContact O-CG 3.33Å; L538-E542 PolarHBondContact O-N 3.32Å
539	R	87.5	Confident	89.1	Confident	103 Å²	103	98.7 Å²	98.7	39%	0.389	49%	0.493	S	S	.	.	H	α-helix	trans	-59	-44.2	175.3	-80.3	-178.3	-75.4	-178	-11	112.4	E535 K536 E537 L541 E542 W543	E535-R539 WeakPolarHBondContact O-CB 3.19Å; E535-R539 WeakPolarHBondContact O-CG 3.23Å; E535-R539 PolarHBondContact O-N 3.35Å; E535-R539 PolarHBondContact O-NE 2.82Å; K536-R539 PolarHBondContact O-N 2.85Å; E537-R539 PolarHBondContact O-N 2.88Å; R539-L541 VanDerWaalsContact C-N 3.26Å; R539-L541 PolarHBondContact O-N 2.85Å; R539-E542 PolarHBondContact O-N 2.8Å; R539-W543 PolarHBondContact O-N 2.98Å
540	C	84.4	Confident	88.5	Confident	93 Å²	93	99.1 Å²	99.1	63%	0.628	49%	0.493	S	S	*	.	H	α-helix	trans	-58.8	-38.6	176.2	-71.6	0	0	0	0	112.3	K536 E537 L538 G544	K536-C540 PolarHBondContact O-N 3.4Å; K536-C540 PolarHBondContact O-SG 3.38Å; E537-C540 WeakPolarHBondContact O-CB 3.26Å; E537-C540 PolarHBondContact O-N 3.17Å; L538-C540 PolarHBondContact O-N 3.44Å; C540-G544 PolarHBondContact O-N 3.16Å
541	L	90.9	Very high	88	Confident	131 Å²	131	102 Å²	102	69%	0.686	50%	0.504	S	S	*	.	H	α-helix	trans	-70.1	-40	175.7	-66.8	171.4	0	0	0	112.3	E537 L538 R539 G544 L545	E537-L541 WeakPolarHBondContact O-CG 3.31Å; E537-L541 PolarHBondContact O-N 3.46Å; L538-L541 WeakPolarHBondContact O-CB 3.36Å; L538-L541 PolarHBondContact O-N 3.4Å; L538-L541 VanDerWaalsContact O-N 3.11Å; R539-L541 VanDerWaalsContact C-N 3.26Å; R539-L541 PolarHBondContact O-N 2.85Å; L541-G544 PolarHBondContact O-N 3.48Å; L541-L545 WeakPolarHBondContact O-CB 3.39Å; L541-L545 PolarHBondContact O-N 3.25Å
542	E	92.8	Very high	87.4	Confident	102 Å²	102	102.4 Å²	102.4	48%	0.477	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-46	173.7	-70.2	174.4	144.6	0	0	111.9	L538 R539 G544 L545 M546	L538-E542 VanDerWaalsContact CD2-CD 3.43Å; L538-E542 HydrophobicContact CD2-CG 4.16Å; L538-E542 WeakPolarHBondContact CD2-OE1 3.46Å; L538-E542 WeakPolarHBondContact O-CG 3.33Å; L538-E542 PolarHBondContact O-N 3.32Å; R539-E542 PolarHBondContact O-N 2.8Å; E542-G544 VanDerWaalsContact C-N 3.32Å; E542-G544 PolarHBondContact O-N 3.38Å; E542-L545 PolarHBondContact O-N 2.92Å; E542-M546 WeakPolarHBondContact O-CB 3.27Å; E542-M546 VanDerWaalsContact O-CG 3.29Å; E542-M546 WeakPolarHBondContact O-CG 3.44Å; E542-M546 PolarHBondContact O-N 2.7Å
543	W	85.4	Confident	86.7	Confident	169 Å²	169	96.8 Å²	96.8	64%	0.64	49%	0.493	S	S	*	.	H	α-helix	trans	-60.4	-41.3	174.3	-83.8	96.6	0	0	0	111.7	R539 M546 G547	R539-W543 PolarHBondContact O-N 2.98Å; W543-M546 PolarHBondContact O-N 3.44Å; W543-G547 PolarHBondContact O-N 3.38Å
544	G	88.4	Confident	85.7	Confident	45 Å²	45	95.3 Å²	95.3	46%	0.464	49%	0.494	S	S	.	.	H	α-helix	trans	-61.7	-48.2	174.1	0	0	0	0	0	112.9	C540 L541 E542 M546 G547 Q548	C540-G544 PolarHBondContact O-N 3.16Å; L541-G544 PolarHBondContact O-N 3.48Å; E542-G544 VanDerWaalsContact C-N 3.32Å; E542-G544 PolarHBondContact O-N 3.38Å; G544-M546 VanDerWaalsContact C-N 3.34Å; G544-M546 PolarHBondContact O-N 3.47Å; G544-G547 PolarHBondContact O-N 3.11Å; G544-Q548 PolarHBondContact O-N 2.87Å
545	L	90	Very high	85	Confident	87 Å²	87	91.6 Å²	91.6	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-59.5	-42.8	176.8	-174.2	83.3	0	0	0	111.7	L541 E542 Q548 K549	L541-L545 WeakPolarHBondContact O-CB 3.39Å; L541-L545 PolarHBondContact O-N 3.25Å; E542-L545 PolarHBondContact O-N 2.92Å; L545-Q548 PolarHBondContact O-N 2.96Å; L545-K549 HydrophobicContact CG-CD 4.36Å; L545-K549 WeakPolarHBondContact O-CB 3.42Å; L545-K549 WeakPolarHBondContact O-CG 3.32Å; L545-K549 PolarHBondContact O-N 3.1Å
546	M	84.8	Confident	84.2	Confident	101 Å²	101	91.2 Å²	91.2	50%	0.498	49%	0.491	S	S	.	.	H	α-helix	trans	-70.3	-35.5	178.7	-69.4	-60.4	-71.8	0	0	112.2	E542 W543 G544 K549 S550	E542-M546 WeakPolarHBondContact O-CB 3.27Å; E542-M546 VanDerWaalsContact O-CG 3.29Å; E542-M546 WeakPolarHBondContact O-CG 3.44Å; E542-M546 PolarHBondContact O-N 2.7Å; W543-M546 PolarHBondContact O-N 3.44Å; G544-M546 VanDerWaalsContact C-N 3.34Å; G544-M546 PolarHBondContact O-N 3.47Å; M546-K549 HydrophobicContact SD-CD 4.03Å; M546-S550 PolarHBondContact O-N 2.86Å; M546-S550 VanDerWaalsContact O-N 3.1Å
547	G	82.1	Confident	83.1	Confident	34 Å²	34	91 Å²	91	35%	0.351	49%	0.491	S	S	.	.	H	α-helix	trans	-59.1	-51.8	168.2	0	0	0	0	0	111.5	W543 G544 K549 S550 Q551	W543-G547 PolarHBondContact O-N 3.38Å; G544-G547 PolarHBondContact O-N 3.11Å; G547-K549 PolarHBondContact O-N 3.41Å; G547-S550 PolarHBondContact O-N 2.81Å; G547-S550 VanDerWaalsContact O-N 3.16Å; G547-S550 PolarHBondContact O-OG 3.03Å; G547-Q551 PolarHBondContact O-N 3.35Å
548	Q	84.1	Confident	82.3	Confident	101 Å²	101	92.6 Å²	92.6	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-58.5	-48.2	177.5	-179.2	177	-15.2	0	0	112.1	G544 L545 S550 Q551 E552	G544-Q548 PolarHBondContact O-N 2.87Å; L545-Q548 PolarHBondContact O-N 2.96Å; Q548-S550 VanDerWaalsContact C-N 3.26Å; Q548-S550 PolarHBondContact O-N 2.83Å; Q548-Q551 CarbonylContact O-C 3.6Å; Q548-Q551 WeakPolarHBondContact O-CA 3.41Å; Q548-Q551 WeakPolarHBondContact O-CB 3.37Å; Q548-Q551 PolarHBondContact O-N 2.83Å; Q548-E552 HydrophobicContact CG-CG 4.26Å; Q548-E552 WeakPolarHBondContact CG-OE1 3.22Å; Q548-E552 PolarHBondContact NE2-OE1 2.8Å; Q548-E552 WeakPolarHBondContact O-CG 3.38Å; Q548-E552 PolarHBondContact O-N 3.23Å
549	K	88.1	Confident	81.4	Confident	108 Å²	108	91.5 Å²	91.5	47%	0.47	50%	0.499	S	S	.	.	H	α-helix	trans	-56.9	-38.4	176.1	-76.3	172.9	176.9	178.5	0	112.6	L545 M546 G547 A553	L545-K549 HydrophobicContact CG-CD 4.36Å; L545-K549 WeakPolarHBondContact O-CB 3.42Å; L545-K549 WeakPolarHBondContact O-CG 3.32Å; L545-K549 PolarHBondContact O-N 3.1Å; M546-K549 HydrophobicContact SD-CD 4.03Å; G547-K549 PolarHBondContact O-N 3.41Å; K549-A553 WeakPolarHBondContact O-CB 3.33Å; K549-A553 PolarHBondContact O-N 2.96Å
550	S	74.4	Confident	80.7	Confident	65 Å²	65	91.2 Å²	91.2	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-70.2	-35	175.8	74.5	0	0	0	0	112.7	M546 G547 Q548 A554	M546-S550 PolarHBondContact O-N 2.86Å; M546-S550 VanDerWaalsContact O-N 3.1Å; G547-S550 PolarHBondContact O-N 2.81Å; G547-S550 VanDerWaalsContact O-N 3.16Å; G547-S550 PolarHBondContact O-OG 3.03Å; Q548-S550 VanDerWaalsContact C-N 3.26Å; Q548-S550 PolarHBondContact O-N 2.83Å; S550-A554 WeakPolarHBondContact O-CB 3.37Å; S550-A554 PolarHBondContact O-N 3.45Å
551	Q	78.5	Confident	80	Confident	149 Å²	149	91.3 Å²	91.3	70%	0.696	50%	0.496	S	S	*	.	H	α-helix	trans	-71.3	-37.5	174.6	-175.8	178.8	-5.3	0	0	112.1	G547 Q548 G555	G547-Q551 PolarHBondContact O-N 3.35Å; Q548-Q551 CarbonylContact O-C 3.6Å; Q548-Q551 WeakPolarHBondContact O-CA 3.41Å; Q548-Q551 WeakPolarHBondContact O-CB 3.37Å; Q548-Q551 PolarHBondContact O-N 2.83Å; Q551-G555 PolarHBondContact O-N 3.1Å
552	E	81.8	Confident	79.4	Confident	103 Å²	103	90 Å²	90	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-46.4	174.1	-74.1	171.4	178	0	0	110.8	Q548 A554 G555 V556	Q548-E552 HydrophobicContact CG-CG 4.26Å; Q548-E552 WeakPolarHBondContact CG-OE1 3.22Å; Q548-E552 PolarHBondContact NE2-OE1 2.8Å; Q548-E552 WeakPolarHBondContact O-CG 3.38Å; Q548-E552 PolarHBondContact O-N 3.23Å; E552-A554 PolarHBondContact O-N 3.45Å; E552-G555 CarbonylContact O-C 3.56Å; E552-G555 WeakPolarHBondContact O-CA 3.36Å; E552-G555 PolarHBondContact O-N 2.94Å; E552-G555 VanDerWaalsContact O-N 3.1Å; E552-V556 WeakPolarHBondContact O-CG2 3.49Å; E552-V556 PolarHBondContact O-N 3.26Å; E552-V556 VanDerWaalsContact O-N 3.08Å
553	A	78.9	Confident	78.8	Confident	50 Å²	50	92.8 Å²	92.8	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-58	-48.9	173.3	0	0	0	0	0	111.7	K549 G555 V556 F557	K549-A553 WeakPolarHBondContact O-CB 3.33Å; K549-A553 PolarHBondContact O-N 2.96Å; A553-G555 VanDerWaalsContact C-N 3.26Å; A553-G555 PolarHBondContact O-N 3.42Å; A553-V556 PolarHBondContact O-N 2.86Å; A553-F557 WeakPolarHBondContact O-CD2 3.49Å; A553-F557 WeakPolarHBondContact O-CE2 3.39Å
554	A	72.8	Confident	78.4	Confident	54 Å²	54	88.7 Å²	88.7	45%	0.446	49%	0.486	S	S	.	.	H	α-helix	trans	-59.2	-37	173.9	0	0	0	0	0	112.6	S550 E552 V556 F557	S550-A554 WeakPolarHBondContact O-CB 3.37Å; S550-A554 PolarHBondContact O-N 3.45Å; E552-A554 PolarHBondContact O-N 3.45Å; A554-V556 VanDerWaalsContact C-N 3.3Å; A554-V556 PolarHBondContact O-N 3.21Å; A554-F557 PolarHBondContact O-N 3.38Å
555	G	75.3	Confident	77.8	Confident	35 Å²	35	90.8 Å²	90.8	36%	0.361	48%	0.484	S	S	.	.	H	α-helix	trans	-69	-20.8	179.1	0	0	0	0	0	114.8	Q551 E552 A553 P559	Q551-G555 PolarHBondContact O-N 3.1Å; E552-G555 CarbonylContact O-C 3.56Å; E552-G555 WeakPolarHBondContact O-CA 3.36Å; E552-G555 PolarHBondContact O-N 2.94Å; E552-G555 VanDerWaalsContact O-N 3.1Å; A553-G555 VanDerWaalsContact C-N 3.26Å; A553-G555 PolarHBondContact O-N 3.42Å; G555-P559 WeakPolarHBondContact O-CD 3.09Å
556	V	74.3	Confident	77.2	Confident	86 Å²	86	88.4 Å²	88.4	52%	0.521	48%	0.477	S	S	.	.	H	α-helix	trans	-76.6	-36.9	173.2	173.2	0	0	0	0	111.6	E552 A553 A554 I558 P559 E560	E552-V556 WeakPolarHBondContact O-CG2 3.49Å; E552-V556 PolarHBondContact O-N 3.26Å; E552-V556 VanDerWaalsContact O-N 3.08Å; A553-V556 PolarHBondContact O-N 2.86Å; A554-V556 VanDerWaalsContact C-N 3.3Å; A554-V556 PolarHBondContact O-N 3.21Å; V556-I558 VanDerWaalsContact C-N 3.29Å; V556-I558 PolarHBondContact O-N 3.25Å; V556-P559 WeakPolarHBondContact O-CD 3.41Å; V556-P559 WeakPolarHBondContact O-CG 3.41Å; V556-E560 PolarHBondContact O-N 2.88Å
557	F	68.5	Low	76.9	Confident	122 Å²	122	87.7 Å²	87.7	54%	0.535	47%	0.472	S	S	.	.	H	α-helix	trans	-68.9	-24	179.3	-63.4	-70.8	0	0	0	113.7	A553 A554 N561	A553-F557 WeakPolarHBondContact O-CD2 3.49Å; A553-F557 WeakPolarHBondContact O-CE2 3.39Å; A554-F557 PolarHBondContact O-N 3.38Å; F557-N561 VanDerWaalsContact O-CB 3.31Å; F557-N561 WeakPolarHBondContact O-CB 3.4Å; F557-N561 PolarHBondContact O-N 3.02Å; F557-N561 PolarHBondContact O-OD1 3.25Å
558	I	73.4	Confident	76.5	Confident	110 Å²	110	90.8 Å²	90.8	56%	0.564	48%	0.481	S	S	*	.	H	α-helix	trans	-64	-56	179.1	-61.4	171.3	0	0	0	112.3	V556 E560 L562	V556-I558 VanDerWaalsContact C-N 3.29Å; V556-I558 PolarHBondContact O-N 3.25Å; I558-E560 VanDerWaalsContact C-N 3.28Å; I558-E560 PolarHBondContact O-N 3.31Å; I558-L562 HydrophobicContact CG2-CD1 4.19Å; I558-L562 WeakPolarHBondContact O-CB 3.41Å; I558-L562 VanDerWaalsContact O-CG 3.28Å; I558-L562 WeakPolarHBondContact O-CG 3.43Å; I558-L562 PolarHBondContact O-N 2.93Å; I558-L562 VanDerWaalsContact O-N 3.1Å
559	P	72.2	Confident	75.9	Confident	73 Å²	73	92.6 Å²	92.6	47%	0.474	48%	0.483	S	S	.	.	H	α-helix	trans	-70.2	-21.3	176.9	28.9	-36.8	0	0	0	113.7	G555 V556 R563	G555-P559 WeakPolarHBondContact O-CD 3.09Å; V556-P559 WeakPolarHBondContact O-CD 3.41Å; V556-P559 WeakPolarHBondContact O-CG 3.41Å; P559-R563 WeakPolarHBondContact O-CB 3.28Å; P559-R563 PolarHBondContact O-N 3.12Å; P559-R563 VanDerWaalsContact O-N 3.15Å
560	E	73.3	Confident	75.2	Confident	98 Å²	98	92.2 Å²	92.2	46%	0.458	48%	0.482	S	S	.	.	H	α-helix	trans	-75	-49.8	175.5	-161.5	145.3	-138.6	0	0	110.6	V556 I558 L562 R563 D564	V556-E560 PolarHBondContact O-N 2.88Å; I558-E560 VanDerWaalsContact C-N 3.28Å; I558-E560 PolarHBondContact O-N 3.31Å; E560-L562 VanDerWaalsContact C-N 3.29Å; E560-L562 PolarHBondContact O-N 3.24Å; E560-R563 WeakPolarHBondContact O-CA 3.05Å; E560-R563 VanDerWaalsContact O-CB 3.31Å; E560-R563 WeakPolarHBondContact O-CB 3.37Å; E560-R563 PolarHBondContact O-N 3.43Å; E560-D564 PolarHBondContact O-N 3.13Å
561	N	70.4	Confident	75	Confident	94 Å²	94	92.2 Å²	92.2	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-57.3	-40.4	171.5	-69.6	-2.9	0	0	0	112.5	F557 R563 D564 E565	F557-N561 VanDerWaalsContact O-CB 3.31Å; F557-N561 WeakPolarHBondContact O-CB 3.4Å; F557-N561 PolarHBondContact O-N 3.02Å; F557-N561 PolarHBondContact O-OD1 3.25Å; N561-R563 VanDerWaalsContact C-N 3.26Å; N561-R563 PolarHBondContact O-N 3.04Å; N561-D564 PolarHBondContact O-N 2.77Å; N561-E565 WeakPolarHBondContact O-CB 3.36Å; N561-E565 WeakPolarHBondContact O-CG 3.47Å; N561-E565 PolarHBondContact O-N 3.38Å
562	L	77.1	Confident	74.5	Confident	104 Å²	104	91.7 Å²	91.7	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-66.9	-25.9	176	-73.6	171.4	0	0	0	113.3	I558 E560 A566	I558-L562 HydrophobicContact CG2-CD1 4.19Å; I558-L562 WeakPolarHBondContact O-CB 3.41Å; I558-L562 VanDerWaalsContact O-CG 3.28Å; I558-L562 WeakPolarHBondContact O-CG 3.43Å; I558-L562 PolarHBondContact O-N 2.93Å; I558-L562 VanDerWaalsContact O-N 3.1Å; E560-L562 VanDerWaalsContact C-N 3.29Å; E560-L562 PolarHBondContact O-N 3.24Å; L562-A566 WeakPolarHBondContact O-CB 3.34Å; L562-A566 PolarHBondContact O-N 2.81Å
563	R	80.2	Confident	73.6	Confident	160 Å²	160	92.8 Å²	92.8	60%	0.604	48%	0.482	S	S	*	.	H	α-helix	trans	-76.8	-45.6	173.2	177.1	-174.7	-57.5	-75.9	-5	110.4	P559 E560 N561 A566 E567	P559-R563 WeakPolarHBondContact O-CB 3.28Å; P559-R563 PolarHBondContact O-N 3.12Å; P559-R563 VanDerWaalsContact O-N 3.15Å; E560-R563 WeakPolarHBondContact O-CA 3.05Å; E560-R563 VanDerWaalsContact O-CB 3.31Å; E560-R563 WeakPolarHBondContact O-CB 3.37Å; E560-R563 PolarHBondContact O-N 3.43Å; N561-R563 VanDerWaalsContact C-N 3.26Å; N561-R563 PolarHBondContact O-N 3.04Å; R563-A566 CarbonylContact O-C 3.55Å; R563-A566 WeakPolarHBondContact O-CA 3.14Å; R563-A566 WeakPolarHBondContact O-CB 3.44Å; R563-A566 PolarHBondContact O-N 2.99Å; R563-E567 PolarHBondContact O-N 3.02Å
564	D	77.4	Confident	72.9	Confident	84 Å²	84	98.8 Å²	98.8	45%	0.449	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-46.8	179.8	-66.1	-15.3	0	0	0	110.5	E560 N561 A566 E567 D568	E560-D564 PolarHBondContact O-N 3.13Å; N561-D564 PolarHBondContact O-N 2.77Å; D564-A566 PolarHBondContact O-N 2.78Å; D564-A566 VanDerWaalsContact O-N 3.11Å; D564-E567 PolarHBondContact O-N 3.27Å; D564-E567 VanDerWaalsContact O-N 3.09Å; D564-D568 PolarHBondContact O-N 3.48Å
565	E	76	Confident	72.1	Confident	88 Å²	88	103.8 Å²	103.8	41%	0.411	51%	0.506	S	S	.	.	H	α-helix	trans	-61	-22.6	171.6	-69.1	-170.8	-172.4	0	0	113.5	N561 R569	N561-E565 WeakPolarHBondContact O-CB 3.36Å; N561-E565 WeakPolarHBondContact O-CG 3.47Å; N561-E565 PolarHBondContact O-N 3.38Å; E565-R569 VanDerWaalsContact CB-NH1 3.26Å; E565-R569 WeakPolarHBondContact O-CD 3.31Å; E565-R569 WeakPolarHBondContact O-CG 3.38Å; E565-R569 PolarHBondContact O-N 3.48Å; E565-R569 PolarHBondContact O-NH1 2.99Å; E565-R569 IonicContact OE2-CZ 2.62Å; E565-R569 VanDerWaalsContact OE2-CZ 3.3Å; E565-R569 IonicContact OE2-NH1 3.5Å; E565-R569 PolarHBondContact OE2-NH1 3.49Å; E565-R569 IonicContact OE2-NH2 3.47Å; E565-R569 PolarHBondContact OE2-NH2 2.83Å
566	A	76.9	Confident	71.3	Confident	37 Å²	37	104.4 Å²	104.4	31%	0.306	51%	0.512	S	S	.	.	H	α-helix	trans	-84.3	-30.5	176.6	0	0	0	0	0	112.2	L562 R563 D564 K570	L562-A566 WeakPolarHBondContact O-CB 3.34Å; L562-A566 PolarHBondContact O-N 2.81Å; R563-A566 CarbonylContact O-C 3.55Å; R563-A566 WeakPolarHBondContact O-CA 3.14Å; R563-A566 WeakPolarHBondContact O-CB 3.44Å; R563-A566 PolarHBondContact O-N 2.99Å; D564-A566 PolarHBondContact O-N 2.78Å; D564-A566 VanDerWaalsContact O-N 3.11Å; A566-K570 WeakPolarHBondContact O-CD 3.38Å; A566-K570 VanDerWaalsContact O-CG 3.25Å; A566-K570 WeakPolarHBondContact O-CG 3.43Å; A566-K570 PolarHBondContact O-N 3.21Å
567	E	78.3	Confident	70.4	Confident	87 Å²	87	106.7 Å²	106.7	41%	0.407	52%	0.517	S	S	.	.	H	α-helix	trans	-75.2	-39	169.8	-64.5	-53.4	140.7	0	0	111.5	R563 D564 R569 K570 T571	R563-E567 PolarHBondContact O-N 3.02Å; D564-E567 PolarHBondContact O-N 3.27Å; D564-E567 VanDerWaalsContact O-N 3.09Å; E567-R569 PolarHBondContact O-N 2.85Å; E567-K570 CarbonylContact O-C 3.58Å; E567-K570 WeakPolarHBondContact O-CA 3.35Å; E567-K570 WeakPolarHBondContact O-CB 3.34Å; E567-K570 PolarHBondContact O-N 3.21Å; E567-K570 IonicContact OE1-NZ 2.68Å; E567-K570 PolarHBondContact OE1-NZ 3.34Å; E567-K570 WeakPolarHBondContact OE2-CD 3.43Å; E567-K570 IonicContact OE2-NZ 2.68Å; E567-T571 WeakPolarHBondContact O-CG2 3.34Å; E567-T571 PolarHBondContact O-N 3.01Å
568	D	73.8	Confident	69.7	Low	99 Å²	99	106.3 Å²	106.3	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-56.1	-50.2	173.3	-77.4	-16.6	0	0	0	110.8	D564 K570 T571 E572	D564-D568 PolarHBondContact O-N 3.48Å; D568-K570 VanDerWaalsContact C-N 3.27Å; D568-K570 PolarHBondContact O-N 2.93Å; D568-T571 PolarHBondContact O-N 2.93Å; D568-T571 PolarHBondContact O-OG1 2.97Å; D568-E572 WeakPolarHBondContact O-CG 3.37Å; D568-E572 PolarHBondContact O-N 3.35Å
569	R	72.9	Confident	68.6	Low	138 Å²	138	105 Å²	105	52%	0.521	53%	0.527	S	S	.	.	H	α-helix	trans	-58	-34.6	174.7	-72.5	171.7	-170.9	113.2	2.1	113.4	E565 E567 Q573	E565-R569 VanDerWaalsContact CB-NH1 3.26Å; E565-R569 WeakPolarHBondContact O-CD 3.31Å; E565-R569 WeakPolarHBondContact O-CG 3.38Å; E565-R569 PolarHBondContact O-N 3.48Å; E565-R569 PolarHBondContact O-NH1 2.99Å; E565-R569 IonicContact OE2-CZ 2.62Å; E565-R569 VanDerWaalsContact OE2-CZ 3.3Å; E565-R569 IonicContact OE2-NH1 3.5Å; E565-R569 PolarHBondContact OE2-NH1 3.49Å; E565-R569 IonicContact OE2-NH2 3.47Å; E565-R569 PolarHBondContact OE2-NH2 2.83Å; E567-R569 PolarHBondContact O-N 2.85Å; R569-Q573 WeakPolarHBondContact O-CB 3.47Å; R569-Q573 PolarHBondContact O-N 3.08Å
570	K	73.3	Confident	67.4	Low	100 Å²	100	105.4 Å²	105.4	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-73.3	-36	175.3	-70.2	165.7	-167	173	0	112.3	A566 E567 D568 Q573 R574	A566-K570 WeakPolarHBondContact O-CD 3.38Å; A566-K570 VanDerWaalsContact O-CG 3.25Å; A566-K570 WeakPolarHBondContact O-CG 3.43Å; A566-K570 PolarHBondContact O-N 3.21Å; E567-K570 CarbonylContact O-C 3.58Å; E567-K570 WeakPolarHBondContact O-CA 3.35Å; E567-K570 WeakPolarHBondContact O-CB 3.34Å; E567-K570 PolarHBondContact O-N 3.21Å; E567-K570 IonicContact OE1-NZ 2.68Å; E567-K570 PolarHBondContact OE1-NZ 3.34Å; E567-K570 WeakPolarHBondContact OE2-CD 3.43Å; E567-K570 IonicContact OE2-NZ 2.68Å; D568-K570 VanDerWaalsContact C-N 3.27Å; D568-K570 PolarHBondContact O-N 2.93Å; K570-Q573 PolarHBondContact O-N 3.39Å; K570-R574 WeakPolarHBondContact O-CG 3.49Å; K570-R574 PolarHBondContact O-N 2.88Å
571	T	70.1	Confident	66.4	Low	65 Å²	65	108.9 Å²	108.9	40%	0.399	55%	0.549	S	S	.	.	H	α-helix	trans	-70.1	-43.7	176.1	63.9	0	0	0	0	110.8	E567 D568 Q573 R574 F575	E567-T571 WeakPolarHBondContact O-CG2 3.34Å; E567-T571 PolarHBondContact O-N 3.01Å; D568-T571 PolarHBondContact O-N 2.93Å; D568-T571 PolarHBondContact O-OG1 2.97Å; T571-Q573 VanDerWaalsContact C-N 3.3Å; T571-Q573 PolarHBondContact O-N 3.27Å; T571-R574 PolarHBondContact O-N 3.35Å; T571-R574 VanDerWaalsContact O-N 3.14Å; T571-F575 VanDerWaalsContact O-CD2 3.28Å; T571-F575 WeakPolarHBondContact O-CD2 3.37Å; T571-F575 PolarHBondContact O-N 3.2Å
572	E	66.8	Low	65.3	Low	139 Å²	139	110 Å²	110	65%	0.65	56%	0.562	S	S	*	*	H	α-helix	trans	-54.3	-45	170	-72	-175.2	147.4	0	0	111.6	D568 R574 F575 G576	D568-E572 WeakPolarHBondContact O-CG 3.37Å; D568-E572 PolarHBondContact O-N 3.35Å; E572-R574 PolarHBondContact O-N 3.37Å; E572-F575 PolarHBondContact O-N 2.88Å; E572-G576 PolarHBondContact O-N 3.47Å
573	Q	63.1	Low	63.7	Low	126 Å²	126	111.7 Å²	111.7	59%	0.589	58%	0.576	S	S	*	*	H	α-helix	trans	-61.5	-43.6	176.3	-172.1	173.3	7.6	0	0	112.5	R569 K570 T571 F575 G576 E577	R569-Q573 WeakPolarHBondContact O-CB 3.47Å; R569-Q573 PolarHBondContact O-N 3.08Å; K570-Q573 PolarHBondContact O-N 3.39Å; T571-Q573 VanDerWaalsContact C-N 3.3Å; T571-Q573 PolarHBondContact O-N 3.27Å; Q573-F575 PolarHBondContact O-N 3.43Å; Q573-G576 PolarHBondContact O-N 3.04Å; Q573-E577 PolarHBondContact O-N 3.31Å
574	R	64.8	Low	62.3	Low	175 Å²	175	111.4 Å²	111.4	66%	0.66	59%	0.587	S	S	*	*	H	α-helix	trans	-65.3	-35	174.5	-74.4	-178.1	-178.3	-177.8	3.8	112.9	K570 T571 E572 G576 N578	K570-R574 WeakPolarHBondContact O-CG 3.49Å; K570-R574 PolarHBondContact O-N 2.88Å; T571-R574 PolarHBondContact O-N 3.35Å; T571-R574 VanDerWaalsContact O-N 3.14Å; E572-R574 PolarHBondContact O-N 3.37Å; R574-G576 VanDerWaalsContact C-N 3.35Å; R574-N578 WeakPolarHBondContact O-CB 3.34Å; R574-N578 PolarHBondContact O-N 2.78Å; R574-N578 VanDerWaalsContact O-N 3.14Å; R574-N578 PolarHBondContact O-ND2 2.95Å
575	F	55.8	Low	60.6	Low	159 Å²	159	114.6 Å²	114.6	70%	0.697	60%	0.604	S	S	*	*	H	α-helix	trans	-67.2	-37.7	173.2	-86.5	-73.4	0	0	0	111.4	T571 E572 Q573 N578 A579	T571-F575 VanDerWaalsContact O-CD2 3.28Å; T571-F575 WeakPolarHBondContact O-CD2 3.37Å; T571-F575 PolarHBondContact O-N 3.2Å; E572-F575 PolarHBondContact O-N 2.88Å; Q573-F575 PolarHBondContact O-N 3.43Å; F575-N578 PolarHBondContact O-N 2.92Å; F575-A579 PolarHBondContact O-N 3.46Å
576	G	58.7	Low	59.6	Low	49 Å²	49	112.8 Å²	112.8	51%	0.505	61%	0.608	S	S	.	*	H	α-helix	trans	-61.7	-45.2	172.4	0	0	0	0	0	113.7	E572 Q573 R574 A579	E572-G576 PolarHBondContact O-N 3.47Å; Q573-G576 PolarHBondContact O-N 3.04Å; R574-G576 VanDerWaalsContact C-N 3.35Å; G576-A579 PolarHBondContact O-N 3.23Å
577	E	55.3	Low	58.4	Low	133 Å²	133	119.5 Å²	119.5	62%	0.621	63%	0.633	S	S	*	*	H	α-helix	trans	-65.4	-37.8	177.4	-73.3	-178.7	143.5	0	0	112.7	Q573 A579 A580	Q573-E577 PolarHBondContact O-N 3.31Å; E577-A579 VanDerWaalsContact C-N 3.28Å; E577-A579 PolarHBondContact O-N 2.89Å; E577-A580 WeakPolarHBondContact O-CB 3.44Å; E577-A580 PolarHBondContact O-N 3.13Å
578	N	53.1	Low	57.3	Low	115 Å²	115	122.4 Å²	122.4	62%	0.615	65%	0.65	S	S	*	*	H	α-helix	trans	-71.6	-20.8	179.3	-76.1	-54.4	0	0	0	113.7	R574 F575 A580	R574-N578 WeakPolarHBondContact O-CB 3.34Å; R574-N578 PolarHBondContact O-N 2.78Å; R574-N578 VanDerWaalsContact O-N 3.14Å; R574-N578 PolarHBondContact O-ND2 2.95Å; F575-N578 PolarHBondContact O-N 2.92Å; N578-A580 VanDerWaalsContact C-N 3.3Å
579	A	52.1	Low	56.4	Low	83 Å²	83	121.8 Å²	121.8	69%	0.686	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-11.8	174.7	0	0	0	0	0	113.6	F575 G576 E577 K581	F575-A579 PolarHBondContact O-N 3.46Å; G576-A579 PolarHBondContact O-N 3.23Å; E577-A579 VanDerWaalsContact C-N 3.28Å; E577-A579 PolarHBondContact O-N 2.89Å; A579-K581 PolarHBondContact O-N 3.46Å; A579-K581 VanDerWaalsContact O-N 3.17Å
580	A	46.4	Very low	55.6	Low	80 Å²	80	118.8 Å²	118.8	66%	0.661	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	17.6	-176.1	0	0	0	0	0	115	E577 N578 P582	E577-A580 WeakPolarHBondContact O-CB 3.44Å; E577-A580 PolarHBondContact O-N 3.13Å; N578-A580 VanDerWaalsContact C-N 3.3Å; A580-P582 WeakPolarHBondContact O-CD 3.32Å
581	K	51.8	Low	54.9	Low	171 Å²	171	118.1 Å²	118.1	74%	0.743	66%	0.658	S	S	*	*			trans	-97.2	104.7	171.3	-75.5	179.9	179.2	172.2	0	110	A579 V583	A579-K581 PolarHBondContact O-N 3.46Å; A579-K581 VanDerWaalsContact O-N 3.17Å; K581-V583 PolarHBondContact O-N 2.9Å; K581-V583 VanDerWaalsContact O-N 3.15Å
582	P	47.4	Very low	54.4	Low	119 Å²	119	120.5 Å²	120.5	77%	0.773	67%	0.668	S	S	*	*			trans	-74.8	107	-179.4	29.9	-33.8	0	0	0	110.8	A580	A580-P582 WeakPolarHBondContact O-CD 3.32Å
583	V	43.8	Very low	54.5	Low	138 Å²	138	117.3 Å²	117.3	84%	0.836	66%	0.658	S	S	*	*			trans	-87.7	103.7	157.3	177.7	0	0	0	0	106.8	K581 D585	K581-V583 PolarHBondContact O-N 2.9Å; K581-V583 VanDerWaalsContact O-N 3.15Å; V583-D585 PolarHBondContact O-N 2.91Å
584	N	51.2	Low	55.1	Low	154 Å²	154	120.3 Å²	120.3	82%	0.824	66%	0.664	S	S	*	*			trans	-71.9	121.3	169.4	-90.7	-23.2	0	0	0	109
585	D	41.6	Very low	55.8	Low	152 Å²	152	114.8 Å²	114.8	81%	0.813	65%	0.651	S	S	*	*			trans	-144.7	150.9	152.7	-143.5	-15.1	0	0	0	111.5	V583	V583-D585 PolarHBondContact O-N 2.91Å
586	G	55.6	Low	57	Low	49 Å²	49	111 Å²	111	51%	0.505	64%	0.637	S	S	.	*			trans	-82.9	144	-150.6	0	0	0	0	0	118.3	I588	G586-I588 VanDerWaalsContact C-N 3.33Å; G586-I588 PolarHBondContact O-N 2.86Å
587	E	51.8	Low	58.3	Low	178 Å²	178	113.8 Å²	113.8	83%	0.832	64%	0.64	S	S	*	*	S	Bend	trans	60	-30.6	149.2	-66.1	-172.1	121.2	0	0	121.9	T589 S590	E587-T589 VanDerWaalsContact C-N 3.29Å; E587-T589 PolarHBondContact O-N 2.93Å; E587-S590 PolarHBondContact O-OG 3.16Å
588	I	53.6	Low	59.8	Low	149 Å²	149	115 Å²	115	76%	0.764	64%	0.643	S	S	*	*	S	Bend	trans	-68.8	-31.8	178.3	-59.6	178.9	0	0	0	111.3	G586 S590 S591	G586-I588 VanDerWaalsContact C-N 3.33Å; G586-I588 PolarHBondContact O-N 2.86Å; I588-S590 VanDerWaalsContact C-N 3.34Å; I588-S590 PolarHBondContact O-N 2.99Å; I588-S591 PolarHBondContact O-OG 3.4Å
589	T	55.2	Low	61.5	Low	86 Å²	86	115.7 Å²	115.7	53%	0.528	64%	0.643	S	S	.	*	H	α-helix	trans	-61	-34.5	-178	44.1	0	0	0	0	114	E587 S591 L592 T593	E587-T589 VanDerWaalsContact C-N 3.29Å; E587-T589 PolarHBondContact O-N 2.93Å; T589-S591 PolarHBondContact O-N 3.31Å; T589-L592 PolarHBondContact O-N 2.91Å; T589-T593 VanDerWaalsContact O-CB 3.27Å; T589-T593 WeakPolarHBondContact O-CB 3.42Å; T589-T593 PolarHBondContact O-N 3.35Å; T589-T593 PolarHBondContact O-OG1 2.7Å
590	S	55.7	Low	63.2	Low	75 Å²	75	116.9 Å²	116.9	52%	0.524	64%	0.637	S	S	.	*	H	α-helix	trans	-59.1	-28.5	-170.2	68.3	0	0	0	0	115.2	E587 I588	E587-S590 PolarHBondContact O-OG 3.16Å; I588-S590 VanDerWaalsContact C-N 3.34Å; I588-S590 PolarHBondContact O-N 2.99Å
591	S	59	Low	65.3	Low	85 Å²	85	119.1 Å²	119.1	59%	0.594	63%	0.634	S	S	*	*	H	α-helix	trans	-82.7	-42.4	-179.7	65.7	0	0	0	0	112.8	I588 T589 P595	I588-S591 PolarHBondContact O-OG 3.4Å; T589-S591 PolarHBondContact O-N 3.31Å; S591-P595 WeakPolarHBondContact O-CD 3.31Å
592	L	59.7	Low	67.1	Low	116 Å²	116	113.9 Å²	113.9	61%	0.607	62%	0.622	S	S	*	*	H	α-helix	trans	-81.3	-30.9	-179	-168.7	70.4	0	0	0	112.6	T589 R594 P595 I596	T589-L592 PolarHBondContact O-N 2.91Å; L592-R594 VanDerWaalsContact C-N 3.3Å; L592-R594 PolarHBondContact O-N 3.23Å; L592-P595 WeakPolarHBondContact O-CD 3.49Å; L592-P595 VanDerWaalsContact O-CG 3.25Å; L592-P595 WeakPolarHBondContact O-CG 3.34Å; L592-I596 HydrophobicContact CD2-CD1 4.49Å; L592-I596 HydrophobicContact CG-CD1 4.05Å; L592-I596 WeakPolarHBondContact O-CD1 3.45Å; L592-I596 WeakPolarHBondContact O-CG1 3.43Å
593	T	69.2	Low	69.1	Low	72 Å²	72	112.5 Å²	112.5	44%	0.442	61%	0.611	S	S	.	*	H	α-helix	trans	-67.8	-28.1	178.5	-61.4	0	0	0	0	112.5	T589 I596 L597	T589-T593 VanDerWaalsContact O-CB 3.27Å; T589-T593 WeakPolarHBondContact O-CB 3.42Å; T589-T593 PolarHBondContact O-N 3.35Å; T589-T593 PolarHBondContact O-OG1 2.7Å; T593-I596 PolarHBondContact O-N 2.93Å; T593-L597 WeakPolarHBondContact O-CB 3.41Å; T593-L597 PolarHBondContact O-N 3.45Å
594	R	75.6	Confident	71.5	Confident	189 Å²	189	109.9 Å²	109.9	71%	0.713	59%	0.592	S	S	*	*	H	α-helix	trans	-63.2	-50.5	177.7	-78.1	-179.5	-176.6	165.6	4.3	114.6	L592 L597 K598	L592-R594 VanDerWaalsContact C-N 3.3Å; L592-R594 PolarHBondContact O-N 3.23Å; R594-L597 PolarHBondContact O-N 3.34Å; R594-K598 WeakPolarHBondContact O-CG 3.48Å; R594-K598 PolarHBondContact O-N 3.37Å
595	P	80.1	Confident	73.5	Confident	59 Å²	59	107.1 Å²	107.1	38%	0.383	57%	0.574	S	S	.	*	H	α-helix	trans	-64.1	-40.8	174.3	21.4	-30.7	0	0	0	112	S591 L592 L597 K598 E599	S591-P595 WeakPolarHBondContact O-CD 3.31Å; L592-P595 WeakPolarHBondContact O-CD 3.49Å; L592-P595 VanDerWaalsContact O-CG 3.25Å; L592-P595 WeakPolarHBondContact O-CG 3.34Å; P595-L597 VanDerWaalsContact C-N 3.33Å; P595-L597 PolarHBondContact O-N 3.43Å; P595-K598 WeakPolarHBondContact O-CB 3.04Å; P595-K598 PolarHBondContact O-N 3.15Å; P595-K598 VanDerWaalsContact O-N 3.08Å; P595-E599 PolarHBondContact O-N 3.1Å
596	I	81	Confident	76	Confident	78 Å²	78	108.9 Å²	108.9	40%	0.4	57%	0.569	S	S	.	*	H	α-helix	trans	-58.5	-43.4	176.6	-64.3	169.3	0	0	0	111.3	L592 T593 K598 E599 L600	L592-I596 HydrophobicContact CD2-CD1 4.49Å; L592-I596 HydrophobicContact CG-CD1 4.05Å; L592-I596 WeakPolarHBondContact O-CD1 3.45Å; L592-I596 WeakPolarHBondContact O-CG1 3.43Å; T593-I596 PolarHBondContact O-N 2.93Å; I596-K598 VanDerWaalsContact C-N 3.32Å; I596-K598 PolarHBondContact O-N 3.44Å; I596-E599 PolarHBondContact O-N 2.76Å; I596-L600 HydrophobicContact CG2-CD1 4.05Å; I596-L600 HydrophobicContact CG2-CG 4.49Å; I596-L600 WeakPolarHBondContact O-CB 3.39Å; I596-L600 WeakPolarHBondContact O-CG 3.45Å; I596-L600 PolarHBondContact O-N 2.79Å
597	L	84.4	Confident	77.8	Confident	109 Å²	109	110.5 Å²	110.5	57%	0.571	56%	0.564	S	S	*	*	H	α-helix	trans	-63.6	-37.1	177.2	-156.2	84.8	0	0	0	112.2	T593 R594 P595 Q601	T593-L597 WeakPolarHBondContact O-CB 3.41Å; T593-L597 PolarHBondContact O-N 3.45Å; R594-L597 PolarHBondContact O-N 3.34Å; P595-L597 VanDerWaalsContact C-N 3.33Å; P595-L597 PolarHBondContact O-N 3.43Å; L597-Q601 WeakPolarHBondContact O-CB 3.38Å; L597-Q601 PolarHBondContact O-N 2.89Å
598	K	87.7	Confident	79.9	Confident	157 Å²	157	105.2 Å²	105.2	68%	0.683	54%	0.539	S	S	*	.	H	α-helix	trans	-68.5	-40.1	175.3	-71.7	178.1	177.6	-175.2	0	112	R594 P595 I596 Q601 A602	R594-K598 WeakPolarHBondContact O-CG 3.48Å; R594-K598 PolarHBondContact O-N 3.37Å; P595-K598 WeakPolarHBondContact O-CB 3.04Å; P595-K598 PolarHBondContact O-N 3.15Å; P595-K598 VanDerWaalsContact O-N 3.08Å; I596-K598 VanDerWaalsContact C-N 3.32Å; I596-K598 PolarHBondContact O-N 3.44Å; K598-Q601 PolarHBondContact O-N 3.41Å; K598-A602 WeakPolarHBondContact O-CB 3.34Å; K598-A602 PolarHBondContact O-N 3.08Å
599	E	88.4	Confident	81.8	Confident	131 Å²	131	100.2 Å²	100.2	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-65.4	-45.5	175.2	-73.7	-178.4	174.4	0	0	111.3	P595 I596 Q601 A602 V603	P595-E599 PolarHBondContact O-N 3.1Å; I596-E599 PolarHBondContact O-N 2.76Å; E599-Q601 VanDerWaalsContact C-N 3.3Å; E599-Q601 PolarHBondContact O-N 2.89Å; E599-A602 CarbonylContact O-C 3.49Å; E599-A602 WeakPolarHBondContact O-CB 3.47Å; E599-A602 PolarHBondContact O-N 3.28Å; E599-A602 VanDerWaalsContact O-N 3.11Å; E599-V603 WeakPolarHBondContact O-CG2 3.44Å; E599-V603 PolarHBondContact O-N 2.93Å
600	L	87.4	Confident	83.6	Confident	108 Å²	108	100 Å²	100	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-57.8	-42.2	173.2	-74.8	169.3	0	0	0	111.9	I596 V603 L604	I596-L600 HydrophobicContact CG2-CD1 4.05Å; I596-L600 HydrophobicContact CG2-CG 4.49Å; I596-L600 WeakPolarHBondContact O-CB 3.39Å; I596-L600 WeakPolarHBondContact O-CG 3.45Å; I596-L600 PolarHBondContact O-N 2.79Å; L600-V603 PolarHBondContact O-N 3.14Å; L600-L604 WeakPolarHBondContact O-CB 3.36Å; L600-L604 PolarHBondContact O-N 3.4Å
601	Q	91.5	Very high	85.6	Confident	127 Å²	127	102.3 Å²	102.3	59%	0.593	52%	0.516	S	S	*	.	H	α-helix	trans	-66.2	-37	175.7	-171.3	165.3	2.3	0	0	112.4	L597 K598 E599 Q605	L597-Q601 WeakPolarHBondContact O-CB 3.38Å; L597-Q601 PolarHBondContact O-N 2.89Å; K598-Q601 PolarHBondContact O-N 3.41Å; E599-Q601 VanDerWaalsContact C-N 3.3Å; E599-Q601 PolarHBondContact O-N 2.89Å; Q601-Q605 VanDerWaalsContact O-CG 3.31Å; Q601-Q605 WeakPolarHBondContact O-CG 3.43Å; Q601-Q605 PolarHBondContact O-N 3.46Å
602	A	89.4	Confident	87.3	Confident	60 Å²	60	104.7 Å²	104.7	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-68	-39.5	174	0	0	0	0	0	112.5	K598 E599 Q605 R606	K598-A602 WeakPolarHBondContact O-CB 3.34Å; K598-A602 PolarHBondContact O-N 3.08Å; E599-A602 CarbonylContact O-C 3.49Å; E599-A602 WeakPolarHBondContact O-CB 3.47Å; E599-A602 PolarHBondContact O-N 3.28Å; E599-A602 VanDerWaalsContact O-N 3.11Å; A602-Q605 PolarHBondContact O-N 2.84Å; A602-R606 WeakPolarHBondContact O-CB 3.48Å; A602-R606 PolarHBondContact O-N 3.41Å
603	V	89.8	Confident	89	Confident	91 Å²	91	106.9 Å²	106.9	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-62.4	-46.3	173.9	169.7	0	0	0	0	110.5	E599 L600 Q605 R606 E607	E599-V603 WeakPolarHBondContact O-CG2 3.44Å; E599-V603 PolarHBondContact O-N 2.93Å; L600-V603 PolarHBondContact O-N 3.14Å; V603-Q605 PolarHBondContact O-N 3.45Å; V603-R606 CarbonylContact O-C 3.59Å; V603-R606 WeakPolarHBondContact O-CB 3.28Å; V603-R606 PolarHBondContact O-N 2.83Å; V603-R606 VanDerWaalsContact O-N 3.15Å; V603-E607 WeakPolarHBondContact O-CB 3.35Å; V603-E607 PolarHBondContact O-N 3.49Å
604	L	94.4	Very high	90.3	Very high	83 Å²	83	109.1 Å²	109.1	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-64.9	-37.5	178.6	-167.8	151.2	0	0	0	112	L600 E607 Q608	L600-L604 WeakPolarHBondContact O-CB 3.36Å; L600-L604 PolarHBondContact O-N 3.4Å; L604-E607 PolarHBondContact O-N 2.72Å; L604-Q608 HydrophobicContact CD2-CG 4.35Å; L604-Q608 WeakPolarHBondContact O-CG 3.45Å; L604-Q608 PolarHBondContact O-N 2.97Å
605	Q	93.1	Very high	91.1	Very high	95 Å²	95	102.3 Å²	102.3	44%	0.444	51%	0.505	S	S	.	.	H	α-helix	trans	-66.2	-39.6	171.8	-71.9	-62.6	-26.8	0	0	112.6	Q601 A602 V603 Q608 A609	Q601-Q605 VanDerWaalsContact O-CG 3.31Å; Q601-Q605 WeakPolarHBondContact O-CG 3.43Å; Q601-Q605 PolarHBondContact O-N 3.46Å; A602-Q605 PolarHBondContact O-N 2.84Å; V603-Q605 PolarHBondContact O-N 3.45Å; Q605-Q608 PolarHBondContact O-N 3.16Å; Q605-A609 WeakPolarHBondContact O-CB 3.33Å; Q605-A609 PolarHBondContact O-N 2.92Å
606	R	93.9	Very high	91.8	Very high	189 Å²	189	105.3 Å²	105.3	71%	0.713	52%	0.515	S	S	*	.	H	α-helix	trans	-64.7	-41.4	174.2	-178.5	177	178.4	159.7	-1.1	111.7	A602 V603 A609 L610	A602-R606 WeakPolarHBondContact O-CB 3.48Å; A602-R606 PolarHBondContact O-N 3.41Å; V603-R606 CarbonylContact O-C 3.59Å; V603-R606 WeakPolarHBondContact O-CB 3.28Å; V603-R606 PolarHBondContact O-N 2.83Å; V603-R606 VanDerWaalsContact O-N 3.15Å; R606-A609 PolarHBondContact O-N 3.24Å; R606-L610 HydrophobicContact CG-CD1 4.32Å; R606-L610 WeakPolarHBondContact O-CG 3.49Å; R606-L610 PolarHBondContact O-N 3.05Å
607	E	93.6	Very high	92.5	Very high	84 Å²	84	106.2 Å²	106.2	39%	0.393	52%	0.524	S	S	.	.	H	α-helix	trans	-61.7	-47.9	175.1	-168.9	-153.1	161.3	0	0	111	V603 L604 A609 L610 K611	V603-E607 WeakPolarHBondContact O-CB 3.35Å; V603-E607 PolarHBondContact O-N 3.49Å; L604-E607 PolarHBondContact O-N 2.72Å; E607-A609 VanDerWaalsContact C-N 3.32Å; E607-A609 PolarHBondContact O-N 3.44Å; E607-L610 PolarHBondContact O-N 3.45Å; E607-L610 VanDerWaalsContact O-N 3.16Å; E607-K611 WeakPolarHBondContact O-CG 3.42Å; E607-K611 PolarHBondContact O-N 3.35Å; E607-K611 WeakPolarHBondContact OE1-CE 3.4Å; E607-K611 IonicContact OE1-NZ 3.61Å; E607-K611 PolarHBondContact OE1-NZ 3.41Å
608	Q	95.1	Very high	93	Very high	67 Å²	67	106.2 Å²	106.2	31%	0.313	52%	0.521	S	S	.	.	H	α-helix	trans	-60.4	-39.9	173.9	-72	-175.2	12.3	0	0	112.3	L604 Q605 L610 K611 R612	L604-Q608 HydrophobicContact CD2-CG 4.35Å; L604-Q608 WeakPolarHBondContact O-CG 3.45Å; L604-Q608 PolarHBondContact O-N 2.97Å; Q605-Q608 PolarHBondContact O-N 3.16Å; Q608-L610 VanDerWaalsContact C-N 3.35Å; Q608-K611 PolarHBondContact O-N 3.47Å; Q608-R612 WeakPolarHBondContact O-CG 3.46Å; Q608-R612 PolarHBondContact O-N 2.99Å
609	A	92.6	Very high	93.2	Very high	44 Å²	44	103.5 Å²	103.5	36%	0.364	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-38.3	175.1	0	0	0	0	0	112.2	Q605 R606 E607 R613	Q605-A609 WeakPolarHBondContact O-CB 3.33Å; Q605-A609 PolarHBondContact O-N 2.92Å; R606-A609 PolarHBondContact O-N 3.24Å; E607-A609 VanDerWaalsContact C-N 3.32Å; E607-A609 PolarHBondContact O-N 3.44Å; A609-R613 WeakPolarHBondContact O-CG 3.41Å; A609-R613 PolarHBondContact O-N 2.84Å
610	L	94.9	Very high	93.4	Very high	81 Å²	81	101 Å²	101	42%	0.424	51%	0.511	S	S	.	.	H	α-helix	trans	-67.4	-43.1	173.8	-71.9	169.8	0	0	0	111.9	R606 E607 Q608 R612 R613 L614	R606-L610 HydrophobicContact CG-CD1 4.32Å; R606-L610 WeakPolarHBondContact O-CG 3.49Å; R606-L610 PolarHBondContact O-N 3.05Å; E607-L610 PolarHBondContact O-N 3.45Å; E607-L610 VanDerWaalsContact O-N 3.16Å; Q608-L610 VanDerWaalsContact C-N 3.35Å; L610-R612 PolarHBondContact O-N 2.81Å; L610-R613 PolarHBondContact O-N 3.06Å; L610-R613 VanDerWaalsContact O-N 3.14Å; L610-L614 PolarHBondContact O-N 3.43Å
611	K	95.9	Very high	93.6	Very high	124 Å²	124	100.7 Å²	100.7	54%	0.539	51%	0.509	S	S	.	.	H	α-helix	trans	-58.8	-44	174.1	-73.6	179.5	-178.6	173.5	0	112	E607 Q608 R613 L614 A615	E607-K611 WeakPolarHBondContact O-CG 3.42Å; E607-K611 PolarHBondContact O-N 3.35Å; E607-K611 WeakPolarHBondContact OE1-CE 3.4Å; E607-K611 IonicContact OE1-NZ 3.61Å; E607-K611 PolarHBondContact OE1-NZ 3.41Å; Q608-K611 PolarHBondContact O-N 3.47Å; K611-R613 PolarHBondContact O-N 2.87Å; K611-L614 PolarHBondContact O-N 3.24Å; K611-A615 PolarHBondContact O-N 3.5Å
612	R	96	Very high	93.4	Very high	135 Å²	135	98 Å²	98	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-41	173.7	-68.9	175	-162.3	109.1	4.5	112.1	Q608 L610 A615 M616	Q608-R612 WeakPolarHBondContact O-CG 3.46Å; Q608-R612 PolarHBondContact O-N 2.99Å; L610-R612 PolarHBondContact O-N 2.81Å; R612-A615 PolarHBondContact O-N 2.96Å; R612-M616 WeakPolarHBondContact O-CG 3.49Å; R612-M616 PolarHBondContact O-N 3.34Å; R612-M616 VanDerWaalsContact O-N 3.08Å
613	R	95.3	Very high	93.3	Very high	161 Å²	161	98.1 Å²	98.1	61%	0.608	50%	0.496	S	S	*	.	H	α-helix	trans	-66.9	-41.1	176.2	-73.5	175.1	66.5	-171.7	0	112.6	A609 L610 K611 M616 V617	A609-R613 WeakPolarHBondContact O-CG 3.41Å; A609-R613 PolarHBondContact O-N 2.84Å; L610-R613 PolarHBondContact O-N 3.06Å; L610-R613 VanDerWaalsContact O-N 3.14Å; K611-R613 PolarHBondContact O-N 2.87Å; R613-M616 HydrophobicContact CG-CE 4.08Å; R613-M616 PolarHBondContact O-N 2.87Å; R613-V617 WeakPolarHBondContact O-CG2 3.38Å; R613-V617 PolarHBondContact O-N 3.09Å
614	L	95.8	Very high	93	Very high	120 Å²	120	96.6 Å²	96.6	63%	0.628	49%	0.493	S	S	*	.	H	α-helix	trans	-62.9	-43.1	175.1	-77.4	168.2	0	0	0	111.6	L610 K611 V617 H618	L610-L614 PolarHBondContact O-N 3.43Å; K611-L614 PolarHBondContact O-N 3.24Å; L614-V617 PolarHBondContact O-N 3.29Å; L614-H618 WeakPolarHBondContact O-CB 3.43Å; L614-H618 PolarHBondContact O-N 2.99Å
615	A	93.8	Very high	92.5	Very high	45 Å²	45	96.8 Å²	96.8	37%	0.372	49%	0.494	S	S	.	.	H	α-helix	trans	-58	-49.2	173.5	0	0	0	0	0	111.7	K611 R612 V617 H618 D619	K611-A615 PolarHBondContact O-N 3.5Å; R612-A615 PolarHBondContact O-N 2.96Å; A615-V617 VanDerWaalsContact C-N 3.33Å; A615-V617 PolarHBondContact O-N 3.17Å; A615-H618 WeakPolarHBondContact O-CB 3.37Å; A615-H618 PolarHBondContact O-N 3.1Å; A615-D619 WeakPolarHBondContact O-CB 3.32Å; A615-D619 VanDerWaalsContact O-CG 3.24Å; A615-D619 PolarHBondContact O-N 3.26Å
616	M	94	Very high	92	Very high	122 Å²	122	95.2 Å²	95.2	60%	0.601	50%	0.498	S	S	*	.	H	α-helix	trans	-60.7	-37.8	176.5	-69.5	-173.2	-61.3	0	0	113.3	R612 R613 S620	R612-M616 WeakPolarHBondContact O-CG 3.49Å; R612-M616 PolarHBondContact O-N 3.34Å; R612-M616 VanDerWaalsContact O-N 3.08Å; R613-M616 HydrophobicContact CG-CE 4.08Å; R613-M616 PolarHBondContact O-N 2.87Å; M616-S620 WeakPolarHBondContact O-CB 3.19Å; M616-S620 PolarHBondContact O-N 2.98Å
617	V	95.3	Very high	91.3	Very high	98 Å²	98	91.6 Å²	91.6	59%	0.594	49%	0.492	S	S	*	.	H	α-helix	trans	-68	-42.1	175.9	169.7	0	0	0	0	111.2	R613 L614 A615 S620 L621	R613-V617 WeakPolarHBondContact O-CG2 3.38Å; R613-V617 PolarHBondContact O-N 3.09Å; L614-V617 PolarHBondContact O-N 3.29Å; A615-V617 VanDerWaalsContact C-N 3.33Å; A615-V617 PolarHBondContact O-N 3.17Å; V617-S620 PolarHBondContact O-N 2.94Å; V617-L621 WeakPolarHBondContact O-CB 3.25Å; V617-L621 PolarHBondContact O-N 3.02Å
618	H	94.3	Very high	90.5	Very high	109 Å²	109	88.8 Å²	88.8	51%	0.505	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-46.2	176.1	175.5	-99.7	0	0	0	111.7	L614 A615 L621 N622	L614-H618 WeakPolarHBondContact O-CB 3.43Å; L614-H618 PolarHBondContact O-N 2.99Å; A615-H618 WeakPolarHBondContact O-CB 3.37Å; A615-H618 PolarHBondContact O-N 3.1Å; H618-L621 PolarHBondContact O-N 3.42Å; H618-N622 PolarHBondContact CE1-ND2 3.5Å; H618-N622 PolarHBondContact ND1-ND2 2.79Å; H618-N622 PolarHBondContact NE2-ND2 3.49Å; H618-N622 WeakPolarHBondContact O-CB 3.38Å; H618-N622 PolarHBondContact O-N 2.98Å; H618-N622 PolarHBondContact O-ND2 2.92Å; H618-N622 VanDerWaalsContact O-ND2 3.13Å
619	D	92.4	Very high	89.7	Confident	99 Å²	99	88.1 Å²	88.1	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-67.2	-38.2	178.3	-63.3	-17.9	0	0	0	111.6	A615 N622 S623	A615-D619 WeakPolarHBondContact O-CB 3.32Å; A615-D619 VanDerWaalsContact O-CG 3.24Å; A615-D619 PolarHBondContact O-N 3.26Å; D619-N622 PolarHBondContact O-N 3.23Å; D619-S623 WeakPolarHBondContact O-CB 3.49Å; D619-S623 PolarHBondContact O-N 3.28Å
620	S	92.9	Very high	89	Confident	80 Å²	80	89.3 Å²	89.3	56%	0.559	50%	0.496	S	S	*	.	H	α-helix	trans	-63.4	-39.8	172	-174.3	0	0	0	0	112.4	M616 V617 A624	M616-S620 WeakPolarHBondContact O-CB 3.19Å; M616-S620 PolarHBondContact O-N 2.98Å; V617-S620 PolarHBondContact O-N 2.94Å; S620-A624 WeakPolarHBondContact O-CB 3.16Å; S620-A624 PolarHBondContact O-N 2.9Å
621	L	91.3	Very high	88.5	Confident	100 Å²	100	91.8 Å²	91.8	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-67.8	-43.4	177.4	-179	64.2	0	0	0	111.1	V617 H618 A624 L625	V617-L621 WeakPolarHBondContact O-CB 3.25Å; V617-L621 PolarHBondContact O-N 3.02Å; H618-L621 PolarHBondContact O-N 3.42Å; L621-A624 PolarHBondContact O-N 3.36Å; L621-L625 HydrophobicContact CD1-CD1 4.49Å; L621-L625 HydrophobicContact CG-CD1 4.11Å; L621-L625 WeakPolarHBondContact O-CB 3.37Å; L621-L625 WeakPolarHBondContact O-CG 3.44Å; L621-L625 PolarHBondContact O-N 2.8Å
622	N	88.6	Confident	87.7	Confident	71 Å²	71	93.8 Å²	93.8	38%	0.38	51%	0.509	S	S	.	.	H	α-helix	trans	-64.5	-39.7	176.1	-72.4	-35.7	0	0	0	111.9	H618 D619 L625 A626	H618-N622 PolarHBondContact CE1-ND2 3.5Å; H618-N622 PolarHBondContact ND1-ND2 2.79Å; H618-N622 PolarHBondContact NE2-ND2 3.49Å; H618-N622 WeakPolarHBondContact O-CB 3.38Å; H618-N622 PolarHBondContact O-N 2.98Å; H618-N622 PolarHBondContact O-ND2 2.92Å; H618-N622 VanDerWaalsContact O-ND2 3.13Å; D619-N622 PolarHBondContact O-N 3.23Å; N622-L625 PolarHBondContact O-N 2.9Å; N622-A626 WeakPolarHBondContact O-CB 3.45Å; N622-A626 PolarHBondContact O-N 3.08Å
623	S	85.8	Confident	87.3	Confident	63 Å²	63	93.7 Å²	93.7	44%	0.441	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-45.9	171.9	-173.2	0	0	0	0	111.6	D619 L625 A626 N627	D619-S623 WeakPolarHBondContact O-CB 3.49Å; D619-S623 PolarHBondContact O-N 3.28Å; S623-L625 PolarHBondContact O-N 3.36Å; S623-A626 PolarHBondContact O-N 2.89Å; S623-N627 WeakPolarHBondContact O-CB 3.4Å; S623-N627 PolarHBondContact O-N 2.95Å; S623-N627 PolarHBondContact O-ND2 3.28Å; S623-N627 VanDerWaalsContact O-ND2 3.12Å
624	A	84.4	Confident	87	Confident	59 Å²	59	89.8 Å²	89.8	49%	0.488	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-40.4	176.6	0	0	0	0	0	112.8	S620 L621 N627 G628	S620-A624 WeakPolarHBondContact O-CB 3.16Å; S620-A624 PolarHBondContact O-N 2.9Å; L621-A624 PolarHBondContact O-N 3.36Å; A624-N627 PolarHBondContact O-N 3.11Å; A624-G628 PolarHBondContact O-N 3.37Å
625	L	84	Confident	86.6	Confident	87 Å²	87	87.6 Å²	87.6	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-64.5	-43.9	175	-77.8	165.8	0	0	0	112.1	L621 N622 S623 G628 A629	L621-L625 HydrophobicContact CD1-CD1 4.49Å; L621-L625 HydrophobicContact CG-CD1 4.11Å; L621-L625 WeakPolarHBondContact O-CB 3.37Å; L621-L625 WeakPolarHBondContact O-CG 3.44Å; L621-L625 PolarHBondContact O-N 2.8Å; N622-L625 PolarHBondContact O-N 2.9Å; S623-L625 PolarHBondContact O-N 3.36Å; L625-G628 PolarHBondContact O-N 3.39Å; L625-A629 PolarHBondContact O-N 2.9Å
626	A	82.4	Confident	86.3	Confident	62 Å²	62	88.2 Å²	88.2	51%	0.512	50%	0.497	S	S	.	.	H	α-helix	trans	-63.3	-42.2	175.6	0	0	0	0	0	111.9	N622 S623 G628 A629 P630	N622-A626 WeakPolarHBondContact O-CB 3.45Å; N622-A626 PolarHBondContact O-N 3.08Å; S623-A626 PolarHBondContact O-N 2.89Å; A626-G628 VanDerWaalsContact C-N 3.29Å; A626-G628 PolarHBondContact O-N 3.43Å; A626-A629 WeakPolarHBondContact O-CB 3.49Å; A626-A629 PolarHBondContact O-N 3.48Å; A626-P630 WeakPolarHBondContact O-CD 3.41Å
627	N	78	Confident	86.2	Confident	113 Å²	113	85.4 Å²	85.4	60%	0.604	48%	0.483	S	S	*	.	H	α-helix	trans	-67.5	-28.3	175.5	-66.3	-25.5	0	0	0	112.6	S623 A624 P630	S623-N627 WeakPolarHBondContact O-CB 3.4Å; S623-N627 PolarHBondContact O-N 2.95Å; S623-N627 PolarHBondContact O-ND2 3.28Å; S623-N627 VanDerWaalsContact O-ND2 3.12Å; A624-N627 PolarHBondContact O-N 3.11Å; N627-P630 WeakPolarHBondContact O-CD 3.5Å; N627-P630 WeakPolarHBondContact O-CG 3.49Å
628	G	77.9	Confident	85.9	Confident	24 Å²	24	86.3 Å²	86.3	25%	0.247	48%	0.481	C	S	.	.	H	α-helix	trans	-79.4	-11.8	174.3	0	0	0	0	0	115.2	A624 L625 A626 R632	A624-G628 PolarHBondContact O-N 3.37Å; L625-G628 PolarHBondContact O-N 3.39Å; A626-G628 VanDerWaalsContact C-N 3.29Å; A626-G628 PolarHBondContact O-N 3.43Å; G628-R632 WeakPolarHBondContact O-CG 3.44Å; G628-R632 PolarHBondContact O-N 2.92Å; G628-R632 PolarHBondContact O-NE 3Å
629	A	78	Confident	85.9	Confident	53 Å²	53	85.5 Å²	85.5	44%	0.438	48%	0.479	S	S	.	.	H	α-helix	trans	-70.2	-50.1	176.4	0	0	0	0	0	114	L625 A626 H631 R632 K633	L625-A629 PolarHBondContact O-N 2.9Å; A626-A629 WeakPolarHBondContact O-CB 3.49Å; A626-A629 PolarHBondContact O-N 3.48Å; A629-H631 PolarHBondContact O-N 3.15Å; A629-R632 PolarHBondContact O-N 3.39Å; A629-K633 PolarHBondContact O-N 2.9Å; A629-K633 VanDerWaalsContact O-N 3.13Å
630	P	78.6	Confident	85.8	Confident	70 Å²	70	83.7 Å²	83.7	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-62.7	-41.5	177.4	24	-33.5	0	0	0	111.8	A626 N627 R632 K633 D634	A626-P630 WeakPolarHBondContact O-CD 3.41Å; N627-P630 WeakPolarHBondContact O-CD 3.5Å; N627-P630 WeakPolarHBondContact O-CG 3.49Å; P630-R632 VanDerWaalsContact C-N 3.31Å; P630-R632 PolarHBondContact O-N 3.03Å; P630-K633 WeakPolarHBondContact O-CA 3.41Å; P630-K633 WeakPolarHBondContact O-CB 3.33Å; P630-K633 PolarHBondContact O-N 2.59Å; P630-D634 PolarHBondContact O-N 2.71Å
631	H	83.1	Confident	86	Confident	132 Å²	132	86.8 Å²	86.8	61%	0.611	48%	0.477	S	S	*	.	H	α-helix	trans	-59.6	-40.1	176.8	-173.3	-9.8	0	0	0	112.2	A629 K633 D634 N635	A629-H631 PolarHBondContact O-N 3.15Å; H631-K633 VanDerWaalsContact C-N 3.34Å; H631-D634 PolarHBondContact O-N 3.34Å; H631-N635 WeakPolarHBondContact O-CB 3.31Å; H631-N635 PolarHBondContact O-N 3.41Å
632	R	80.7	Confident	86.2	Confident	167 Å²	167	86.9 Å²	86.9	63%	0.63	48%	0.477	S	S	*	.	H	α-helix	trans	-64.3	-37.8	174.8	-82.3	-172.4	-89.6	-167.1	-5.1	112.3	G628 A629 P630 A636	G628-R632 WeakPolarHBondContact O-CG 3.44Å; G628-R632 PolarHBondContact O-N 2.92Å; G628-R632 PolarHBondContact O-NE 3Å; A629-R632 PolarHBondContact O-N 3.39Å; P630-R632 VanDerWaalsContact C-N 3.31Å; P630-R632 PolarHBondContact O-N 3.03Å; R632-A636 WeakPolarHBondContact O-CB 3.42Å; R632-A636 PolarHBondContact O-N 2.93Å
633	K	87.1	Confident	86.4	Confident	133 Å²	133	87.7 Å²	87.7	58%	0.578	49%	0.485	S	S	*	.	H	α-helix	trans	-64.7	-48.1	173.9	-170.3	-171	174.2	-160.1	0	111.7	A629 P630 H631 N635 A636 E637	A629-K633 PolarHBondContact O-N 2.9Å; A629-K633 VanDerWaalsContact O-N 3.13Å; P630-K633 WeakPolarHBondContact O-CA 3.41Å; P630-K633 WeakPolarHBondContact O-CB 3.33Å; P630-K633 PolarHBondContact O-N 2.59Å; H631-K633 VanDerWaalsContact C-N 3.34Å; K633-N635 VanDerWaalsContact C-N 3.3Å; K633-N635 PolarHBondContact O-N 3.01Å; K633-A636 PolarHBondContact O-N 2.98Å; K633-A636 VanDerWaalsContact O-N 3.17Å; K633-E637 VanDerWaalsContact CE-OE1 3.28Å; K633-E637 WeakPolarHBondContact CE-OE1 3.01Å; K633-E637 IonicContact NZ-OE1 3.3Å; K633-E637 PolarHBondContact O-N 3.21Å
634	D	88.1	Confident	86.9	Confident	79 Å²	79	89.8 Å²	89.8	42%	0.422	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-37.9	179.4	-66.4	-22.9	0	0	0	112	P630 H631 E637 Q638	P630-D634 PolarHBondContact O-N 2.71Å; H631-D634 PolarHBondContact O-N 3.34Å; D634-E637 PolarHBondContact O-N 3.01Å; D634-Q638 VanDerWaalsContact O-CG 3.25Å; D634-Q638 WeakPolarHBondContact O-CG 3.28Å; D634-Q638 PolarHBondContact O-N 3.08Å
635	N	87.8	Confident	87.3	Confident	74 Å²	74	89.6 Å²	89.6	40%	0.396	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-45.9	173.8	-176.5	-78.1	0	0	0	111.4	H631 K633 E637 Q638 I639	H631-N635 WeakPolarHBondContact O-CB 3.31Å; H631-N635 PolarHBondContact O-N 3.41Å; K633-N635 VanDerWaalsContact C-N 3.3Å; K633-N635 PolarHBondContact O-N 3.01Å; N635-E637 VanDerWaalsContact C-N 3.33Å; N635-E637 PolarHBondContact O-N 3.1Å; N635-Q638 WeakPolarHBondContact O-CB 3.21Å; N635-Q638 PolarHBondContact O-N 3.35Å; N635-Q638 VanDerWaalsContact O-N 3.15Å; N635-I639 WeakPolarHBondContact O-CG1 3.48Å; N635-I639 PolarHBondContact O-N 3.3Å; N635-I639 VanDerWaalsContact OD1-CD1 3.23Å; N635-I639 WeakPolarHBondContact OD1-CD1 3.3Å
636	A	86.8	Confident	87.7	Confident	57 Å²	57	90.9 Å²	90.9	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-39.4	175	0	0	0	0	0	112.3	R632 K633 I639 A640	R632-A636 WeakPolarHBondContact O-CB 3.42Å; R632-A636 PolarHBondContact O-N 2.93Å; K633-A636 PolarHBondContact O-N 2.98Å; K633-A636 VanDerWaalsContact O-N 3.17Å; A636-I639 PolarHBondContact O-N 3.46Å; A636-A640 WeakPolarHBondContact O-CB 3.31Å; A636-A640 PolarHBondContact O-N 2.99Å
637	E	92.2	Very high	88.1	Confident	63 Å²	63	91 Å²	91	29%	0.294	49%	0.487	S	S	.	.	H	α-helix	trans	-65.5	-37.5	173.4	-72.4	-173.4	-161.4	0	0	112.6	K633 D634 N635 A640 R641	K633-E637 VanDerWaalsContact CE-OE1 3.28Å; K633-E637 WeakPolarHBondContact CE-OE1 3.01Å; K633-E637 IonicContact NZ-OE1 3.3Å; K633-E637 PolarHBondContact O-N 3.21Å; D634-E637 PolarHBondContact O-N 3.01Å; N635-E637 VanDerWaalsContact C-N 3.33Å; N635-E637 PolarHBondContact O-N 3.1Å; E637-A640 PolarHBondContact O-N 3.49Å; E637-R641 WeakPolarHBondContact O-CB 3.36Å; E637-R641 VanDerWaalsContact O-CG 3.26Å; E637-R641 WeakPolarHBondContact O-CG 3.37Å; E637-R641 PolarHBondContact O-N 2.98Å; E637-R641 IonicContact OE2-CZ 2.95Å; E637-R641 IonicContact OE2-NH1 2.68Å; E637-R641 IonicContact OE2-NH2 2.88Å; E637-R641 PolarHBondContact OE2-NH2 2.87Å
638	Q	90.4	Very high	88.9	Confident	118 Å²	118	91.3 Å²	91.3	55%	0.551	48%	0.483	S	S	*	.	H	α-helix	trans	-65.2	-43.8	173.7	-72.3	169.2	29.6	0	0	111.6	D634 N635 A640 R641 L642	D634-Q638 VanDerWaalsContact O-CG 3.25Å; D634-Q638 WeakPolarHBondContact O-CG 3.28Å; D634-Q638 PolarHBondContact O-N 3.08Å; N635-Q638 WeakPolarHBondContact O-CB 3.21Å; N635-Q638 PolarHBondContact O-N 3.35Å; N635-Q638 VanDerWaalsContact O-N 3.15Å; Q638-A640 VanDerWaalsContact C-N 3.33Å; Q638-A640 PolarHBondContact O-N 2.99Å; Q638-R641 PolarHBondContact O-N 3.04Å; Q638-L642 WeakPolarHBondContact O-CB 3.48Å; Q638-L642 PolarHBondContact O-N 2.98Å
639	I	92.7	Very high	89.7	Confident	92 Å²	92	93.1 Å²	93.1	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-40.6	174.6	-67.9	170.2	0	0	0	111.1	N635 A636 L642 T643	N635-I639 WeakPolarHBondContact O-CG1 3.48Å; N635-I639 PolarHBondContact O-N 3.3Å; N635-I639 VanDerWaalsContact OD1-CD1 3.23Å; N635-I639 WeakPolarHBondContact OD1-CD1 3.3Å; A636-I639 PolarHBondContact O-N 3.46Å; I639-L642 PolarHBondContact O-N 3.38Å; I639-T643 WeakPolarHBondContact O-CB 3.49Å; I639-T643 PolarHBondContact O-N 2.93Å; I639-T643 PolarHBondContact O-OG1 2.95Å
640	A	91	Very high	90.5	Very high	60 Å²	60	95 Å²	95	50%	0.496	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-44.9	176.1	0	0	0	0	0	111.9	A636 E637 Q638 T643 Q644	A636-A640 WeakPolarHBondContact O-CB 3.31Å; A636-A640 PolarHBondContact O-N 2.99Å; E637-A640 PolarHBondContact O-N 3.49Å; Q638-A640 VanDerWaalsContact C-N 3.33Å; Q638-A640 PolarHBondContact O-N 2.99Å; A640-T643 PolarHBondContact O-N 2.98Å; A640-Q644 WeakPolarHBondContact O-CB 3.43Å; A640-Q644 PolarHBondContact O-N 3.36Å
641	R	96.5	Very high	91	Very high	146 Å²	146	95 Å²	95	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-61.3	-42.9	175	-71.8	169.6	-169.5	130.2	13.9	111.7	E637 Q638 Q644 A645	E637-R641 WeakPolarHBondContact O-CB 3.36Å; E637-R641 VanDerWaalsContact O-CG 3.26Å; E637-R641 WeakPolarHBondContact O-CG 3.37Å; E637-R641 PolarHBondContact O-N 2.98Å; E637-R641 IonicContact OE2-CZ 2.95Å; E637-R641 IonicContact OE2-NH1 2.68Å; E637-R641 IonicContact OE2-NH2 2.88Å; E637-R641 PolarHBondContact OE2-NH2 2.87Å; Q638-R641 PolarHBondContact O-N 3.04Å; R641-Q644 PolarHBondContact O-N 3.14Å; R641-A645 PolarHBondContact O-N 2.81Å
642	L	96.1	Very high	91.5	Very high	102 Å²	102	91.2 Å²	91.2	53%	0.534	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-50.2	176.5	-176.4	66.4	0	0	0	111.4	Q638 I639 Q644 A645 H646	Q638-L642 WeakPolarHBondContact O-CB 3.48Å; Q638-L642 PolarHBondContact O-N 2.98Å; I639-L642 PolarHBondContact O-N 3.38Å; L642-Q644 VanDerWaalsContact C-N 3.26Å; L642-Q644 PolarHBondContact O-N 3.42Å; L642-A645 WeakPolarHBondContact O-CB 3.43Å; L642-A645 PolarHBondContact O-N 3.36Å; L642-H646 PolarHBondContact O-CD2 3.34Å; L642-H646 VanDerWaalsContact O-CD2 3.25Å; L642-H646 PolarHBondContact O-N 3.23Å
643	T	92.4	Very high	92.2	Very high	88 Å²	88	90 Å²	90	54%	0.54	48%	0.484	S	S	.	.	H	α-helix	trans	-57.5	-40.3	177.3	-56.2	0	0	0	0	111.5	I639 A640 H646 S647	I639-T643 WeakPolarHBondContact O-CB 3.49Å; I639-T643 PolarHBondContact O-N 2.93Å; I639-T643 PolarHBondContact O-OG1 2.95Å; A640-T643 PolarHBondContact O-N 2.98Å; T643-H646 PolarHBondContact O-N 3.3Å; T643-S647 PolarHBondContact O-N 3.06Å; T643-S647 PolarHBondContact O-OG 3.28Å
644	Q	96.1	Very high	92.6	Very high	107 Å²	107	91.6 Å²	91.6	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-68.3	-35.6	175.4	-160.9	-165.1	37.8	0	0	113	A640 R641 L642 S647 K648	A640-Q644 WeakPolarHBondContact O-CB 3.43Å; A640-Q644 PolarHBondContact O-N 3.36Å; R641-Q644 PolarHBondContact O-N 3.14Å; L642-Q644 VanDerWaalsContact C-N 3.26Å; L642-Q644 PolarHBondContact O-N 3.42Å; Q644-S647 PolarHBondContact O-OG 3.39Å; Q644-S647 VanDerWaalsContact O-OG 3.1Å; Q644-K648 HydrophobicContact CG-CD 4.48Å; Q644-K648 WeakPolarHBondContact O-CB 3.31Å; Q644-K648 WeakPolarHBondContact O-CD 3.37Å; Q644-K648 VanDerWaalsContact O-CG 3.27Å; Q644-K648 WeakPolarHBondContact O-CG 3.5Å; Q644-K648 PolarHBondContact O-N 2.86Å; Q644-K648 VanDerWaalsContact O-N 3.16Å
645	A	94.1	Very high	92.8	Very high	55 Å²	55	92.6 Å²	92.6	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-67.3	-43.6	174.8	0	0	0	0	0	111.3	R641 L642 K648 A649	R641-A645 PolarHBondContact O-N 2.81Å; L642-A645 WeakPolarHBondContact O-CB 3.43Å; L642-A645 PolarHBondContact O-N 3.36Å; A645-K648 PolarHBondContact O-N 3.23Å; A645-A649 WeakPolarHBondContact O-CB 3.32Å; A645-A649 PolarHBondContact O-N 3.04Å
646	H	91.1	Very high	93.2	Very high	113 Å²	113	92.7 Å²	92.7	52%	0.523	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-42.8	176.1	-82.5	-113.6	0	0	0	112.4	L642 T643 K648 A649 L650	L642-H646 PolarHBondContact O-CD2 3.34Å; L642-H646 VanDerWaalsContact O-CD2 3.25Å; L642-H646 PolarHBondContact O-N 3.23Å; T643-H646 PolarHBondContact O-N 3.3Å; H646-K648 PolarHBondContact O-N 2.93Å; H646-A649 PolarHBondContact O-N 3.43Å; H646-L650 WeakPolarHBondContact O-CB 3.44Å; H646-L650 WeakPolarHBondContact O-CG 3.27Å; H646-L650 PolarHBondContact O-N 2.85Å
647	S	90.9	Very high	93.6	Very high	65 Å²	65	95.3 Å²	95.3	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-37.1	178.1	67.1	0	0	0	0	112.8	T643 Q644 S651	T643-S647 PolarHBondContact O-N 3.06Å; T643-S647 PolarHBondContact O-OG 3.28Å; Q644-S647 PolarHBondContact O-OG 3.39Å; Q644-S647 VanDerWaalsContact O-OG 3.1Å; S647-S651 PolarHBondContact O-N 2.9Å; S647-S651 PolarHBondContact O-OG 3.35Å
648	K	96	Very high	93.6	Very high	120 Å²	120	99.5 Å²	99.5	52%	0.522	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-41.3	171.4	-73.5	170	179.2	170.9	0	112.7	Q644 A645 H646 S651 S652	Q644-K648 HydrophobicContact CG-CD 4.48Å; Q644-K648 WeakPolarHBondContact O-CB 3.31Å; Q644-K648 WeakPolarHBondContact O-CD 3.37Å; Q644-K648 VanDerWaalsContact O-CG 3.27Å; Q644-K648 WeakPolarHBondContact O-CG 3.5Å; Q644-K648 PolarHBondContact O-N 2.86Å; Q644-K648 VanDerWaalsContact O-N 3.16Å; A645-K648 PolarHBondContact O-N 3.23Å; H646-K648 PolarHBondContact O-N 2.93Å; K648-S651 PolarHBondContact O-N 3.23Å; K648-S651 PolarHBondContact O-OG 2.83Å; K648-S651 VanDerWaalsContact O-OG 3.06Å; K648-S652 WeakPolarHBondContact O-CB 3.45Å; K648-S652 PolarHBondContact O-N 2.86Å
649	A	94.6	Very high	93.9	Very high	62 Å²	62	99.4 Å²	99.4	51%	0.512	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-43.6	176.4	0	0	0	0	0	111.5	A645 H646 S652 Y653	A645-A649 WeakPolarHBondContact O-CB 3.32Å; A645-A649 PolarHBondContact O-N 3.04Å; H646-A649 PolarHBondContact O-N 3.43Å; A649-S652 PolarHBondContact O-N 2.84Å; A649-Y653 WeakPolarHBondContact O-CB 3.35Å; A649-Y653 PolarHBondContact O-N 2.92Å
650	L	94.1	Very high	93.9	Very high	93 Å²	93	102.2 Å²	102.2	49%	0.487	50%	0.503	S	S	.	.	H	α-helix	trans	-64.1	-41.6	176.5	-76.7	165.7	0	0	0	112.9	H646 R654	H646-L650 WeakPolarHBondContact O-CB 3.44Å; H646-L650 WeakPolarHBondContact O-CG 3.27Å; H646-L650 PolarHBondContact O-N 2.85Å; L650-R654 WeakPolarHBondContact O-CB 3.29Å; L650-R654 VanDerWaalsContact O-CG 3.27Å; L650-R654 WeakPolarHBondContact O-CG 3.43Å; L650-R654 PolarHBondContact O-N 3.4Å
651	S	88.3	Confident	94	Very high	68 Å²	68	104.8 Å²	104.8	48%	0.476	50%	0.499	S	S	.	.	H	α-helix	trans	-68.5	-39.7	177.4	66.2	0	0	0	0	112	S647 K648 R654 Q655	S647-S651 PolarHBondContact O-N 2.9Å; S647-S651 PolarHBondContact O-OG 3.35Å; K648-S651 PolarHBondContact O-N 3.23Å; K648-S651 PolarHBondContact O-OG 2.83Å; K648-S651 VanDerWaalsContact O-OG 3.06Å; S651-R654 PolarHBondContact O-N 3Å; S651-Q655 WeakPolarHBondContact O-CB 3.45Å; S651-Q655 PolarHBondContact O-N 3.48Å
652	S	94.8	Very high	93.9	Very high	54 Å²	54	102 Å²	102	38%	0.378	49%	0.493	S	S	.	.	H	α-helix	trans	-59.7	-50.6	171.9	-177.3	0	0	0	0	111.7	K648 A649 R654 Q655 I656	K648-S652 WeakPolarHBondContact O-CB 3.45Å; K648-S652 PolarHBondContact O-N 2.86Å; A649-S652 PolarHBondContact O-N 2.84Å; S652-R654 PolarHBondContact O-N 3.06Å; S652-Q655 WeakPolarHBondContact O-CB 3.43Å; S652-Q655 PolarHBondContact O-N 3.36Å; S652-Q655 VanDerWaalsContact O-N 3.07Å; S652-I656 WeakPolarHBondContact O-CG1 3.49Å; S652-I656 PolarHBondContact O-N 3.09Å
653	Y	94.4	Very high	93.9	Very high	141 Å²	141	102.1 Å²	102.1	55%	0.553	49%	0.491	S	S	*	.	H	α-helix	trans	-57.2	-45.5	176.3	175.1	-98.3	0	0	0	112.2	A649 Q655 I656 R657	A649-Y653 WeakPolarHBondContact O-CB 3.35Å; A649-Y653 PolarHBondContact O-N 2.92Å; Y653-Q655 VanDerWaalsContact C-N 3.32Å; Y653-Q655 PolarHBondContact O-N 2.86Å; Y653-I656 PolarHBondContact O-N 3.11Å; Y653-R657 WeakPolarHBondContact O-CB 3.38Å; Y653-R657 PolarHBondContact O-N 2.84Å
654	R	95.1	Very high	93.9	Very high	166 Å²	166	101.5 Å²	101.5	63%	0.626	49%	0.486	S	S	*	.	H	α-helix	trans	-62.5	-35.3	175.5	-73.5	170.6	178	171.2	-1.5	112.8	L650 S651 S652 R658	L650-R654 WeakPolarHBondContact O-CB 3.29Å; L650-R654 VanDerWaalsContact O-CG 3.27Å; L650-R654 WeakPolarHBondContact O-CG 3.43Å; L650-R654 PolarHBondContact O-N 3.4Å; S651-R654 PolarHBondContact O-N 3Å; S652-R654 PolarHBondContact O-N 3.06Å; R654-R658 WeakPolarHBondContact O-CG 3.49Å; R654-R658 PolarHBondContact O-N 2.9Å; R654-R658 VanDerWaalsContact O-N 3.16Å; R654-R658 PolarHBondContact O-NE 3.41Å
655	Q	93.1	Very high	93.9	Very high	100 Å²	100	103.3 Å²	103.3	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-70.7	-43.7	175.6	-170.4	-179	13.4	0	0	111.5	S651 S652 Y653 R658 K659	S651-Q655 WeakPolarHBondContact O-CB 3.45Å; S651-Q655 PolarHBondContact O-N 3.48Å; S652-Q655 WeakPolarHBondContact O-CB 3.43Å; S652-Q655 PolarHBondContact O-N 3.36Å; S652-Q655 VanDerWaalsContact O-N 3.07Å; Y653-Q655 VanDerWaalsContact C-N 3.32Å; Y653-Q655 PolarHBondContact O-N 2.86Å; Q655-R658 PolarHBondContact O-N 3.44Å; Q655-K659 PolarHBondContact O-N 3.39Å
656	I	95.5	Very high	94	Very high	77 Å²	77	106.5 Å²	106.5	40%	0.395	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-46.5	176.4	-69.1	166.6	0	0	0	110.4	S652 Y653 R658 K659 Y660	S652-I656 WeakPolarHBondContact O-CG1 3.49Å; S652-I656 PolarHBondContact O-N 3.09Å; Y653-I656 PolarHBondContact O-N 3.11Å; I656-R658 VanDerWaalsContact C-N 3.31Å; I656-R658 PolarHBondContact O-N 3.08Å; I656-K659 PolarHBondContact O-N 2.88Å; I656-K659 VanDerWaalsContact O-N 3.15Å; I656-Y660 HydrophobicContact CG2-CD2 3.62Å; I656-Y660 HydrophobicContact CG2-CE2 3.39Å; I656-Y660 WeakPolarHBondContact O-CD2 3.38Å; I656-Y660 PolarHBondContact O-N 3.41Å
657	R	95.1	Very high	94.3	Very high	112 Å²	112	106.3 Å²	106.3	42%	0.423	49%	0.492	S	S	.	.	H	α-helix	trans	-59.7	-38	176	-170.7	177	179.7	-154	-2.1	112.3	E522 Y653 R661	E522-R657 IonicContact OE1-NH2 2.67Å; Y653-R657 WeakPolarHBondContact O-CB 3.38Å; Y653-R657 PolarHBondContact O-N 2.84Å; R657-R661 WeakPolarHBondContact O-CG 3.4Å; R657-R661 PolarHBondContact O-N 2.81Å
658	R	93.3	Very high	94.4	Very high	150 Å²	150	107.8 Å²	107.8	57%	0.566	49%	0.491	S	S	*	.	H	α-helix	trans	-64.3	-47.6	172.2	-79.3	-174.8	-69.4	162.1	-2.7	112.1	R654 Q655 I656 Y660 R661 E662	R654-R658 WeakPolarHBondContact O-CG 3.49Å; R654-R658 PolarHBondContact O-N 2.9Å; R654-R658 VanDerWaalsContact O-N 3.16Å; R654-R658 PolarHBondContact O-NE 3.41Å; Q655-R658 PolarHBondContact O-N 3.44Å; I656-R658 VanDerWaalsContact C-N 3.31Å; I656-R658 PolarHBondContact O-N 3.08Å; R658-Y660 VanDerWaalsContact C-N 3.32Å; R658-Y660 PolarHBondContact O-N 2.96Å; R658-R661 PolarHBondContact O-N 3.18Å; R658-R661 VanDerWaalsContact O-N 3.17Å; R658-E662 WeakPolarHBondContact O-CG 3.21Å; R658-E662 PolarHBondContact O-N 3.23Å
659	K	95.8	Very high	94.3	Very high	117 Å²	117	107 Å²	107	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-57.8	-42.6	176.4	-72.2	-177.2	177.2	-173.7	0	112.5	Q655 I656 E662 Q663	Q655-K659 PolarHBondContact O-N 3.39Å; I656-K659 PolarHBondContact O-N 2.88Å; I656-K659 VanDerWaalsContact O-N 3.15Å; K659-E662 PolarHBondContact O-N 3.5Å; K659-Q663 WeakPolarHBondContact O-CG 3.36Å; K659-Q663 PolarHBondContact O-N 2.94Å
660	Y	94.2	Very high	94.4	Very high	150 Å²	150	111 Å²	111	59%	0.588	50%	0.495	S	S	*	.	H	α-helix	trans	-64.5	-44.3	175	-79	-60.4	0	0	0	112.4	I656 R658 E662 Q663 V664	I656-Y660 HydrophobicContact CG2-CD2 3.62Å; I656-Y660 HydrophobicContact CG2-CE2 3.39Å; I656-Y660 WeakPolarHBondContact O-CD2 3.38Å; I656-Y660 PolarHBondContact O-N 3.41Å; R658-Y660 VanDerWaalsContact C-N 3.32Å; R658-Y660 PolarHBondContact O-N 2.96Å; Y660-E662 VanDerWaalsContact C-N 3.34Å; Y660-E662 PolarHBondContact O-N 3.3Å; Y660-Q663 WeakPolarHBondContact O-CB 3.39Å; Y660-Q663 PolarHBondContact O-N 3.39Å; Y660-Q663 VanDerWaalsContact O-N 3.1Å; Y660-V664 WeakPolarHBondContact O-CG2 3.48Å; Y660-V664 PolarHBondContact O-N 3.49Å
661	R	92.6	Very high	94.4	Very high	114 Å²	114	110.4 Å²	110.4	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-57.4	-44.6	173.6	-77.6	171.8	163.8	-179.6	-12.5	111.8	E522 R657 R658 Q663 V664 W665	E522-R661 IonicContact OE1-NH2 3.92Å; E522-R661 PolarHBondContact OE1-NH2 3.04Å; E522-R661 IonicContact OE2-NH2 3.86Å; E522-R661 PolarHBondContact OE2-NH2 2.93Å; R657-R661 WeakPolarHBondContact O-CG 3.4Å; R657-R661 PolarHBondContact O-N 2.81Å; R658-R661 PolarHBondContact O-N 3.18Å; R658-R661 VanDerWaalsContact O-N 3.17Å; R661-Q663 VanDerWaalsContact C-N 3.32Å; R661-Q663 PolarHBondContact O-N 3.4Å; R661-V664 PolarHBondContact O-N 2.91Å; R661-W665 WeakPolarHBondContact O-CB 3.34Å; R661-W665 PolarHBondContact O-N 3.37Å
662	E	94.5	Very high	94.7	Very high	89 Å²	89	109.6 Å²	109.6	42%	0.416	49%	0.492	S	S	.	.	H	α-helix	trans	-66.1	-31.2	175.4	-64.8	171.3	-147	0	0	113.3	R658 K659 Y660 R666	R658-E662 WeakPolarHBondContact O-CG 3.21Å; R658-E662 PolarHBondContact O-N 3.23Å; K659-E662 PolarHBondContact O-N 3.5Å; Y660-E662 VanDerWaalsContact C-N 3.34Å; Y660-E662 PolarHBondContact O-N 3.3Å; E662-R666 VanDerWaalsContact C-NH1 3.34Å; E662-R666 VanDerWaalsContact CB-NH1 3.28Å; E662-R666 WeakPolarHBondContact O-CB 3.37Å; E662-R666 VanDerWaalsContact O-CG 3.23Å; E662-R666 WeakPolarHBondContact O-CG 3.09Å; E662-R666 PolarHBondContact O-N 3.47Å; E662-R666 VanDerWaalsContact O-N 3.08Å; E662-R666 PolarHBondContact O-NH1 3.27Å; E662-R666 VanDerWaalsContact O-NH1 3.13Å; E662-R666 IonicContact OE2-CZ 3.78Å; E662-R666 IonicContact OE2-NH1 2.89Å; E662-R666 IonicContact OE2-NH2 3.74Å; E662-R666 PolarHBondContact OE2-NH2 3.23Å
663	Q	96	Very high	94.6	Very high	103 Å²	103	109.6 Å²	109.6	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-69.5	-46.3	174.9	-76.9	172.3	-14.7	0	0	111	K659 Y660 R661 R666 L667	K659-Q663 WeakPolarHBondContact O-CG 3.36Å; K659-Q663 PolarHBondContact O-N 2.94Å; Y660-Q663 WeakPolarHBondContact O-CB 3.39Å; Y660-Q663 PolarHBondContact O-N 3.39Å; Y660-Q663 VanDerWaalsContact O-N 3.1Å; R661-Q663 VanDerWaalsContact C-N 3.32Å; R661-Q663 PolarHBondContact O-N 3.4Å; Q663-R666 PolarHBondContact O-N 3.49Å; Q663-L667 WeakPolarHBondContact O-CG 3.37Å; Q663-L667 PolarHBondContact O-N 2.88Å
664	V	93	Very high	94.6	Very high	75 Å²	75	108.5 Å²	108.5	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-58.7	-50.6	174.6	172.1	0	0	0	0	110.3	Y660 R661 R666 L667 E668	Y660-V664 WeakPolarHBondContact O-CG2 3.48Å; Y660-V664 PolarHBondContact O-N 3.49Å; R661-V664 PolarHBondContact O-N 2.91Å; V664-R666 VanDerWaalsContact C-N 3.34Å; V664-R666 PolarHBondContact O-N 3.14Å; V664-L667 CarbonylContact O-C 3.57Å; V664-L667 WeakPolarHBondContact O-CA 3.49Å; V664-L667 WeakPolarHBondContact O-CB 3.43Å; V664-L667 PolarHBondContact O-N 3Å; V664-E668 HydrophobicContact CG1-CG 4.23Å; V664-E668 WeakPolarHBondContact CG1-OE1 3.42Å; V664-E668 WeakPolarHBondContact O-CG 3.38Å; V664-E668 PolarHBondContact O-N 2.87Å
665	W	94.4	Very high	94.4	Very high	146 Å²	146	106.7 Å²	106.7	55%	0.553	50%	0.497	S	S	*	.	H	α-helix	trans	-57.2	-42.7	177.3	-178.5	79.7	0	0	0	112.9	R661 L667 E668 Q669	R661-W665 WeakPolarHBondContact O-CB 3.34Å; R661-W665 PolarHBondContact O-N 3.37Å; W665-L667 VanDerWaalsContact C-N 3.27Å; W665-L667 PolarHBondContact O-N 3.46Å; W665-E668 PolarHBondContact O-N 3.12Å; W665-Q669 HydrophobicContact CD2-CG 4.08Å; W665-Q669 HydrophobicContact CE3-CG 4.4Å; W665-Q669 HydrophobicContact CH2-CG 4.18Å; W665-Q669 HydrophobicContact CZ2-CG 3.84Å; W665-Q669 HydrophobicContact CZ3-CG 4.44Å; W665-Q669 VanDerWaalsContact O-CG 3.26Å; W665-Q669 WeakPolarHBondContact O-CG 3.28Å; W665-Q669 PolarHBondContact O-N 3.47Å
666	R	97.3	Very high	94.3	Very high	121 Å²	121	108.4 Å²	108.4	46%	0.457	51%	0.505	S	S	.	.	H	α-helix	trans	-65.1	-27.5	174.7	-74	179.1	-159.6	100.6	-0.3	113.3	E662 Q663 V664 K670	E662-R666 VanDerWaalsContact C-NH1 3.34Å; E662-R666 VanDerWaalsContact CB-NH1 3.28Å; E662-R666 WeakPolarHBondContact O-CB 3.37Å; E662-R666 VanDerWaalsContact O-CG 3.23Å; E662-R666 WeakPolarHBondContact O-CG 3.09Å; E662-R666 PolarHBondContact O-N 3.47Å; E662-R666 VanDerWaalsContact O-N 3.08Å; E662-R666 PolarHBondContact O-NH1 3.27Å; E662-R666 VanDerWaalsContact O-NH1 3.13Å; E662-R666 IonicContact OE2-CZ 3.78Å; E662-R666 IonicContact OE2-NH1 2.89Å; E662-R666 IonicContact OE2-NH2 3.74Å; E662-R666 PolarHBondContact OE2-NH2 3.23Å; Q663-R666 PolarHBondContact O-N 3.49Å; V664-R666 VanDerWaalsContact C-N 3.34Å; V664-R666 PolarHBondContact O-N 3.14Å; R666-K670 WeakPolarHBondContact O-CG 3.46Å; R666-K670 PolarHBondContact O-N 3.05Å
667	L	96.6	Very high	94	Very high	110 Å²	110	107.5 Å²	107.5	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-77.9	-44.2	174.4	-70.4	169.6	0	0	0	110.9	Q663 V664 W665 Q669 K670 V671	Q663-L667 WeakPolarHBondContact O-CG 3.37Å; Q663-L667 PolarHBondContact O-N 2.88Å; V664-L667 CarbonylContact O-C 3.57Å; V664-L667 WeakPolarHBondContact O-CA 3.49Å; V664-L667 WeakPolarHBondContact O-CB 3.43Å; V664-L667 PolarHBondContact O-N 3Å; W665-L667 VanDerWaalsContact C-N 3.27Å; W665-L667 PolarHBondContact O-N 3.46Å; L667-Q669 VanDerWaalsContact C-N 3.33Å; L667-Q669 PolarHBondContact O-N 3.07Å; L667-K670 WeakPolarHBondContact O-CB 3.36Å; L667-K670 PolarHBondContact O-N 3.38Å; L667-K670 VanDerWaalsContact O-N 3.07Å; L667-V671 WeakPolarHBondContact O-CG2 3.44Å; L667-V671 PolarHBondContact O-N 3.05Å
668	E	94.4	Very high	93.5	Very high	96 Å²	96	108.1 Å²	108.1	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-56.4	-45.5	174.3	-69.5	168.1	164.8	0	0	111.4	V664 W665 K670 V671 A672	V664-E668 HydrophobicContact CG1-CG 4.23Å; V664-E668 WeakPolarHBondContact CG1-OE1 3.42Å; V664-E668 WeakPolarHBondContact O-CG 3.38Å; V664-E668 PolarHBondContact O-N 2.87Å; W665-E668 PolarHBondContact O-N 3.12Å; E668-K670 VanDerWaalsContact C-N 3.32Å; E668-K670 PolarHBondContact O-N 3.09Å; E668-V671 PolarHBondContact O-N 3.47Å; E668-A672 WeakPolarHBondContact O-CB 3.25Å; E668-A672 PolarHBondContact O-N 2.62Å
669	Q	94.2	Very high	93.1	Very high	102 Å²	102	106.3 Å²	106.3	48%	0.477	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-38.1	174.8	-69.9	-63.6	-50.9	0	0	112.8	W665 L667 A673	W665-Q669 HydrophobicContact CD2-CG 4.08Å; W665-Q669 HydrophobicContact CE3-CG 4.4Å; W665-Q669 HydrophobicContact CH2-CG 4.18Å; W665-Q669 HydrophobicContact CZ2-CG 3.84Å; W665-Q669 HydrophobicContact CZ3-CG 4.44Å; W665-Q669 VanDerWaalsContact O-CG 3.26Å; W665-Q669 WeakPolarHBondContact O-CG 3.28Å; W665-Q669 PolarHBondContact O-N 3.47Å; L667-Q669 VanDerWaalsContact C-N 3.33Å; L667-Q669 PolarHBondContact O-N 3.07Å; Q669-A673 WeakPolarHBondContact O-CB 3.47Å; Q669-A673 PolarHBondContact O-N 2.67Å
670	K	95.4	Very high	92.6	Very high	148 Å²	148	103.9 Å²	103.9	64%	0.643	51%	0.509	S	S	*	.	H	α-helix	trans	-69.9	-38.7	175.7	-74.9	177.2	178.5	-171.8	0	112.4	R666 L667 E668 M674	R666-K670 WeakPolarHBondContact O-CG 3.46Å; R666-K670 PolarHBondContact O-N 3.05Å; L667-K670 WeakPolarHBondContact O-CB 3.36Å; L667-K670 PolarHBondContact O-N 3.38Å; L667-K670 VanDerWaalsContact O-N 3.07Å; E668-K670 VanDerWaalsContact C-N 3.32Å; E668-K670 PolarHBondContact O-N 3.09Å; K670-M674 WeakPolarHBondContact O-CB 3.49Å; K670-M674 PolarHBondContact O-N 2.78Å
671	V	94.6	Very high	92.1	Very high	80 Å²	80	102.8 Å²	102.8	49%	0.485	51%	0.509	S	S	.	.	H	α-helix	trans	-67.3	-43	176.2	172.9	0	0	0	0	110.4	L667 E668 M674 M675	L667-V671 WeakPolarHBondContact O-CG2 3.44Å; L667-V671 PolarHBondContact O-N 3.05Å; E668-V671 PolarHBondContact O-N 3.47Å; V671-M674 PolarHBondContact O-N 3.17Å; V671-M675 HydrophobicContact CG1-CG 4.45Å; V671-M675 HydrophobicContact CG1-SD 4.07Å; V671-M675 WeakPolarHBondContact O-CG 3.3Å; V671-M675 PolarHBondContact O-N 3.36Å
672	A	93.6	Very high	91.6	Very high	50 Å²	50	100.1 Å²	100.1	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-59.2	-48.8	175.1	0	0	0	0	0	112	E668 M674 M675 E676	E668-A672 WeakPolarHBondContact O-CB 3.25Å; E668-A672 PolarHBondContact O-N 2.62Å; A672-M674 VanDerWaalsContact C-N 3.31Å; A672-M674 PolarHBondContact O-N 2.96Å; A672-M675 PolarHBondContact O-N 3.4Å; A672-E676 WeakPolarHBondContact O-CB 3.45Å; A672-E676 PolarHBondContact O-N 3.5Å
673	A	93.8	Very high	90.9	Very high	55 Å²	55	101 Å²	101	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-63.5	-34.5	176.4	0	0	0	0	0	113	Q669 S677	Q669-A673 WeakPolarHBondContact O-CB 3.47Å; Q669-A673 PolarHBondContact O-N 2.67Å; A673-S677 WeakPolarHBondContact O-CB 3.34Å; A673-S677 PolarHBondContact O-N 2.68Å
674	M	93.6	Very high	90.2	Very high	118 Å²	118	99 Å²	99	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-43.4	174	-174.6	-173.9	-62.1	0	0	111.7	K670 V671 A672 S677 Q678	K670-M674 WeakPolarHBondContact O-CB 3.49Å; K670-M674 PolarHBondContact O-N 2.78Å; V671-M674 PolarHBondContact O-N 3.17Å; A672-M674 VanDerWaalsContact C-N 3.31Å; A672-M674 PolarHBondContact O-N 2.96Å; M674-S677 PolarHBondContact O-N 3.12Å; M674-Q678 PolarHBondContact O-N 3.35Å
675	M	90.9	Very high	89.6	Confident	127 Å²	127	98.3 Å²	98.3	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-43.8	175.8	-74.2	174.6	57.5	0	0	111.8	V671 A672 Q678 H679	V671-M675 HydrophobicContact CG1-CG 4.45Å; V671-M675 HydrophobicContact CG1-SD 4.07Å; V671-M675 WeakPolarHBondContact O-CG 3.3Å; V671-M675 PolarHBondContact O-N 3.36Å; A672-M675 PolarHBondContact O-N 3.4Å; M675-Q678 PolarHBondContact O-N 3.14Å; M675-H679 WeakPolarHBondContact O-CB 3.47Å; M675-H679 PolarHBondContact O-N 2.84Å
676	E	91.3	Very high	88.9	Confident	136 Å²	136	97 Å²	97	64%	0.636	51%	0.514	S	S	*	.	H	α-helix	trans	-62.4	-45.1	176.2	-170.5	170.7	-156.3	0	0	110.9	A672 Q678 H679 S680	A672-E676 WeakPolarHBondContact O-CB 3.45Å; A672-E676 PolarHBondContact O-N 3.5Å; E676-Q678 PolarHBondContact O-N 2.95Å; E676-H679 PolarHBondContact O-N 2.98Å; E676-S680 PolarHBondContact O-N 3.12Å; E676-S680 PolarHBondContact O-OG 3.22Å
677	S	88.8	Confident	88.1	Confident	59 Å²	59	94.2 Å²	94.2	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-61.7	-38	174.4	-177.4	0	0	0	0	113.4	A673 M674 Q681	A673-S677 WeakPolarHBondContact O-CB 3.34Å; A673-S677 PolarHBondContact O-N 2.68Å; M674-S677 PolarHBondContact O-N 3.12Å; S677-Q681 WeakPolarHBondContact O-CB 3.37Å; S677-Q681 VanDerWaalsContact O-CG 3.23Å; S677-Q681 WeakPolarHBondContact O-CG 3.39Å; S677-Q681 PolarHBondContact O-N 3.47Å; S677-Q681 VanDerWaalsContact O-N 3.08Å
678	Q	86.2	Confident	87.1	Confident	124 Å²	124	91.9 Å²	91.9	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-71.8	-35.6	175.4	-76.8	-164.8	-9.8	0	0	112.1	M674 M675 E676 Q681 S682	M674-Q678 PolarHBondContact O-N 3.35Å; M675-Q678 PolarHBondContact O-N 3.14Å; E676-Q678 PolarHBondContact O-N 2.95Å; Q678-Q681 PolarHBondContact O-N 3.15Å; Q678-S682 WeakPolarHBondContact O-CB 3.3Å; Q678-S682 PolarHBondContact O-N 2.8Å
679	H	83.8	Confident	86.3	Confident	113 Å²	113	93.9 Å²	93.9	52%	0.523	52%	0.522	S	S	.	.	H	α-helix	trans	-62.9	-50.2	175.1	-168.6	10.9	0	0	0	110.8	M675 E676 Q681 S682 E683	M675-H679 WeakPolarHBondContact O-CB 3.47Å; M675-H679 PolarHBondContact O-N 2.84Å; E676-H679 PolarHBondContact O-N 2.98Å; H679-Q681 VanDerWaalsContact C-N 3.32Å; H679-Q681 PolarHBondContact O-N 3.35Å; H679-S682 PolarHBondContact O-N 3.37Å; H679-S682 VanDerWaalsContact O-N 3.12Å; H679-E683 IonicContact CE1-OE1 3.28Å; H679-E683 PolarHBondContact CE1-OE1 2.92Å; H679-E683 IonicContact ND1-OE1 2.64Å; H679-E683 IonicContact NE2-OE1 3.54Å; H679-E683 WeakPolarHBondContact O-CG 3.48Å; H679-E683 PolarHBondContact O-N 3.37Å
680	S	85.8	Confident	85.5	Confident	65 Å²	65	94.2 Å²	94.2	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-34.2	176.6	-56.2	0	0	0	0	113.2	E676 A684	E676-S680 PolarHBondContact O-N 3.12Å; E676-S680 PolarHBondContact O-OG 3.22Å; S680-A684 VanDerWaalsContact O-CB 3.25Å; S680-A684 WeakPolarHBondContact O-CB 3.5Å; S680-A684 PolarHBondContact O-N 3.27Å
681	Q	83.1	Confident	84.5	Confident	127 Å²	127	88.5 Å²	88.5	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-67.9	-38.9	172.6	-77.2	173.1	7.7	0	0	112.2	S677 Q678 H679 A685	S677-Q681 WeakPolarHBondContact O-CB 3.37Å; S677-Q681 VanDerWaalsContact O-CG 3.23Å; S677-Q681 WeakPolarHBondContact O-CG 3.39Å; S677-Q681 PolarHBondContact O-N 3.47Å; S677-Q681 VanDerWaalsContact O-N 3.08Å; Q678-Q681 PolarHBondContact O-N 3.15Å; H679-Q681 VanDerWaalsContact C-N 3.32Å; H679-Q681 PolarHBondContact O-N 3.35Å; Q681-A685 WeakPolarHBondContact O-CB 3.35Å; Q681-A685 PolarHBondContact O-N 3.17Å
682	S	82.1	Confident	83.3	Confident	59 Å²	59	86.3 Å²	86.3	41%	0.413	50%	0.498	S	S	.	.	H	α-helix	trans	-68.1	-39.9	175.9	-175.7	0	0	0	0	112.1	Q678 H679 A685 K686	Q678-S682 WeakPolarHBondContact O-CB 3.3Å; Q678-S682 PolarHBondContact O-N 2.8Å; H679-S682 PolarHBondContact O-N 3.37Å; H679-S682 VanDerWaalsContact O-N 3.12Å; S682-A685 PolarHBondContact O-N 3.39Å; S682-K686 WeakPolarHBondContact O-CG 3.49Å; S682-K686 PolarHBondContact O-N 3.14Å
683	E	80.1	Confident	82.2	Confident	106 Å²	106	89.6 Å²	89.6	50%	0.495	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-43.3	174.5	-70.7	-177.9	152.8	0	0	111.8	H679 A685 K686 A687	H679-E683 IonicContact CE1-OE1 3.28Å; H679-E683 PolarHBondContact CE1-OE1 2.92Å; H679-E683 IonicContact ND1-OE1 2.64Å; H679-E683 IonicContact NE2-OE1 3.54Å; H679-E683 WeakPolarHBondContact O-CG 3.48Å; H679-E683 PolarHBondContact O-N 3.37Å; E683-A685 VanDerWaalsContact C-N 3.33Å; E683-A685 PolarHBondContact O-N 3.36Å; E683-K686 PolarHBondContact O-N 2.99Å; E683-A687 WeakPolarHBondContact O-CB 3.39Å; E683-A687 PolarHBondContact O-N 3.23Å
684	A	81.6	Confident	81	Confident	63 Å²	63	95.5 Å²	95.5	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-63.4	-37.1	174.7	0	0	0	0	0	112.5	S680 A688	S680-A684 VanDerWaalsContact O-CB 3.25Å; S680-A684 WeakPolarHBondContact O-CB 3.5Å; S680-A684 PolarHBondContact O-N 3.27Å; A684-A688 WeakPolarHBondContact O-CB 3.43Å; A684-A688 PolarHBondContact O-N 3.1Å
685	A	79.4	Confident	79.6	Confident	59 Å²	59	98 Å²	98	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-44.7	174.7	0	0	0	0	0	111.8	Q681 S682 E683 A688 E689	Q681-A685 WeakPolarHBondContact O-CB 3.35Å; Q681-A685 PolarHBondContact O-N 3.17Å; S682-A685 PolarHBondContact O-N 3.39Å; E683-A685 VanDerWaalsContact C-N 3.33Å; E683-A685 PolarHBondContact O-N 3.36Å; A685-A688 PolarHBondContact O-N 2.62Å; A685-E689 WeakPolarHBondContact O-CB 3.41Å; A685-E689 PolarHBondContact O-N 3.32Å
686	K	81.1	Confident	78.3	Confident	120 Å²	120	98.4 Å²	98.4	52%	0.522	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-45.9	175.7	-74.3	-180	176.4	-170.2	0	112.6	S682 E683 A688 E689 E690	S682-K686 WeakPolarHBondContact O-CG 3.49Å; S682-K686 PolarHBondContact O-N 3.14Å; E683-K686 PolarHBondContact O-N 2.99Å; K686-A688 PolarHBondContact O-N 3.3Å; K686-E689 WeakPolarHBondContact O-CB 3.39Å; K686-E689 PolarHBondContact O-N 2.86Å; K686-E689 VanDerWaalsContact O-N 3.09Å; K686-E690 WeakPolarHBondContact O-CG 3.43Å; K686-E690 PolarHBondContact O-N 3.04Å
687	A	78.9	Confident	76.6	Confident	61 Å²	61	96.9 Å²	96.9	50%	0.504	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-32.2	176.5	0	0	0	0	0	112.6	E683 G691	E683-A687 WeakPolarHBondContact O-CB 3.39Å; E683-A687 PolarHBondContact O-N 3.23Å; A687-G691 PolarHBondContact O-N 3.29Å
688	A	76.9	Confident	75.1	Confident	61 Å²	61	101.3 Å²	101.3	50%	0.504	52%	0.523	S	S	.	.	H	α-helix	trans	-74.3	-32.1	173.8	0	0	0	0	0	113.1	A684 A685 K686 A692	A684-A688 WeakPolarHBondContact O-CB 3.43Å; A684-A688 PolarHBondContact O-N 3.1Å; A685-A688 PolarHBondContact O-N 2.62Å; K686-A688 PolarHBondContact O-N 3.3Å; A688-A692 WeakPolarHBondContact O-CB 3.49Å; A688-A692 PolarHBondContact O-N 2.83Å; A688-A692 VanDerWaalsContact O-N 3.09Å
689	E	76.1	Confident	73.7	Confident	138 Å²	138	100.8 Å²	100.8	65%	0.645	53%	0.529	S	S	*	.	H	α-helix	trans	-68.9	-52	173.7	-174.7	167.9	-154.5	0	0	111	A685 K686 G691 A692 E693	A685-E689 WeakPolarHBondContact O-CB 3.41Å; A685-E689 PolarHBondContact O-N 3.32Å; K686-E689 WeakPolarHBondContact O-CB 3.39Å; K686-E689 PolarHBondContact O-N 2.86Å; K686-E689 VanDerWaalsContact O-N 3.09Å; E689-G691 VanDerWaalsContact C-N 3.34Å; E689-G691 PolarHBondContact O-N 3.41Å; E689-A692 CarbonylContact O-C 3.59Å; E689-A692 WeakPolarHBondContact O-CA 3.46Å; E689-A692 WeakPolarHBondContact O-CB 3.34Å; E689-A692 PolarHBondContact O-N 2.82Å; E689-E693 PolarHBondContact O-N 3.23Å
690	E	77.8	Confident	72.2	Confident	109 Å²	109	102.2 Å²	102.2	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-55.4	-47.5	172.7	-69.1	170.6	-166.4	0	0	110.9	K686 A692 E693 W694	K686-E690 WeakPolarHBondContact O-CG 3.43Å; K686-E690 PolarHBondContact O-N 3.04Å; E690-A692 PolarHBondContact O-N 3.09Å; E690-E693 WeakPolarHBondContact O-CB 3.22Å; E690-E693 PolarHBondContact O-N 3.44Å; E690-W694 PolarHBondContact O-N 3.17Å
691	G	74.4	Confident	70.1	Confident	28 Å²	28	109.3 Å²	109.3	29%	0.289	57%	0.57	S	S	.	*	H	α-helix	trans	-68.2	-11	175.9	0	0	0	0	0	115.4	A687 E689 R695	A687-G691 PolarHBondContact O-N 3.29Å; E689-G691 VanDerWaalsContact C-N 3.34Å; E689-G691 PolarHBondContact O-N 3.41Å; G691-R695 PolarHBondContact O-NE 3.38Å
692	A	71.1	Confident	69.4	Low	35 Å²	35	108.4 Å²	108.4	29%	0.289	57%	0.569	S	S	.	*	H	α-helix	trans	-93.6	-27.6	168.5	0	0	0	0	0	111.9	A688 E689 E690 K696	A688-A692 WeakPolarHBondContact O-CB 3.49Å; A688-A692 PolarHBondContact O-N 2.83Å; A688-A692 VanDerWaalsContact O-N 3.09Å; E689-A692 CarbonylContact O-C 3.59Å; E689-A692 WeakPolarHBondContact O-CA 3.46Å; E689-A692 WeakPolarHBondContact O-CB 3.34Å; E689-A692 PolarHBondContact O-N 2.82Å; E690-A692 PolarHBondContact O-N 3.09Å; A692-K696 WeakPolarHBondContact O-CG 3.33Å; A692-K696 PolarHBondContact O-N 3.45Å
693	E	69.3	Low	68.7	Low	119 Å²	119	111 Å²	111	56%	0.556	58%	0.578	S	S	*	*	H	α-helix	trans	-69.2	-50.7	173.9	-165.7	159.2	-136.1	0	0	111.2	E689 E690 R695 K696 E697	E689-E693 PolarHBondContact O-N 3.23Å; E690-E693 WeakPolarHBondContact O-CB 3.22Å; E690-E693 PolarHBondContact O-N 3.44Å; E693-R695 PolarHBondContact O-N 3.02Å; E693-R695 VanDerWaalsContact O-N 3.15Å; E693-K696 WeakPolarHBondContact O-CA 3.41Å; E693-K696 WeakPolarHBondContact O-CB 3.46Å; E693-K696 PolarHBondContact O-N 3.43Å; E693-E697 PolarHBondContact O-N 2.79Å
694	W	68.1	Low	68.1	Low	178 Å²	178	111.3 Å²	111.3	67%	0.674	58%	0.582	S	S	*	*	H	α-helix	trans	-53	-38.5	173.9	-71.9	112.8	0	0	0	113.3	E690 K696 E697 E698	E690-W694 PolarHBondContact O-N 3.17Å; W694-K696 VanDerWaalsContact C-N 3.35Å; W694-E697 PolarHBondContact O-N 3.48Å; W694-E698 WeakPolarHBondContact O-CB 3.34Å; W694-E698 PolarHBondContact O-N 2.68Å
695	R	64.6	Low	67.3	Low	170 Å²	170	114.1 Å²	114.1	64%	0.642	59%	0.586	S	S	*	*	H	α-helix	trans	-74.7	-20.7	177.9	-76.5	-172.4	-71.9	179.7	-0.3	114.1	G691 E693 T699	G691-R695 PolarHBondContact O-NE 3.38Å; E693-R695 PolarHBondContact O-N 3.02Å; E693-R695 VanDerWaalsContact O-N 3.15Å; R695-T699 PolarHBondContact O-OG1 3.22Å
696	K	63	Low	66.6	Low	136 Å²	136	117.6 Å²	117.6	59%	0.591	59%	0.592	S	S	*	*	H	α-helix	trans	-77.8	-40.5	169.9	-70	166.3	-174.2	169.9	0	110.5	A692 E693 W694 T699 I700	A692-K696 WeakPolarHBondContact O-CG 3.33Å; A692-K696 PolarHBondContact O-N 3.45Å; E693-K696 WeakPolarHBondContact O-CA 3.41Å; E693-K696 WeakPolarHBondContact O-CB 3.46Å; E693-K696 PolarHBondContact O-N 3.43Å; W694-K696 VanDerWaalsContact C-N 3.35Å; K696-T699 PolarHBondContact O-N 3.37Å; K696-T699 PolarHBondContact O-OG1 2.91Å; K696-I700 WeakPolarHBondContact O-CD1 3.5Å; K696-I700 VanDerWaalsContact O-CG1 3.28Å; K696-I700 WeakPolarHBondContact O-CG1 3.22Å; K696-I700 PolarHBondContact O-N 3.13Å
697	E	56.8	Low	65.6	Low	105 Å²	105	117.4 Å²	117.4	49%	0.491	60%	0.597	S	S	.	*	H	α-helix	trans	-63	-42.4	175.6	-64.3	-169.5	151.2	0	0	111.7	E693 W694 T699 I700	E693-E697 PolarHBondContact O-N 2.79Å; W694-E697 PolarHBondContact O-N 3.48Å; E697-T699 PolarHBondContact O-N 3.01Å; E697-I700 PolarHBondContact O-N 3.22Å; E697-I700 VanDerWaalsContact O-N 3.13Å
698	E	56.4	Low	64.6	Low	151 Å²	151	121.4 Å²	121.4	71%	0.706	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-13.4	176.3	-164.2	176.4	-147.2	0	0	114	W694	W694-E698 WeakPolarHBondContact O-CB 3.34Å; W694-E698 PolarHBondContact O-N 2.68Å
699	T	56.5	Low	63.7	Low	114 Å²	114	126.1 Å²	126.1	70%	0.699	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	4.4	174.5	39.9	0	0	0	0	114.2	R695 K696 E697	R695-T699 PolarHBondContact O-OG1 3.22Å; K696-T699 PolarHBondContact O-N 3.37Å; K696-T699 PolarHBondContact O-OG1 2.91Å; E697-T699 PolarHBondContact O-N 3.01Å
700	I	52.7	Low	62.7	Low	143 Å²	143	125.1 Å²	125.1	73%	0.733	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-10.7	177.4	-69	167.9	0	0	0	111.8	K696 E697	K696-I700 WeakPolarHBondContact O-CD1 3.5Å; K696-I700 VanDerWaalsContact O-CG1 3.28Å; K696-I700 WeakPolarHBondContact O-CG1 3.22Å; K696-I700 PolarHBondContact O-N 3.13Å; E697-I700 PolarHBondContact O-N 3.22Å; E697-I700 VanDerWaalsContact O-N 3.13Å
701	L	41.4	Very low	61.3	Low	213 Å²	213	126.5 Å²	126.5	100%	1.115	62%	0.617	S	S	*	*			trans	-93.3	0	169.1	-68.6	170.2	0	0	0	112.1

Retrieved 701 of 701 residues in 618.4 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).