A0A096MQV4_PAPAN Loading...

Prelamin-A/C

Prelamin-A/C can accelerate smooth muscle cell senescence. It acts to disrupt mitosis and induce DNA damage in vascular smooth muscle cells (VSMCs), leading to mitotic failure, genomic instability, and premature senescence.

AlphaFold DB (A0A2K5VVA3), UniProt , Accession A0A096MQV4, Species PAPAN (Papio anubis, Olive baboon), Gene LMNA, Length 663 aa.

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(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	42.7	Very low	35.9	Very low	217 Å²	217	161.7 Å²	161.7	100%	1.069	81%	0.81	S	S	*	*				0	69.2	0	-57	-179.7	-173	0	0	108.3
2	E	33.8	Very low	35.7	Very low	188 Å²	188	158.4 Å²	158.4	88%	0.879	81%	0.814	S	S	*	*			cis	75	121.4	38.9	-66.4	159.4	110.8	0	0	114.7
3	T	47.7	Very low	35.4	Very low	133 Å²	133	151.5 Å²	151.5	82%	0.816	81%	0.805	S	S	*	*			trans	-87.5	164.8	167.1	51.4	0	0	0	0	110.5
4	P	49.9	Very low	35.2	Very low	124 Å²	124	147.6 Å²	147.6	81%	0.805	81%	0.806	S	S	*	*				-127.9	-158.1	88.7	42.5	-35.1	0	0	0	110.4
5	S	30	Very low	35.2	Very low	100 Å²	100	150.2 Å²	150.2	70%	0.699	81%	0.81	S	S	*	*			cis	-149.2	154.6	-6.1	-151.9	0	0	0	0	106.6
6	Q	32.4	Very low	35.2	Very low	139 Å²	139	146.4 Å²	146.4	65%	0.65	81%	0.806	S	S	*	*			cis	81.6	104.8	25	-66.8	-147.3	82.7	0	0	118.6
7	R	30.2	Very low	35.3	Very low	216 Å²	216	144.1 Å²	144.1	82%	0.815	80%	0.802	S	S	*	*			trans	75.8	153.7	131.4	-70.7	-176.7	172.4	-173.5	-1.4	119.5
8	R	28	Very low	35	Very low	217 Å²	217	142.7 Å²	142.7	82%	0.819	80%	0.804	S	S	*	*			cis	-174.1	126.2	-12.2	163.8	-177.9	-179.8	-134.3	5.5	114.2
9	A	33.9	Very low	35.4	Very low	80 Å²	80	142.1 Å²	142.1	66%	0.661	80%	0.804	S	S	*	*			trans	65.9	174.2	144.9	0	0	0	0	0	123.9
10	T	33.1	Very low	36.5	Very low	137 Å²	137	141.2 Å²	141.2	84%	0.84	80%	0.804	S	S	*	*			trans	90.2	147.6	169.7	70	0	0	0	0	118.5
11	R	33.5	Very low	36.4	Very low	228 Å²	228	142 Å²	142	86%	0.86	81%	0.805	S	S	*	*			cis	-172.1	151.8	-27.2	-171	176.1	-168.9	-175.3	2.1	110.4
12	S	33.1	Very low	36.4	Very low	122 Å²	122	136.4 Å²	136.4	85%	0.853	79%	0.787	S	S	*	*			trans	63.6	156.3	167.2	35.8	0	0	0	0	118.8
13	G	31.6	Very low	37.8	Very low	68 Å²	68	132.6 Å²	132.6	70%	0.701	78%	0.779	S	S	*	*			cis	172	-179.2	-6.2	0	0	0	0	0	114.2
14	A	33.2	Very low	37.5	Very low	98 Å²	98	132.5 Å²	132.5	81%	0.81	78%	0.778	S	S	*	*			trans	75.9	155.9	173.1	0	0	0	0	0	117.4
15	Q	35.4	Very low	37.3	Very low	186 Å²	186	137.4 Å²	137.4	87%	0.869	78%	0.78	S	S	*	*			cis	-162.6	150.2	-2	-140.1	170.1	-4.6	0	0	113.6
16	A	35	Very low	38.2	Very low	90 Å²	90	139.9 Å²	139.9	74%	0.744	78%	0.784	S	S	*	*			trans	55.9	161.2	149.3	0	0	0	0	0	122.5
17	S	36.2	Very low	39.1	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	79%	0.791	S	S	*	*			cis	-172.8	172.6	-31.3	63.3	0	0	0	0	112.5
18	S	31.3	Very low	40.3	Very low	118 Å²	118	140.4 Å²	140.4	83%	0.825	80%	0.795	S	S	*	*			trans	94.2	145.8	157	80.6	0	0	0	0	122.1
19	T	42.4	Very low	41.8	Very low	132 Å²	132	136.9 Å²	136.9	81%	0.81	79%	0.792	S	S	*	*			trans	-127.5	155.9	-176.1	27.3	0	0	0	0	112.6
20	P	57.5	Low	43	Very low	124 Å²	124	139.3 Å²	139.3	81%	0.805	79%	0.789	S	S	*	*			trans	-128.2	170.6	141.3	38.7	-28.7	0	0	0	112.2
21	L	34.2	Very low	44.2	Very low	159 Å²	159	140.2 Å²	140.2	83%	0.832	78%	0.784	S	S	*	*			trans	-164.9	159.5	179.7	-115.3	178.9	0	0	0	115.7
22	S	42.1	Very low	45.6	Very low	99 Å²	99	137.5 Å²	137.5	69%	0.692	78%	0.779	S	S	*	*			trans	73.1	170.3	154.5	-55.4	0	0	0	0	119.1
23	P	63.8	Low	47	Very low	107 Å²	107	137.5 Å²	137.5	70%	0.695	77%	0.765	S	S	*	*				-132.9	161.2	-63.3	35.5	-18.4	0	0	0	114
24	T	40.8	Very low	48.5	Very low	131 Å²	131	139.5 Å²	139.5	80%	0.804	76%	0.76	S	S	*	*				170.8	151.6	89.7	32.6	0	0	0	0	114.8
25	R	46.6	Very low	49.9	Very low	227 Å²	227	140.1 Å²	140.1	86%	0.857	75%	0.749	S	S	*	*			trans	60.9	129.9	151.9	-95.2	-175.4	173.7	-174.1	-1.9	122.5
26	I	48.8	Very low	51.1	Low	152 Å²	152	137.4 Å²	137.4	78%	0.779	74%	0.736	S	S	*	*			trans	76.7	127.8	156.5	-58	158.1	0	0	0	113.9
27	T	51.2	Low	52.7	Low	130 Å²	130	137.9 Å²	137.9	80%	0.798	72%	0.723	S	S	*	*			cis	-137	157.6	11.7	-31.3	0	0	0	0	112.7	L29	T27-L29 PolarHBondContact O-N 2.92Å
28	R	55.1	Low	54.2	Low	236 Å²	236	138.3 Å²	138.3	89%	0.891	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	4.9	-168.2	-101.8	179	177.2	157.8	-2.8	120
29	L	58.4	Low	55.8	Low	143 Å²	143	137.6 Å²	137.6	75%	0.749	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-38.1	-162.7	-151.7	74.2	0	0	0	115.1	T27 E31	T27-L29 PolarHBondContact O-N 2.92Å; L29-E31 PolarHBondContact O-N 2.77Å
30	Q	59.1	Low	56.9	Low	131 Å²	131	135.9 Å²	135.9	61%	0.612	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-66.3	-36.7	-167.6	-140.3	71.1	42.4	0	0	114.5	K32 E33	Q30-K32 PolarHBondContact O-N 2.89Å; Q30-E33 PolarHBondContact O-N 2.8Å; Q30-E33 VanDerWaalsContact O-N 3.14Å
31	E	58.9	Low	57.3	Low	157 Å²	157	137 Å²	137	73%	0.734	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-66.7	-5.6	-165.3	-160.1	169.6	-145.1	0	0	114.7	L29	L29-E31 PolarHBondContact O-N 2.77Å
32	K	62.3	Low	58.8	Low	171 Å²	171	134.6 Å²	134.6	74%	0.743	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-92.6	-26.5	178.1	-167.8	-176.7	174.3	-165.2	0	113.3	Q30	Q30-K32 PolarHBondContact O-N 2.89Å
33	E	63	Low	60.1	Low	121 Å²	121	132.2 Å²	132.2	57%	0.565	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-44.7	-172	-62.1	-178.5	144.4	0	0	111	Q30 L35 Q36 E37	Q30-E33 PolarHBondContact O-N 2.8Å; Q30-E33 VanDerWaalsContact O-N 3.14Å; E33-L35 PolarHBondContact O-N 2.74Å; E33-Q36 WeakPolarHBondContact O-CB 3.46Å; E33-Q36 PolarHBondContact O-N 3.1Å; E33-E37 PolarHBondContact O-N 3.09Å
34	D	62.5	Low	60.5	Low	111 Å²	111	132.1 Å²	132.1	59%	0.594	65%	0.648	S	S	*	*	H	α-helix	trans	-55.3	-35.7	177.8	-61.8	2.9	0	0	0	113.5	Q36 L38	D34-Q36 VanDerWaalsContact C-N 3.27Å; D34-Q36 PolarHBondContact O-N 3.15Å; D34-L38 PolarHBondContact O-N 3.48Å
35	L	62.6	Low	61.9	Low	110 Å²	110	134.1 Å²	134.1	58%	0.576	64%	0.642	S	S	*	*	H	α-helix	trans	-71.7	-19.1	178.5	-91.1	170.5	0	0	0	113.5	E33 N39	E33-L35 PolarHBondContact O-N 2.74Å; L35-N39 PolarHBondContact O-ND2 3.18Å
36	Q	62.4	Low	62.9	Low	129 Å²	129	127.4 Å²	127.4	60%	0.603	62%	0.622	S	S	*	*	H	α-helix	trans	-82.3	-46.7	174.7	-168.5	167.5	-25.8	0	0	110.8	E33 D34 L38 N39 D40	E33-Q36 WeakPolarHBondContact O-CB 3.46Å; E33-Q36 PolarHBondContact O-N 3.1Å; D34-Q36 VanDerWaalsContact C-N 3.27Å; D34-Q36 PolarHBondContact O-N 3.15Å; Q36-L38 PolarHBondContact O-N 3.46Å; Q36-N39 PolarHBondContact O-N 3.49Å; Q36-D40 PolarHBondContact O-N 3.47Å; Q36-D40 VanDerWaalsContact O-N 3.14Å
37	E	68.1	Low	64	Low	101 Å²	101	124.6 Å²	124.6	47%	0.472	61%	0.609	S	S	.	*	H	α-helix	trans	-55.8	-37.3	177.1	-169.3	-170.3	148.7	0	0	112.1	E33 N39 D40 R41	E33-E37 PolarHBondContact O-N 3.09Å; E37-N39 PolarHBondContact O-N 3.4Å; E37-D40 PolarHBondContact O-N 3.46Å; E37-R41 PolarHBondContact O-N 3.39Å; E37-R41 VanDerWaalsContact O-N 3.09Å; E37-R41 IonicContact OE1-CZ 3.49Å; E37-R41 IonicContact OE1-NH1 3.07Å; E37-R41 PolarHBondContact OE1-NH1 3.45Å; E37-R41 IonicContact OE1-NH2 2.69Å; E37-R41 PolarHBondContact OE1-NH2 3.32Å
38	L	67	Low	65.2	Low	116 Å²	116	125.1 Å²	125.1	61%	0.607	60%	0.596	S	S	*	*	H	α-helix	trans	-66	-35.3	179.3	-162.9	72.7	0	0	0	113.1	D34 Q36 L42	D34-L38 PolarHBondContact O-N 3.48Å; Q36-L38 PolarHBondContact O-N 3.46Å; L38-L42 PolarHBondContact O-N 2.63Å
39	N	65.4	Low	66.2	Low	102 Å²	102	117.4 Å²	117.4	55%	0.545	58%	0.575	S	S	.	*	H	α-helix	trans	-74.9	-41.5	177.8	-81.6	-78.2	0	0	0	111.6	L35 Q36 E37 R41 L42 A43	L35-N39 PolarHBondContact O-ND2 3.18Å; Q36-N39 PolarHBondContact O-N 3.49Å; E37-N39 PolarHBondContact O-N 3.4Å; N39-R41 VanDerWaalsContact C-N 3.3Å; N39-R41 PolarHBondContact O-N 3.4Å; N39-L42 WeakPolarHBondContact O-CB 3.18Å; N39-L42 PolarHBondContact O-N 3.44Å; N39-A43 PolarHBondContact O-N 3.48Å; N39-A43 VanDerWaalsContact O-N 3.16Å
40	D	65.9	Low	66.9	Low	96 Å²	96	117.7 Å²	117.7	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-62.1	-38.7	177.6	-67.4	-24.8	0	0	0	111.2	Q36 E37 L42 A43 V44	Q36-D40 PolarHBondContact O-N 3.47Å; Q36-D40 VanDerWaalsContact O-N 3.14Å; E37-D40 PolarHBondContact O-N 3.46Å; D40-L42 VanDerWaalsContact C-N 3.31Å; D40-L42 PolarHBondContact O-N 2.66Å; D40-A43 PolarHBondContact O-N 3.13Å; D40-V44 PolarHBondContact O-N 3.24Å
41	R	65.4	Low	67.8	Low	147 Å²	147	114 Å²	114	56%	0.555	56%	0.555	S	S	*	*	H	α-helix	trans	-59.3	-38	169.8	-86.6	-164.2	176	103	15.5	113.3	E37 N39 Y45	E37-R41 PolarHBondContact O-N 3.39Å; E37-R41 VanDerWaalsContact O-N 3.09Å; E37-R41 IonicContact OE1-CZ 3.49Å; E37-R41 IonicContact OE1-NH1 3.07Å; E37-R41 PolarHBondContact OE1-NH1 3.45Å; E37-R41 IonicContact OE1-NH2 2.69Å; E37-R41 PolarHBondContact OE1-NH2 3.32Å; N39-R41 VanDerWaalsContact C-N 3.3Å; N39-R41 PolarHBondContact O-N 3.4Å; R41-Y45 WeakPolarHBondContact O-CD2 3.44Å; R41-Y45 PolarHBondContact O-N 3.49Å
42	L	66.2	Low	68.7	Low	109 Å²	109	109.9 Å²	109.9	57%	0.571	54%	0.538	S	S	*	.	H	α-helix	trans	-69.2	-39	-177.1	-155.1	78.5	0	0	0	111.6	L38 N39 D40 Y45 I46	L38-L42 PolarHBondContact O-N 2.63Å; N39-L42 WeakPolarHBondContact O-CB 3.18Å; N39-L42 PolarHBondContact O-N 3.44Å; D40-L42 VanDerWaalsContact C-N 3.31Å; D40-L42 PolarHBondContact O-N 2.66Å; L42-Y45 PolarHBondContact O-N 3.48Å; L42-I46 WeakPolarHBondContact O-CG1 3.49Å; L42-I46 PolarHBondContact O-N 3.21Å; L42-I46 VanDerWaalsContact O-N 3.16Å
43	A	67.6	Low	69.4	Low	49 Å²	49	107.4 Å²	107.4	41%	0.405	53%	0.529	S	S	.	.	H	α-helix	trans	-59.9	-46.6	176.4	0	0	0	0	0	112.1	N39 D40 Y45 I46 D47	N39-A43 PolarHBondContact O-N 3.48Å; N39-A43 VanDerWaalsContact O-N 3.16Å; D40-A43 PolarHBondContact O-N 3.13Å; A43-Y45 VanDerWaalsContact C-N 3.26Å; A43-Y45 PolarHBondContact O-N 3.37Å; A43-I46 PolarHBondContact O-N 3.32Å; A43-D47 PolarHBondContact O-N 3.47Å; A43-D47 VanDerWaalsContact O-N 3.1Å
44	V	72.4	Confident	70.2	Confident	105 Å²	105	106.5 Å²	106.5	64%	0.636	53%	0.532	S	S	*	.	H	α-helix	trans	-58.3	-37.2	178.1	174.7	0	0	0	0	112.2	D40 R48	D40-V44 PolarHBondContact O-N 3.24Å; V44-R48 WeakPolarHBondContact O-CB 3.5Å; V44-R48 PolarHBondContact O-N 3.27Å; V44-R48 VanDerWaalsContact O-N 3.16Å
45	Y	71.4	Confident	71.1	Confident	173 Å²	173	106.4 Å²	106.4	68%	0.678	53%	0.528	S	S	*	.	H	α-helix	trans	-69.2	-39.7	174.9	-91.6	-76.9	0	0	0	113	R41 L42 A43 R48 V49	R41-Y45 WeakPolarHBondContact O-CD2 3.44Å; R41-Y45 PolarHBondContact O-N 3.49Å; L42-Y45 PolarHBondContact O-N 3.48Å; A43-Y45 VanDerWaalsContact C-N 3.26Å; A43-Y45 PolarHBondContact O-N 3.37Å; Y45-R48 PolarHBondContact O-N 3.09Å; Y45-V49 WeakPolarHBondContact O-CG2 3.42Å; Y45-V49 PolarHBondContact O-N 3.18Å
46	I	67.4	Low	71.8	Confident	86 Å²	86	105.2 Å²	105.2	44%	0.441	52%	0.522	S	S	.	.	H	α-helix	trans	-63.7	-45.5	179.7	-69.3	166.6	0	0	0	111	L42 A43 R48 V49 R50	L42-I46 WeakPolarHBondContact O-CG1 3.49Å; L42-I46 PolarHBondContact O-N 3.21Å; L42-I46 VanDerWaalsContact O-N 3.16Å; A43-I46 PolarHBondContact O-N 3.32Å; I46-R48 VanDerWaalsContact C-N 3.32Å; I46-R48 PolarHBondContact O-N 3.1Å; I46-V49 PolarHBondContact O-N 3.33Å; I46-R50 PolarHBondContact O-N 3.33Å; I46-R50 VanDerWaalsContact O-N 3.09Å
47	D	72.5	Confident	72.6	Confident	93 Å²	93	102 Å²	102	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-69.3	-31.6	177.9	-71.9	-27.7	0	0	0	112.2	A43 R50 S51	A43-D47 PolarHBondContact O-N 3.47Å; A43-D47 VanDerWaalsContact O-N 3.1Å; D47-R50 PolarHBondContact O-N 3.29Å; D47-R50 IonicContact OD1-NH1 2.7Å; D47-R50 PolarHBondContact OD1-NH1 3.4Å; D47-S51 PolarHBondContact O-N 3.05Å
48	R	75	Confident	73.3	Confident	141 Å²	141	98.9 Å²	98.9	53%	0.532	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-36.5	172.5	-172.2	56.5	178.5	160.5	3.7	112.7	V44 Y45 I46 L52	V44-R48 WeakPolarHBondContact O-CB 3.5Å; V44-R48 PolarHBondContact O-N 3.27Å; V44-R48 VanDerWaalsContact O-N 3.16Å; Y45-R48 PolarHBondContact O-N 3.09Å; I46-R48 VanDerWaalsContact C-N 3.32Å; I46-R48 PolarHBondContact O-N 3.1Å; R48-L52 HydrophobicContact CG-CD1 4.47Å; R48-L52 WeakPolarHBondContact O-CG 3.4Å; R48-L52 PolarHBondContact O-N 3.31Å
49	V	75.8	Confident	74	Confident	75 Å²	75	97.5 Å²	97.5	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-48.7	173.9	170.8	0	0	0	0	110.8	Y45 I46 S51 L52 E53	Y45-V49 WeakPolarHBondContact O-CG2 3.42Å; Y45-V49 PolarHBondContact O-N 3.18Å; I46-V49 PolarHBondContact O-N 3.33Å; V49-S51 VanDerWaalsContact C-N 3.26Å; V49-S51 PolarHBondContact O-N 3.14Å; V49-L52 WeakPolarHBondContact O-CA 3.38Å; V49-L52 PolarHBondContact O-N 3.04Å; V49-E53 HydrophobicContact CG1-CG 4.26Å; V49-E53 WeakPolarHBondContact O-CG 3.4Å; V49-E53 PolarHBondContact O-N 3.07Å
50	R	73.6	Confident	74.7	Confident	148 Å²	148	101.2 Å²	101.2	56%	0.558	51%	0.512	S	S	*	.	H	α-helix	trans	-56.5	-38.9	177.4	-72.6	170	166.9	171.7	-6.6	113.2	I46 D47 E53 T54	I46-R50 PolarHBondContact O-N 3.33Å; I46-R50 VanDerWaalsContact O-N 3.09Å; D47-R50 PolarHBondContact O-N 3.29Å; D47-R50 IonicContact OD1-NH1 2.7Å; D47-R50 PolarHBondContact OD1-NH1 3.4Å; R50-E53 PolarHBondContact O-N 3.41Å; R50-T54 WeakPolarHBondContact O-CB 3.05Å; R50-T54 PolarHBondContact O-N 3.46Å; R50-T54 PolarHBondContact O-OG1 3.23Å
51	S	78.3	Confident	75.6	Confident	54 Å²	54	101.2 Å²	101.2	38%	0.378	51%	0.511	S	S	.	.	H	α-helix	trans	-60.1	-43.7	173.4	-179.1	0	0	0	0	112.1	D47 V49 T54 E55	D47-S51 PolarHBondContact O-N 3.05Å; V49-S51 VanDerWaalsContact C-N 3.26Å; V49-S51 PolarHBondContact O-N 3.14Å; S51-T54 PolarHBondContact O-N 2.93Å; S51-E55 WeakPolarHBondContact O-CB 3.37Å; S51-E55 PolarHBondContact O-N 2.77Å
52	L	77.6	Confident	76.3	Confident	71 Å²	71	102.7 Å²	102.7	37%	0.372	52%	0.517	S	S	.	.	H	α-helix	trans	-74.8	-29.7	-178.8	-69.3	167.9	0	0	0	113.1	R48 V49 N56	R48-L52 HydrophobicContact CG-CD1 4.47Å; R48-L52 WeakPolarHBondContact O-CG 3.4Å; R48-L52 PolarHBondContact O-N 3.31Å; V49-L52 WeakPolarHBondContact O-CA 3.38Å; V49-L52 PolarHBondContact O-N 3.04Å; L52-N56 WeakPolarHBondContact O-CB 3.43Å; L52-N56 PolarHBondContact O-N 3.14Å; L52-N56 PolarHBondContact O-ND2 3.39Å
53	E	78.1	Confident	77	Confident	119 Å²	119	101.9 Å²	101.9	56%	0.556	51%	0.512	S	S	*	.	H	α-helix	trans	-66.8	-44.1	171	-70.1	175.9	146.5	0	0	111.1	V49 R50 N56 A57	V49-E53 HydrophobicContact CG1-CG 4.26Å; V49-E53 WeakPolarHBondContact O-CG 3.4Å; V49-E53 PolarHBondContact O-N 3.07Å; R50-E53 PolarHBondContact O-N 3.41Å; E53-N56 WeakPolarHBondContact O-CB 3.49Å; E53-N56 PolarHBondContact O-N 3.04Å; E53-A57 PolarHBondContact O-N 3.17Å
54	T	79.4	Confident	77.8	Confident	102 Å²	102	103.2 Å²	103.2	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-42.7	176.9	-52.3	0	0	0	0	111.4	R50 S51 A57 G58	R50-T54 WeakPolarHBondContact O-CB 3.05Å; R50-T54 PolarHBondContact O-N 3.46Å; R50-T54 PolarHBondContact O-OG1 3.23Å; S51-T54 PolarHBondContact O-N 2.93Å; T54-A57 PolarHBondContact O-N 3.46Å; T54-G58 PolarHBondContact O-N 3.45Å; T54-G58 VanDerWaalsContact O-N 3.12Å
55	E	80	Confident	78.5	Confident	108 Å²	108	103 Å²	103	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-41.4	175.2	-172.2	170.3	-163.5	0	0	111.9	S51 A57 G58 L59	S51-E55 WeakPolarHBondContact O-CB 3.37Å; S51-E55 PolarHBondContact O-N 2.77Å; E55-A57 VanDerWaalsContact C-N 3.34Å; E55-A57 PolarHBondContact O-N 3.42Å; E55-G58 PolarHBondContact O-N 3.17Å; E55-L59 HydrophobicContact CG-CD1 4.32Å; E55-L59 WeakPolarHBondContact O-CG 3.49Å; E55-L59 PolarHBondContact O-N 3.17Å
56	N	77.4	Confident	79	Confident	86 Å²	86	97.8 Å²	97.8	46%	0.46	50%	0.496	S	S	.	.	H	α-helix	trans	-59.7	-40.6	173	-100.1	-88.1	0	0	0	113	L52 E53 L59 R60	L52-N56 WeakPolarHBondContact O-CB 3.43Å; L52-N56 PolarHBondContact O-N 3.14Å; L52-N56 PolarHBondContact O-ND2 3.39Å; E53-N56 WeakPolarHBondContact O-CB 3.49Å; E53-N56 PolarHBondContact O-N 3.04Å; N56-L59 PolarHBondContact O-N 3.36Å; N56-R60 VanDerWaalsContact O-CG 3.31Å; N56-R60 WeakPolarHBondContact O-CG 3.36Å; N56-R60 PolarHBondContact O-N 3.03Å
57	A	80.9	Confident	79.9	Confident	60 Å²	60	99.7 Å²	99.7	50%	0.496	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-44.5	177.3	0	0	0	0	0	111.6	E53 T54 E55 R60 L61	E53-A57 PolarHBondContact O-N 3.17Å; T54-A57 PolarHBondContact O-N 3.46Å; E55-A57 VanDerWaalsContact C-N 3.34Å; E55-A57 PolarHBondContact O-N 3.42Å; A57-R60 PolarHBondContact O-N 3.19Å; A57-L61 PolarHBondContact O-N 3.06Å; A57-L61 VanDerWaalsContact O-N 3.13Å
58	G	81.8	Confident	80.6	Confident	37 Å²	37	100.9 Å²	100.9	38%	0.381	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-38.3	176.2	0	0	0	0	0	113.7	T54 E55 L61 R62	T54-G58 PolarHBondContact O-N 3.45Å; T54-G58 VanDerWaalsContact O-N 3.12Å; E55-G58 PolarHBondContact O-N 3.17Å; G58-L61 PolarHBondContact O-N 2.75Å; G58-R62 PolarHBondContact O-N 2.99Å
59	L	80.9	Confident	81.2	Confident	87 Å²	87	97.9 Å²	97.9	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-65.5	-40	174.9	-72.8	170.3	0	0	0	112.2	E55 N56 R62 I63	E55-L59 HydrophobicContact CG-CD1 4.32Å; E55-L59 WeakPolarHBondContact O-CG 3.49Å; E55-L59 PolarHBondContact O-N 3.17Å; N56-L59 PolarHBondContact O-N 3.36Å; L59-R62 PolarHBondContact O-N 3.36Å; L59-I63 WeakPolarHBondContact O-CG1 3.3Å; L59-I63 PolarHBondContact O-N 3.48Å; L59-I63 VanDerWaalsContact O-N 3.12Å
60	R	81.7	Confident	81.7	Confident	179 Å²	179	98.5 Å²	98.5	68%	0.675	51%	0.507	S	S	*	.	H	α-helix	trans	-63.3	-41.8	176	-74.2	171.1	-179	-127.8	0.7	112.4	N56 A57 I63 T64	N56-R60 VanDerWaalsContact O-CG 3.31Å; N56-R60 WeakPolarHBondContact O-CG 3.36Å; N56-R60 PolarHBondContact O-N 3.03Å; A57-R60 PolarHBondContact O-N 3.19Å; R60-I63 PolarHBondContact O-N 3.24Å; R60-T64 PolarHBondContact O-N 3.2Å; R60-T64 PolarHBondContact O-OG1 3.46Å
61	L	83.2	Confident	82.4	Confident	96 Å²	96	94.5 Å²	94.5	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-61.3	-47.5	176.7	-177.4	63.2	0	0	0	111.3	A57 G58 I63 T64 E65	A57-L61 PolarHBondContact O-N 3.06Å; A57-L61 VanDerWaalsContact O-N 3.13Å; G58-L61 PolarHBondContact O-N 2.75Å; L61-I63 VanDerWaalsContact C-N 3.28Å; L61-I63 PolarHBondContact O-N 2.85Å; L61-T64 PolarHBondContact O-N 3.13Å; L61-T64 VanDerWaalsContact O-N 3.15Å; L61-T64 PolarHBondContact O-OG1 3.35Å; L61-E65 HydrophobicContact CD1-CG 4.33Å; L61-E65 HydrophobicContact CG-CG 4.29Å; L61-E65 WeakPolarHBondContact O-CG 3.5Å; L61-E65 PolarHBondContact O-N 3.36Å
62	R	81.3	Confident	82.9	Confident	179 Å²	179	100.3 Å²	100.3	68%	0.675	52%	0.515	S	S	*	.	H	α-helix	trans	-59.2	-35.8	176.7	-76.5	-173.6	-178.3	167.2	2.7	113.5	G58 L59 S66	G58-R62 PolarHBondContact O-N 2.99Å; L59-R62 PolarHBondContact O-N 3.36Å; R62-S66 VanDerWaalsContact O-CB 3.26Å; R62-S66 WeakPolarHBondContact O-CB 3.34Å; R62-S66 PolarHBondContact O-N 3.5Å; R62-S66 PolarHBondContact O-OG 2.68Å; R62-S66 VanDerWaalsContact O-OG 3.14Å
63	I	81.6	Confident	83.4	Confident	91 Å²	91	102.6 Å²	102.6	47%	0.467	52%	0.524	S	S	.	.	H	α-helix	trans	-60.6	-54.5	174.7	-70.4	165.2	0	0	0	109.1	L59 R60 L61 E65 S66 E67	L59-I63 WeakPolarHBondContact O-CG1 3.3Å; L59-I63 PolarHBondContact O-N 3.48Å; L59-I63 VanDerWaalsContact O-N 3.12Å; R60-I63 PolarHBondContact O-N 3.24Å; L61-I63 VanDerWaalsContact C-N 3.28Å; L61-I63 PolarHBondContact O-N 2.85Å; I63-E65 PolarHBondContact O-N 3.24Å; I63-S66 PolarHBondContact O-N 3.39Å; I63-S66 VanDerWaalsContact O-N 3.14Å; I63-S66 PolarHBondContact O-OG 2.65Å; I63-E67 HydrophobicContact CG2-CG 4.49Å; I63-E67 WeakPolarHBondContact O-CG 3.43Å; I63-E67 PolarHBondContact O-N 3.09Å
64	T	83.9	Confident	84	Confident	78 Å²	78	101.1 Å²	101.1	48%	0.479	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-39.1	179.3	45.8	0	0	0	0	113.5	R60 L61 E68	R60-T64 PolarHBondContact O-N 3.2Å; R60-T64 PolarHBondContact O-OG1 3.46Å; L61-T64 PolarHBondContact O-N 3.13Å; L61-T64 VanDerWaalsContact O-N 3.15Å; L61-T64 PolarHBondContact O-OG1 3.35Å; T64-E68 PolarHBondContact O-N 2.98Å
65	E	86.1	Confident	84.5	Confident	101 Å²	101	99.5 Å²	99.5	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-42.7	174.6	-70.5	172.3	153.7	0	0	111.4	L61 I63 E68 V69	L61-E65 HydrophobicContact CD1-CG 4.33Å; L61-E65 HydrophobicContact CG-CG 4.29Å; L61-E65 WeakPolarHBondContact O-CG 3.5Å; L61-E65 PolarHBondContact O-N 3.36Å; I63-E65 PolarHBondContact O-N 3.24Å; E65-E68 PolarHBondContact O-N 3.44Å; E65-V69 WeakPolarHBondContact O-CB 3.43Å; E65-V69 VanDerWaalsContact O-CG2 3.29Å; E65-V69 WeakPolarHBondContact O-CG2 3.48Å; E65-V69 PolarHBondContact O-N 3.24Å
66	S	83.1	Confident	85.1	Confident	63 Å²	63	96.3 Å²	96.3	44%	0.441	51%	0.512	S	S	.	.	H	α-helix	trans	-68.1	-37.7	178.8	70.9	0	0	0	0	112.8	R62 I63 V69 V70	R62-S66 VanDerWaalsContact O-CB 3.26Å; R62-S66 WeakPolarHBondContact O-CB 3.34Å; R62-S66 PolarHBondContact O-N 3.5Å; R62-S66 PolarHBondContact O-OG 2.68Å; R62-S66 VanDerWaalsContact O-OG 3.14Å; I63-S66 PolarHBondContact O-N 3.39Å; I63-S66 VanDerWaalsContact O-N 3.14Å; I63-S66 PolarHBondContact O-OG 2.65Å; S66-V69 PolarHBondContact O-N 3.23Å; S66-V70 WeakPolarHBondContact O-CB 3.42Å; S66-V70 VanDerWaalsContact O-CG2 3.29Å; S66-V70 WeakPolarHBondContact O-CG2 3.5Å; S66-V70 PolarHBondContact O-N 2.86Å
67	E	85.4	Confident	85.8	Confident	125 Å²	125	96.7 Å²	96.7	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-65.4	-41.6	175	-72.3	176.4	172.1	0	0	111.2	I63 S71	I63-E67 HydrophobicContact CG2-CG 4.49Å; I63-E67 WeakPolarHBondContact O-CG 3.43Å; I63-E67 PolarHBondContact O-N 3.09Å; E67-S71 WeakPolarHBondContact O-CB 3.44Å; E67-S71 PolarHBondContact O-N 3.02Å
68	E	86.9	Confident	86.4	Confident	119 Å²	119	101 Å²	101	56%	0.556	52%	0.521	S	S	*	.	H	α-helix	trans	-72.1	-37.3	176.6	-166.5	174.7	152.7	0	0	112.6	T64 E65 S71 R72	T64-E68 PolarHBondContact O-N 2.98Å; E65-E68 PolarHBondContact O-N 3.44Å; E68-S71 WeakPolarHBondContact O-CB 3.3Å; E68-S71 PolarHBondContact O-N 3.46Å; E68-R72 HydrophobicContact CG-CG 4.47Å; E68-R72 WeakPolarHBondContact O-CB 3.41Å; E68-R72 VanDerWaalsContact O-CG 3.3Å; E68-R72 WeakPolarHBondContact O-CG 3.46Å; E68-R72 PolarHBondContact O-N 3.09Å; E68-R72 IonicContact OE1-NH1 2.64Å
69	V	87.2	Confident	86.9	Confident	77 Å²	77	102.4 Å²	102.4	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-61.1	-50.4	173.1	168.2	0	0	0	0	110.7	E65 S66 S71 R72 E73	E65-V69 WeakPolarHBondContact O-CB 3.43Å; E65-V69 VanDerWaalsContact O-CG2 3.29Å; E65-V69 WeakPolarHBondContact O-CG2 3.48Å; E65-V69 PolarHBondContact O-N 3.24Å; S66-V69 PolarHBondContact O-N 3.23Å; V69-S71 VanDerWaalsContact C-N 3.28Å; V69-S71 PolarHBondContact O-N 3.42Å; V69-R72 PolarHBondContact O-N 3.35Å; V69-R72 VanDerWaalsContact O-N 3.09Å; V69-E73 HydrophobicContact CG1-CG 4.36Å; V69-E73 WeakPolarHBondContact O-CG 3.32Å; V69-E73 PolarHBondContact O-N 3.46Å
70	V	87.5	Confident	87.5	Confident	89 Å²	89	100.6 Å²	100.6	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-60.4	-38.9	177	170	0	0	0	0	111.3	S66 R72 E73 V74	S66-V70 WeakPolarHBondContact O-CB 3.42Å; S66-V70 VanDerWaalsContact O-CG2 3.29Å; S66-V70 WeakPolarHBondContact O-CG2 3.5Å; S66-V70 PolarHBondContact O-N 2.86Å; V70-R72 PolarHBondContact O-N 3.48Å; V70-E73 PolarHBondContact O-N 3.25Å; V70-V74 WeakPolarHBondContact O-CG1 3.38Å; V70-V74 PolarHBondContact O-N 3.32Å
71	S	88.6	Confident	88.1	Confident	64 Å²	64	98.9 Å²	98.9	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-39.6	174.6	-174.7	0	0	0	0	112.7	E67 E68 V69 V74 S75	E67-S71 WeakPolarHBondContact O-CB 3.44Å; E67-S71 PolarHBondContact O-N 3.02Å; E68-S71 WeakPolarHBondContact O-CB 3.3Å; E68-S71 PolarHBondContact O-N 3.46Å; V69-S71 VanDerWaalsContact C-N 3.28Å; V69-S71 PolarHBondContact O-N 3.42Å; S71-V74 WeakPolarHBondContact O-CG1 3.36Å; S71-S75 VanDerWaalsContact O-CB 3.24Å; S71-S75 WeakPolarHBondContact O-CB 3.4Å; S71-S75 PolarHBondContact O-N 3.37Å; S71-S75 VanDerWaalsContact O-N 3.11Å; S71-S75 PolarHBondContact O-OG 2.91Å
72	R	88.1	Confident	88.6	Confident	176 Å²	176	99 Å²	99	66%	0.664	52%	0.519	S	S	*	.	H	α-helix	trans	-74	-38.1	176.3	-70.1	174.7	73.9	127.3	1.7	112.3	E68 V69 V70 S75 G76	E68-R72 HydrophobicContact CG-CG 4.47Å; E68-R72 WeakPolarHBondContact O-CB 3.41Å; E68-R72 VanDerWaalsContact O-CG 3.3Å; E68-R72 WeakPolarHBondContact O-CG 3.46Å; E68-R72 PolarHBondContact O-N 3.09Å; E68-R72 IonicContact OE1-NH1 2.64Å; V69-R72 PolarHBondContact O-N 3.35Å; V69-R72 VanDerWaalsContact O-N 3.09Å; V70-R72 PolarHBondContact O-N 3.48Å; R72-S75 PolarHBondContact O-N 3.48Å; R72-G76 PolarHBondContact O-N 2.74Å
73	E	88.5	Confident	89.3	Confident	118 Å²	118	93.2 Å²	93.2	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-64.1	-50.2	175.3	-73.9	-178.6	167.4	0	0	111.5	V69 V70 S75 G76 I77	V69-E73 HydrophobicContact CG1-CG 4.36Å; V69-E73 WeakPolarHBondContact O-CG 3.32Å; V69-E73 PolarHBondContact O-N 3.46Å; V70-E73 PolarHBondContact O-N 3.25Å; E73-S75 VanDerWaalsContact C-N 3.27Å; E73-S75 PolarHBondContact O-N 3.49Å; E73-G76 PolarHBondContact O-N 3.45Å; E73-G76 VanDerWaalsContact O-N 3.13Å; E73-I77 WeakPolarHBondContact O-CG1 3.46Å; E73-I77 PolarHBondContact O-N 3.45Å
74	V	90.2	Very high	89.9	Confident	89 Å²	89	94.8 Å²	94.8	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-33.4	177.3	74.7	0	0	0	0	111.9	V70 S71 K78	V70-V74 WeakPolarHBondContact O-CG1 3.38Å; V70-V74 PolarHBondContact O-N 3.32Å; S71-V74 WeakPolarHBondContact O-CG1 3.36Å; V74-K78 VanDerWaalsContact O-CB 3.22Å; V74-K78 WeakPolarHBondContact O-CB 3.48Å; V74-K78 PolarHBondContact O-N 3.15Å
75	S	90.6	Very high	90.4	Very high	67 Å²	67	95.1 Å²	95.1	47%	0.469	51%	0.513	S	S	.	.	H	α-helix	trans	-68.3	-38.7	173.4	-63	0	0	0	0	112.5	S71 R72 E73 A79	S71-S75 VanDerWaalsContact O-CB 3.24Å; S71-S75 WeakPolarHBondContact O-CB 3.4Å; S71-S75 PolarHBondContact O-N 3.37Å; S71-S75 VanDerWaalsContact O-N 3.11Å; S71-S75 PolarHBondContact O-OG 2.91Å; R72-S75 PolarHBondContact O-N 3.48Å; E73-S75 VanDerWaalsContact C-N 3.27Å; E73-S75 PolarHBondContact O-N 3.49Å; S75-A79 WeakPolarHBondContact O-CB 3.48Å; S75-A79 PolarHBondContact O-N 3.43Å
76	G	92	Very high	90.8	Very high	42 Å²	42	91.1 Å²	91.1	43%	0.433	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-45.5	175.2	0	0	0	0	0	112.6	R72 E73 K78 A79 A80	R72-G76 PolarHBondContact O-N 2.74Å; E73-G76 PolarHBondContact O-N 3.45Å; E73-G76 VanDerWaalsContact O-N 3.13Å; G76-K78 VanDerWaalsContact C-N 3.34Å; G76-K78 PolarHBondContact O-N 3.26Å; G76-A79 PolarHBondContact O-N 3.22Å; G76-A80 PolarHBondContact O-N 2.97Å
77	I	92.5	Very high	91.4	Very high	93 Å²	93	92.3 Å²	92.3	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-43.5	174.6	-66.9	163.9	0	0	0	110.4	E73 A79 A80 Y81	E73-I77 WeakPolarHBondContact O-CG1 3.46Å; E73-I77 PolarHBondContact O-N 3.45Å; I77-A79 PolarHBondContact O-N 3.33Å; I77-A80 PolarHBondContact O-N 3.42Å; I77-Y81 HydrophobicContact CG2-CD2 3.73Å; I77-Y81 HydrophobicContact CG2-CE2 3.46Å; I77-Y81 VanDerWaalsContact CG2-CE2 3.46Å; I77-Y81 PolarHBondContact O-N 3.5Å
78	K	93	Very high	91.9	Very high	151 Å²	151	88.9 Å²	88.9	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-60.5	-42.5	174.4	-178.2	-178.5	177.5	-176.4	0	112.2	V74 G76 E82	V74-K78 VanDerWaalsContact O-CB 3.22Å; V74-K78 WeakPolarHBondContact O-CB 3.48Å; V74-K78 PolarHBondContact O-N 3.15Å; G76-K78 VanDerWaalsContact C-N 3.34Å; G76-K78 PolarHBondContact O-N 3.26Å; K78-E82 WeakPolarHBondContact O-CB 3.38Å; K78-E82 PolarHBondContact O-N 3.34Å
79	A	93.8	Very high	92.3	Very high	66 Å²	66	89.4 Å²	89.4	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-39.1	177.6	0	0	0	0	0	112.2	S75 G76 I77 A83	S75-A79 WeakPolarHBondContact O-CB 3.48Å; S75-A79 PolarHBondContact O-N 3.43Å; G76-A79 PolarHBondContact O-N 3.22Å; I77-A79 PolarHBondContact O-N 3.33Å; A79-A83 WeakPolarHBondContact O-CB 3.38Å; A79-A83 PolarHBondContact O-N 2.72Å
80	A	93.1	Very high	92.7	Very high	49 Å²	49	92.1 Å²	92.1	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-50.6	174	0	0	0	0	0	111.5	G76 I77 E82 A83 E84	G76-A80 PolarHBondContact O-N 2.97Å; I77-A80 PolarHBondContact O-N 3.42Å; A80-E82 PolarHBondContact O-N 2.92Å; A80-A83 WeakPolarHBondContact O-CB 3.49Å; A80-A83 PolarHBondContact O-N 3.39Å; A80-E84 WeakPolarHBondContact O-CG 3.49Å; A80-E84 PolarHBondContact O-N 3.5Å
81	Y	93.3	Very high	93.2	Very high	144 Å²	144	91.9 Å²	91.9	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-65.1	-36	178.4	-71.5	-37.9	0	0	0	113.5	I77 A83 E84 L85	I77-Y81 HydrophobicContact CG2-CD2 3.73Å; I77-Y81 HydrophobicContact CG2-CE2 3.46Å; I77-Y81 VanDerWaalsContact CG2-CE2 3.46Å; I77-Y81 PolarHBondContact O-N 3.5Å; Y81-A83 VanDerWaalsContact C-N 3.32Å; Y81-E84 PolarHBondContact O-N 3.13Å; Y81-L85 VanDerWaalsContact O-CB 3.28Å; Y81-L85 WeakPolarHBondContact O-CB 3.33Å; Y81-L85 WeakPolarHBondContact O-CG 3.45Å; Y81-L85 PolarHBondContact O-N 2.97Å
82	E	94.6	Very high	93.5	Very high	98 Å²	98	94.4 Å²	94.4	46%	0.458	50%	0.502	S	S	.	.	H	α-helix	trans	-70.7	-29.5	175	-162.6	68.1	-122.5	0	0	111.9	K78 A80 G86 R89	K78-E82 WeakPolarHBondContact O-CB 3.38Å; K78-E82 PolarHBondContact O-N 3.34Å; A80-E82 PolarHBondContact O-N 2.92Å; E82-G86 PolarHBondContact O-N 2.95Å; E82-R89 IonicContact OE1-CZ 3.95Å; E82-R89 IonicContact OE1-NH1 3.06Å; E82-R89 PolarHBondContact OE1-NH1 3.16Å; E82-R89 IonicContact OE1-NH2 3.23Å; E82-R89 PolarHBondContact OE1-NH2 2.7Å
83	A	95	Very high	93.9	Very high	57 Å²	57	91 Å²	91	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-69.2	-46.9	171.2	0	0	0	0	0	111.9	A79 A80 Y81 L85 G86 D87	A79-A83 WeakPolarHBondContact O-CB 3.38Å; A79-A83 PolarHBondContact O-N 2.72Å; A80-A83 WeakPolarHBondContact O-CB 3.49Å; A80-A83 PolarHBondContact O-N 3.39Å; Y81-A83 VanDerWaalsContact C-N 3.32Å; A83-L85 PolarHBondContact O-N 2.76Å; A83-G86 CarbonylContact O-C 3.55Å; A83-G86 WeakPolarHBondContact O-CA 3.43Å; A83-G86 PolarHBondContact O-N 3.06Å; A83-D87 PolarHBondContact O-N 3.49Å
84	E	95	Very high	94.3	Very high	125 Å²	125	88.6 Å²	88.6	58%	0.584	49%	0.494	S	S	*	.	H	α-helix	trans	-59.4	-44.6	174.3	-72.7	178.6	179.3	0	0	111.7	A80 Y81 G86 D87 A88	A80-E84 WeakPolarHBondContact O-CG 3.49Å; A80-E84 PolarHBondContact O-N 3.5Å; Y81-E84 PolarHBondContact O-N 3.13Å; E84-G86 VanDerWaalsContact C-N 3.3Å; E84-G86 PolarHBondContact O-N 3.23Å; E84-D87 PolarHBondContact O-N 3.29Å; E84-A88 VanDerWaalsContact O-CB 3.24Å; E84-A88 WeakPolarHBondContact O-CB 3.48Å; E84-A88 PolarHBondContact O-N 3.36Å
85	L	94.4	Very high	94.6	Very high	84 Å²	84	89.1 Å²	89.1	44%	0.44	50%	0.497	S	S	.	.	H	α-helix	trans	-63.3	-36.1	172.5	-73.1	170.2	0	0	0	112	Y81 A83 R89	Y81-L85 VanDerWaalsContact O-CB 3.28Å; Y81-L85 WeakPolarHBondContact O-CB 3.33Å; Y81-L85 WeakPolarHBondContact O-CG 3.45Å; Y81-L85 PolarHBondContact O-N 2.97Å; A83-L85 PolarHBondContact O-N 2.76Å; L85-R89 WeakPolarHBondContact O-CB 3.41Å; L85-R89 VanDerWaalsContact O-CD 3.31Å; L85-R89 WeakPolarHBondContact O-CD 3.48Å; L85-R89 WeakPolarHBondContact O-CG 3.47Å; L85-R89 PolarHBondContact O-N 2.89Å
86	G	94.9	Very high	94.8	Very high	18 Å²	18	88.1 Å²	88.1	19%	0.186	49%	0.493	C	S	.	.	H	α-helix	trans	-61.6	-46.6	174	0	0	0	0	0	112.8	E82 A83 E84 R89 K90	E82-G86 PolarHBondContact O-N 2.95Å; A83-G86 CarbonylContact O-C 3.55Å; A83-G86 WeakPolarHBondContact O-CA 3.43Å; A83-G86 PolarHBondContact O-N 3.06Å; E84-G86 VanDerWaalsContact C-N 3.3Å; E84-G86 PolarHBondContact O-N 3.23Å; G86-R89 PolarHBondContact O-N 3.22Å; G86-K90 WeakPolarHBondContact O-CG 3.35Å; G86-K90 PolarHBondContact O-N 2.83Å
87	D	95.8	Very high	95	Very high	88 Å²	88	93.4 Å²	93.4	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-76.7	-31.7	179.4	-72.9	-18.7	0	0	0	112.6	A83 E84 R89 K90 T91	A83-D87 PolarHBondContact O-N 3.49Å; E84-D87 PolarHBondContact O-N 3.29Å; D87-R89 VanDerWaalsContact C-N 3.34Å; D87-K90 PolarHBondContact O-N 3.26Å; D87-K90 WeakPolarHBondContact OD1-CD 3.49Å; D87-K90 WeakPolarHBondContact OD1-CE 3.35Å; D87-K90 IonicContact OD1-NZ 2.73Å; D87-K90 PolarHBondContact OD1-NZ 3.13Å; D87-T91 WeakPolarHBondContact O-CB 3.49Å; D87-T91 WeakPolarHBondContact O-CG2 3.48Å; D87-T91 PolarHBondContact O-N 3.44Å; D87-T91 PolarHBondContact O-OG1 3.16Å
88	A	94.4	Very high	95.2	Very high	53 Å²	53	92.8 Å²	92.8	44%	0.438	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-40.4	168	0	0	0	0	0	111.9	E84 T91 L92	E84-A88 VanDerWaalsContact O-CB 3.24Å; E84-A88 WeakPolarHBondContact O-CB 3.48Å; E84-A88 PolarHBondContact O-N 3.36Å; A88-T91 WeakPolarHBondContact CA-OG1 3.39Å; A88-T91 PolarHBondContact O-OG1 3.35Å; A88-T91 VanDerWaalsContact O-OG1 3.1Å; A88-L92 VanDerWaalsContact O-CB 3.23Å; A88-L92 WeakPolarHBondContact O-CB 3.33Å; A88-L92 PolarHBondContact O-N 3.13Å
89	R	95.9	Very high	95.4	Very high	130 Å²	130	93.3 Å²	93.3	49%	0.491	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-50.8	173.1	-71.4	160.8	-171.7	147.9	0.1	111.1	E82 L85 G86 D87 T91 L92 D93	E82-R89 IonicContact OE1-CZ 3.95Å; E82-R89 IonicContact OE1-NH1 3.06Å; E82-R89 PolarHBondContact OE1-NH1 3.16Å; E82-R89 IonicContact OE1-NH2 3.23Å; E82-R89 PolarHBondContact OE1-NH2 2.7Å; L85-R89 WeakPolarHBondContact O-CB 3.41Å; L85-R89 VanDerWaalsContact O-CD 3.31Å; L85-R89 WeakPolarHBondContact O-CD 3.48Å; L85-R89 WeakPolarHBondContact O-CG 3.47Å; L85-R89 PolarHBondContact O-N 2.89Å; G86-R89 PolarHBondContact O-N 3.22Å; D87-R89 VanDerWaalsContact C-N 3.34Å; R89-T91 VanDerWaalsContact C-N 3.33Å; R89-T91 PolarHBondContact O-N 3.18Å; R89-L92 PolarHBondContact O-N 3.36Å; R89-D93 PolarHBondContact O-N 3.39Å
90	K	96.4	Very high	95.5	Very high	133 Å²	133	92.3 Å²	92.3	58%	0.578	49%	0.489	S	S	*	.	H	α-helix	trans	-56.9	-42.9	178.2	-68.7	169.5	-156.6	163.2	0	112.8	G86 D87 S94	G86-K90 WeakPolarHBondContact O-CG 3.35Å; G86-K90 PolarHBondContact O-N 2.83Å; D87-K90 PolarHBondContact O-N 3.26Å; D87-K90 WeakPolarHBondContact OD1-CD 3.49Å; D87-K90 WeakPolarHBondContact OD1-CE 3.35Å; D87-K90 IonicContact OD1-NZ 2.73Å; D87-K90 PolarHBondContact OD1-NZ 3.13Å; K90-S94 WeakPolarHBondContact O-CB 3.44Å; K90-S94 PolarHBondContact O-N 3.24Å
91	T	96.2	Very high	95.7	Very high	84 Å²	84	96.1 Å²	96.1	52%	0.515	49%	0.493	S	S	.	.	H	α-helix	trans	-70.7	-39.1	179.1	48.7	0	0	0	0	111.7	D87 A88 R89 S94 V95	D87-T91 WeakPolarHBondContact O-CB 3.49Å; D87-T91 WeakPolarHBondContact O-CG2 3.48Å; D87-T91 PolarHBondContact O-N 3.44Å; D87-T91 PolarHBondContact O-OG1 3.16Å; A88-T91 WeakPolarHBondContact CA-OG1 3.39Å; A88-T91 PolarHBondContact O-OG1 3.35Å; A88-T91 VanDerWaalsContact O-OG1 3.1Å; R89-T91 VanDerWaalsContact C-N 3.33Å; R89-T91 PolarHBondContact O-N 3.18Å; T91-S94 PolarHBondContact O-N 3.15Å; T91-V95 WeakPolarHBondContact O-CB 3.31Å; T91-V95 VanDerWaalsContact O-CG2 3.31Å; T91-V95 WeakPolarHBondContact O-CG2 3.35Å; T91-V95 PolarHBondContact O-N 3.46Å
92	L	96.2	Very high	95.8	Very high	117 Å²	117	94.1 Å²	94.1	61%	0.613	49%	0.491	S	S	*	.	H	α-helix	trans	-61.4	-44.7	172.1	-176.2	149	0	0	0	112.1	A88 R89 V95 A96	A88-L92 VanDerWaalsContact O-CB 3.23Å; A88-L92 WeakPolarHBondContact O-CB 3.33Å; A88-L92 PolarHBondContact O-N 3.13Å; R89-L92 PolarHBondContact O-N 3.36Å; L92-V95 PolarHBondContact O-N 3.4Å; L92-A96 VanDerWaalsContact O-CB 3.28Å; L92-A96 WeakPolarHBondContact O-CB 3.39Å; L92-A96 PolarHBondContact O-N 3.25Å
93	D	95.9	Very high	95.9	Very high	104 Å²	104	94.3 Å²	94.3	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-64.3	-40.4	176.8	-72.4	-31.4	0	0	0	111.9	R89 A96 K97	R89-D93 PolarHBondContact O-N 3.39Å; D93-A96 PolarHBondContact O-N 2.94Å; D93-K97 WeakPolarHBondContact O-CB 3.42Å; D93-K97 PolarHBondContact O-N 2.94Å
94	S	96.3	Very high	96	Very high	69 Å²	69	97.5 Å²	97.5	48%	0.483	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-46.5	174.9	-169.9	0	0	0	0	111.9	K90 T91 A96 K97 E98	K90-S94 WeakPolarHBondContact O-CB 3.44Å; K90-S94 PolarHBondContact O-N 3.24Å; T91-S94 PolarHBondContact O-N 3.15Å; S94-A96 VanDerWaalsContact C-N 3.35Å; S94-A96 PolarHBondContact O-N 3.34Å; S94-K97 PolarHBondContact O-N 3.39Å; S94-E98 PolarHBondContact O-N 3.31Å
95	V	96.3	Very high	96.1	Very high	99 Å²	99	95.3 Å²	95.3	60%	0.6	49%	0.491	S	S	*	.	H	α-helix	trans	-65.4	-37.2	175.5	169.8	0	0	0	0	111.5	T91 L92 R99	T91-V95 WeakPolarHBondContact O-CB 3.31Å; T91-V95 VanDerWaalsContact O-CG2 3.31Å; T91-V95 WeakPolarHBondContact O-CG2 3.35Å; T91-V95 PolarHBondContact O-N 3.46Å; L92-V95 PolarHBondContact O-N 3.4Å; V95-R99 WeakPolarHBondContact O-CB 3.35Å; V95-R99 PolarHBondContact O-N 2.94Å
96	A	96	Very high	96.2	Very high	47 Å²	47	95.4 Å²	95.4	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-40.4	174.5	0	0	0	0	0	111.7	L92 D93 S94 A100	L92-A96 VanDerWaalsContact O-CB 3.28Å; L92-A96 WeakPolarHBondContact O-CB 3.39Å; L92-A96 PolarHBondContact O-N 3.25Å; D93-A96 PolarHBondContact O-N 2.94Å; S94-A96 VanDerWaalsContact C-N 3.35Å; S94-A96 PolarHBondContact O-N 3.34Å; A96-A100 WeakPolarHBondContact O-CB 3.43Å; A96-A100 PolarHBondContact O-N 3.47Å
97	K	96.8	Very high	96.3	Very high	152 Å²	152	97.5 Å²	97.5	66%	0.661	50%	0.502	S	S	*	.	H	α-helix	trans	-65.2	-48.9	176.1	-175.5	-177.4	177.5	-174.3	0	112.2	D93 S94 R99 A100 R101	D93-K97 WeakPolarHBondContact O-CB 3.42Å; D93-K97 PolarHBondContact O-N 2.94Å; S94-K97 PolarHBondContact O-N 3.39Å; K97-R99 VanDerWaalsContact C-N 3.35Å; K97-A100 PolarHBondContact O-N 3.09Å; K97-R101 WeakPolarHBondContact O-CB 3.43Å; K97-R101 PolarHBondContact O-N 2.91Å
98	E	96.4	Very high	96.4	Very high	80 Å²	80	99.3 Å²	99.3	37%	0.374	51%	0.506	S	S	.	.	H	α-helix	trans	-68	-34.1	176.9	-70.6	-56.4	127.7	0	0	111.9	S94 R101 L102	S94-E98 PolarHBondContact O-N 3.31Å; E98-R101 PolarHBondContact O-N 3.41Å; E98-R101 WeakPolarHBondContact OE2-CD 3.5Å; E98-R101 IonicContact OE2-NH1 2.86Å; E98-L102 WeakPolarHBondContact O-CB 3.46Å; E98-L102 VanDerWaalsContact O-CG 3.27Å; E98-L102 WeakPolarHBondContact O-CG 3.45Å; E98-L102 PolarHBondContact O-N 3.22Å
99	R	96.4	Very high	96.5	Very high	162 Å²	162	100.9 Å²	100.9	61%	0.611	51%	0.51	S	S	*	.	H	α-helix	trans	-61.4	-44.6	170.4	177.4	174.4	174.7	-107.9	3.7	112	V95 K97 L102 Q103	V95-R99 WeakPolarHBondContact O-CB 3.35Å; V95-R99 PolarHBondContact O-N 2.94Å; K97-R99 VanDerWaalsContact C-N 3.35Å; R99-L102 PolarHBondContact O-N 3.41Å; R99-Q103 WeakPolarHBondContact O-CB 3.48Å; R99-Q103 VanDerWaalsContact O-CG 3.25Å; R99-Q103 WeakPolarHBondContact O-CG 3.18Å; R99-Q103 PolarHBondContact O-N 3.43Å
100	A	96.4	Very high	96.6	Very high	46 Å²	46	102.3 Å²	102.3	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-41.2	176.5	0	0	0	0	0	111.5	A96 K97 Q103 L104	A96-A100 WeakPolarHBondContact O-CB 3.43Å; A96-A100 PolarHBondContact O-N 3.47Å; K97-A100 PolarHBondContact O-N 3.09Å; A100-Q103 PolarHBondContact O-N 3.28Å; A100-L104 WeakPolarHBondContact O-CG 3.45Å; A100-L104 PolarHBondContact O-N 3.38Å
101	R	97.2	Very high	96.6	Very high	128 Å²	128	100.3 Å²	100.3	48%	0.483	51%	0.508	S	S	.	.	H	α-helix	trans	-58.9	-51.9	173.4	-178	-168.5	169.7	179.2	-4.8	111.7	K97 E98 Q103 L104 E105	K97-R101 WeakPolarHBondContact O-CB 3.43Å; K97-R101 PolarHBondContact O-N 2.91Å; E98-R101 PolarHBondContact O-N 3.41Å; E98-R101 WeakPolarHBondContact OE2-CD 3.5Å; E98-R101 IonicContact OE2-NH1 2.86Å; R101-Q103 VanDerWaalsContact C-N 3.26Å; R101-Q103 PolarHBondContact O-N 3.06Å; R101-L104 WeakPolarHBondContact O-CB 3.41Å; R101-L104 PolarHBondContact O-N 2.95Å; R101-E105 IonicContact CZ-OE1 2.74Å; R101-E105 VanDerWaalsContact CZ-OE1 3.3Å; R101-E105 IonicContact NE-OE1 2.64Å; R101-E105 PolarHBondContact NE-OE1 2.87Å; R101-E105 IonicContact NH2-OE1 3.64Å; R101-E105 PolarHBondContact NH2-OE1 3.4Å; R101-E105 PolarHBondContact O-N 3.1Å
102	L	96.3	Very high	96.7	Very high	103 Å²	103	100.8 Å²	100.8	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-64	-31	178.8	-71.1	169.6	0	0	0	112.1	E98 R99 L106	E98-L102 WeakPolarHBondContact O-CB 3.46Å; E98-L102 VanDerWaalsContact O-CG 3.27Å; E98-L102 WeakPolarHBondContact O-CG 3.45Å; E98-L102 PolarHBondContact O-N 3.22Å; R99-L102 PolarHBondContact O-N 3.41Å; L102-L106 WeakPolarHBondContact O-CB 3.34Å; L102-L106 PolarHBondContact O-N 3.28Å
103	Q	96.4	Very high	96.7	Very high	102 Å²	102	101.6 Å²	101.6	48%	0.477	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-40.3	170.7	-77.4	174.6	-26.7	0	0	112.3	R99 A100 R101 S107	R99-Q103 WeakPolarHBondContact O-CB 3.48Å; R99-Q103 VanDerWaalsContact O-CG 3.25Å; R99-Q103 WeakPolarHBondContact O-CG 3.18Å; R99-Q103 PolarHBondContact O-N 3.43Å; A100-Q103 PolarHBondContact O-N 3.28Å; R101-Q103 VanDerWaalsContact C-N 3.26Å; R101-Q103 PolarHBondContact O-N 3.06Å; Q103-S107 WeakPolarHBondContact O-CB 3.49Å; Q103-S107 PolarHBondContact O-N 3.08Å
104	L	97	Very high	96.8	Very high	123 Å²	123	102.2 Å²	102.2	64%	0.644	50%	0.501	S	S	*	.	H	α-helix	trans	-67	-47	174.3	-69.9	172.6	0	0	0	111.8	A100 R101 L106 S107 K108	A100-L104 WeakPolarHBondContact O-CG 3.45Å; A100-L104 PolarHBondContact O-N 3.38Å; R101-L104 WeakPolarHBondContact O-CB 3.41Å; R101-L104 PolarHBondContact O-N 2.95Å; L104-L106 PolarHBondContact O-N 3.08Å; L104-S107 PolarHBondContact O-N 3.35Å; L104-S107 VanDerWaalsContact O-N 3.12Å; L104-S107 PolarHBondContact O-OG 3.31Å; L104-K108 PolarHBondContact O-N 3.09Å
105	E	96.8	Very high	96.9	Very high	80 Å²	80	105.4 Å²	105.4	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-60.1	-42.9	175.7	-70.2	177.7	180	0	0	111.2	R101 S107 K108 V109	R101-E105 IonicContact CZ-OE1 2.74Å; R101-E105 VanDerWaalsContact CZ-OE1 3.3Å; R101-E105 IonicContact NE-OE1 2.64Å; R101-E105 PolarHBondContact NE-OE1 2.87Å; R101-E105 IonicContact NH2-OE1 3.64Å; R101-E105 PolarHBondContact NH2-OE1 3.4Å; R101-E105 PolarHBondContact O-N 3.1Å; E105-S107 PolarHBondContact O-N 3.2Å; E105-K108 PolarHBondContact O-N 3.47Å; E105-V109 WeakPolarHBondContact O-CG2 3.42Å; E105-V109 PolarHBondContact O-N 3.4Å
106	L	96.3	Very high	96.9	Very high	86 Å²	86	106.1 Å²	106.1	45%	0.45	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-38.4	173	179.1	62.2	0	0	0	112.5	L102 L104 R110	L102-L106 WeakPolarHBondContact O-CB 3.34Å; L102-L106 PolarHBondContact O-N 3.28Å; L104-L106 PolarHBondContact O-N 3.08Å; L106-R110 HydrophobicContact CD1-CG 4.39Å; L106-R110 WeakPolarHBondContact O-CB 3.33Å; L106-R110 WeakPolarHBondContact O-CD 3.33Å; L106-R110 WeakPolarHBondContact O-CG 3.33Å; L106-R110 PolarHBondContact O-N 3.47Å; L106-R110 VanDerWaalsContact O-N 3.09Å
107	S	97.3	Very high	97	Very high	61 Å²	61	110 Å²	110	43%	0.427	52%	0.517	S	S	.	.	H	α-helix	trans	-68	-41.9	177.3	74.9	0	0	0	0	111.8	Q103 L104 E105 R110 E111	Q103-S107 WeakPolarHBondContact O-CB 3.49Å; Q103-S107 PolarHBondContact O-N 3.08Å; L104-S107 PolarHBondContact O-N 3.35Å; L104-S107 VanDerWaalsContact O-N 3.12Å; L104-S107 PolarHBondContact O-OG 3.31Å; E105-S107 PolarHBondContact O-N 3.2Å; S107-R110 PolarHBondContact O-N 2.94Å; S107-E111 PolarHBondContact O-N 2.98Å; S107-E111 VanDerWaalsContact O-N 3.14Å
108	K	97.6	Very high	97	Very high	126 Å²	126	105 Å²	105	55%	0.548	50%	0.503	S	S	.	.	H	α-helix	trans	-59.1	-54.5	173.9	177.4	-177.7	166.7	-178.1	0	111.3	L104 E105 R110 E111 E112	L104-K108 PolarHBondContact O-N 3.09Å; E105-K108 PolarHBondContact O-N 3.47Å; K108-R110 PolarHBondContact O-N 3.07Å; K108-E111 PolarHBondContact O-N 3.14Å; K108-E111 VanDerWaalsContact O-N 3.11Å; K108-E112 VanDerWaalsContact CE-CD 3.4Å; K108-E112 WeakPolarHBondContact CE-OE1 3.46Å; K108-E112 HydrophobicContact CG-CG 4.33Å; K108-E112 IonicContact NZ-OE1 3.13Å; K108-E112 WeakPolarHBondContact O-CG 3.23Å; K108-E112 PolarHBondContact O-N 2.74Å
109	V	97.1	Very high	97	Very high	86 Å²	86	109.7 Å²	109.7	52%	0.521	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-31.4	-178.5	172.3	0	0	0	0	111.9	E105 F113	E105-V109 WeakPolarHBondContact O-CG2 3.42Å; E105-V109 PolarHBondContact O-N 3.4Å; V109-F113 WeakPolarHBondContact O-CB 3.48Å; V109-F113 PolarHBondContact O-N 3.09Å
110	R	97.2	Very high	97.1	Very high	160 Å²	160	105.9 Å²	105.9	60%	0.604	51%	0.51	S	S	*	.	H	α-helix	trans	-67.2	-42	173.9	-79.1	170.5	175.9	-170.7	-1.4	112.9	L106 S107 K108 K114	L106-R110 HydrophobicContact CD1-CG 4.39Å; L106-R110 WeakPolarHBondContact O-CB 3.33Å; L106-R110 WeakPolarHBondContact O-CD 3.33Å; L106-R110 WeakPolarHBondContact O-CG 3.33Å; L106-R110 PolarHBondContact O-N 3.47Å; L106-R110 VanDerWaalsContact O-N 3.09Å; S107-R110 PolarHBondContact O-N 2.94Å; K108-R110 PolarHBondContact O-N 3.07Å; R110-K114 VanDerWaalsContact O-CB 3.28Å; R110-K114 WeakPolarHBondContact O-CB 3.28Å; R110-K114 PolarHBondContact O-N 2.75Å
111	E	97	Very high	97.1	Very high	92 Å²	92	107.2 Å²	107.2	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-73.1	-40.6	176.1	-69.2	-64.2	128.4	0	0	111.5	S107 K108 F113 K114 E115	S107-E111 PolarHBondContact O-N 2.98Å; S107-E111 VanDerWaalsContact O-N 3.14Å; K108-E111 PolarHBondContact O-N 3.14Å; K108-E111 VanDerWaalsContact O-N 3.11Å; E111-F113 VanDerWaalsContact C-N 3.33Å; E111-F113 PolarHBondContact O-N 3.1Å; E111-K114 WeakPolarHBondContact O-CB 3.31Å; E111-K114 PolarHBondContact O-N 3.02Å; E111-K114 VanDerWaalsContact O-N 3.1Å; E111-K114 WeakPolarHBondContact OE1-CD 3.22Å; E111-K114 IonicContact OE1-NZ 3.96Å; E111-K114 PolarHBondContact OE1-NZ 2.98Å; E111-K114 WeakPolarHBondContact OE2-CD 3.29Å; E111-K114 IonicContact OE2-NZ 2.72Å; E111-K114 PolarHBondContact OE2-NZ 3.38Å; E111-E115 WeakPolarHBondContact O-CG 3.42Å; E111-E115 PolarHBondContact O-N 3.04Å
112	E	97.5	Very high	97.2	Very high	94 Å²	94	108.1 Å²	108.1	44%	0.439	52%	0.52	S	S	.	.	H	α-helix	trans	-58.1	-42.8	171.9	-72.2	176.4	152.2	0	0	111.9	K108 L116	K108-E112 VanDerWaalsContact CE-CD 3.4Å; K108-E112 WeakPolarHBondContact CE-OE1 3.46Å; K108-E112 HydrophobicContact CG-CG 4.33Å; K108-E112 IonicContact NZ-OE1 3.13Å; K108-E112 WeakPolarHBondContact O-CG 3.23Å; K108-E112 PolarHBondContact O-N 2.74Å; E112-L116 VanDerWaalsContact O-CB 3.27Å; E112-L116 WeakPolarHBondContact O-CB 3.38Å; E112-L116 PolarHBondContact O-N 3.28Å
113	F	97.4	Very high	97.2	Very high	134 Å²	134	109 Å²	109	59%	0.588	52%	0.52	S	S	*	.	H	α-helix	trans	-63.9	-39.1	174.3	175.2	-99	0	0	0	112.5	V109 E111 K117	V109-F113 WeakPolarHBondContact O-CB 3.48Å; V109-F113 PolarHBondContact O-N 3.09Å; E111-F113 VanDerWaalsContact C-N 3.33Å; E111-F113 PolarHBondContact O-N 3.1Å; F113-K117 HydrophobicContact CE1-CD 4.37Å; F113-K117 WeakPolarHBondContact O-CB 3.1Å; F113-K117 PolarHBondContact O-N 3.42Å
114	K	97.6	Very high	97.2	Very high	116 Å²	116	108.9 Å²	108.9	50%	0.504	52%	0.519	S	S	.	.	H	α-helix	trans	-69.3	-40.7	178.5	173.4	-176.5	164.2	-152.9	0	111.7	R110 E111 A118	R110-K114 VanDerWaalsContact O-CB 3.28Å; R110-K114 WeakPolarHBondContact O-CB 3.28Å; R110-K114 PolarHBondContact O-N 2.75Å; E111-K114 WeakPolarHBondContact O-CB 3.31Å; E111-K114 PolarHBondContact O-N 3.02Å; E111-K114 VanDerWaalsContact O-N 3.1Å; E111-K114 WeakPolarHBondContact OE1-CD 3.22Å; E111-K114 IonicContact OE1-NZ 3.96Å; E111-K114 PolarHBondContact OE1-NZ 2.98Å; E111-K114 WeakPolarHBondContact OE2-CD 3.29Å; E111-K114 IonicContact OE2-NZ 2.72Å; E111-K114 PolarHBondContact OE2-NZ 3.38Å; K114-A118 WeakPolarHBondContact O-CB 3.48Å; K114-A118 PolarHBondContact O-N 3.34Å
115	E	97.3	Very high	97.3	Very high	136 Å²	136	105 Å²	105	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-47.8	170.8	-73.7	-172.8	-178.2	0	0	111.7	E111 K117 A118 R119	E111-E115 WeakPolarHBondContact O-CG 3.42Å; E111-E115 PolarHBondContact O-N 3.04Å; E115-K117 VanDerWaalsContact C-N 3.32Å; E115-K117 PolarHBondContact O-N 2.88Å; E115-A118 CarbonylContact O-C 3.52Å; E115-A118 PolarHBondContact O-N 3.4Å; E115-R119 WeakPolarHBondContact O-CB 3.43Å; E115-R119 PolarHBondContact O-N 3.5Å
116	L	96.7	Very high	97.3	Very high	115 Å²	115	105.1 Å²	105.1	60%	0.602	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-40.8	178	-175.8	61.3	0	0	0	111.3	E112 R119 N120	E112-L116 VanDerWaalsContact O-CB 3.27Å; E112-L116 WeakPolarHBondContact O-CB 3.38Å; E112-L116 PolarHBondContact O-N 3.28Å; L116-R119 PolarHBondContact O-N 2.97Å; L116-N120 WeakPolarHBondContact O-CB 3.47Å; L116-N120 PolarHBondContact O-N 3.09Å
117	K	97.5	Very high	97.4	Very high	128 Å²	128	105.7 Å²	105.7	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-62.9	-44.5	173.4	-174.9	174.3	-178.4	177.1	0	111.8	F113 E115 R119 N120 T121	F113-K117 HydrophobicContact CE1-CD 4.37Å; F113-K117 WeakPolarHBondContact O-CB 3.1Å; F113-K117 PolarHBondContact O-N 3.42Å; E115-K117 VanDerWaalsContact C-N 3.32Å; E115-K117 PolarHBondContact O-N 2.88Å; K117-R119 VanDerWaalsContact C-N 3.29Å; K117-R119 PolarHBondContact O-N 3.38Å; K117-N120 PolarHBondContact O-N 3.39Å; K117-T121 PolarHBondContact O-N 2.92Å; K117-T121 PolarHBondContact O-OG1 3.23Å
118	A	97.3	Very high	97.4	Very high	46 Å²	46	108.7 Å²	108.7	38%	0.38	52%	0.524	S	S	.	.	H	α-helix	trans	-68.3	-26.2	176.6	0	0	0	0	0	113.4	K114 E115 T121 K122	K114-A118 WeakPolarHBondContact O-CB 3.48Å; K114-A118 PolarHBondContact O-N 3.34Å; E115-A118 CarbonylContact O-C 3.52Å; E115-A118 PolarHBondContact O-N 3.4Å; A118-T121 PolarHBondContact O-OG1 3.08Å; A118-K122 WeakPolarHBondContact O-CD 3.29Å; A118-K122 VanDerWaalsContact O-CG 3.29Å; A118-K122 WeakPolarHBondContact O-CG 3.08Å
119	R	97.6	Very high	97.4	Very high	179 Å²	179	104.9 Å²	104.9	68%	0.675	52%	0.515	S	S	*	.	H	α-helix	trans	-74.3	-39.9	169.3	-179.2	176.2	176.4	164.8	-1.2	111.4	E115 L116 K117 K123	E115-R119 WeakPolarHBondContact O-CB 3.43Å; E115-R119 PolarHBondContact O-N 3.5Å; L116-R119 PolarHBondContact O-N 2.97Å; K117-R119 VanDerWaalsContact C-N 3.29Å; K117-R119 PolarHBondContact O-N 3.38Å; R119-K123 WeakPolarHBondContact O-CG 3.4Å; R119-K123 PolarHBondContact O-N 3.38Å; R119-K123 VanDerWaalsContact O-N 3.08Å
120	N	97.3	Very high	97.4	Very high	83 Å²	83	102.8 Å²	102.8	44%	0.444	51%	0.507	S	S	.	.	H	α-helix	trans	-66.8	-47.6	178.9	-167.1	76.5	0	0	0	111.7	L116 K117 K122 K123 E124	L116-N120 WeakPolarHBondContact O-CB 3.47Å; L116-N120 PolarHBondContact O-N 3.09Å; K117-N120 PolarHBondContact O-N 3.39Å; N120-K122 VanDerWaalsContact C-N 3.28Å; N120-K122 PolarHBondContact O-N 3.21Å; N120-K123 CarbonylContact O-C 3.58Å; N120-K123 WeakPolarHBondContact O-CA 3.5Å; N120-K123 PolarHBondContact O-N 2.9Å; N120-E124 PolarHBondContact ND2-OE1 2.97Å; N120-E124 PolarHBondContact ND2-OE2 2.99Å; N120-E124 WeakPolarHBondContact O-CG 3.29Å; N120-E124 PolarHBondContact O-N 3.34Å
121	T	97.6	Very high	97.4	Very high	73 Å²	73	99 Å²	99	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-33.6	177.6	55.6	0	0	0	0	113	K117 A118 E124 G125	K117-T121 PolarHBondContact O-N 2.92Å; K117-T121 PolarHBondContact O-OG1 3.23Å; A118-T121 PolarHBondContact O-OG1 3.08Å; T121-E124 WeakPolarHBondContact CA-OE2 3.39Å; T121-G125 PolarHBondContact O-N 2.92Å
122	K	97.8	Very high	97.4	Very high	147 Å²	147	96.8 Å²	96.8	64%	0.639	49%	0.494	S	S	*	.	H	α-helix	trans	-63	-43.7	168.9	-74.8	174.5	-178.4	-179.8	0	111.8	A118 N120 G125 D126	A118-K122 WeakPolarHBondContact O-CD 3.29Å; A118-K122 VanDerWaalsContact O-CG 3.29Å; A118-K122 WeakPolarHBondContact O-CG 3.08Å; N120-K122 VanDerWaalsContact C-N 3.28Å; N120-K122 PolarHBondContact O-N 3.21Å; K122-G125 PolarHBondContact O-N 3.33Å; K122-D126 VanDerWaalsContact O-CG 3.22Å; K122-D126 PolarHBondContact O-N 2.94Å
123	K	97.3	Very high	97.5	Very high	123 Å²	123	100.6 Å²	100.6	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-70.6	-31.8	179.1	-71.5	-70.9	150.1	-143.9	0	113.6	R119 N120 D126 L127	R119-K123 WeakPolarHBondContact O-CG 3.4Å; R119-K123 PolarHBondContact O-N 3.38Å; R119-K123 VanDerWaalsContact O-N 3.08Å; N120-K123 CarbonylContact O-C 3.58Å; N120-K123 WeakPolarHBondContact O-CA 3.5Å; N120-K123 PolarHBondContact O-N 2.9Å; K123-D126 WeakPolarHBondContact CE-OD2 3.27Å; K123-D126 IonicContact NZ-OD2 2.73Å; K123-D126 PolarHBondContact NZ-OD2 3.34Å; K123-L127 VanDerWaalsContact O-CB 3.24Å; K123-L127 WeakPolarHBondContact O-CB 3.4Å; K123-L127 PolarHBondContact O-N 2.91Å
124	E	97.1	Very high	97.5	Very high	99 Å²	99	98.8 Å²	98.8	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-43.4	169.3	-70.5	166	155.8	0	0	110.7	N120 T121 L127 M128	N120-E124 PolarHBondContact ND2-OE1 2.97Å; N120-E124 PolarHBondContact ND2-OE2 2.99Å; N120-E124 WeakPolarHBondContact O-CG 3.29Å; N120-E124 PolarHBondContact O-N 3.34Å; T121-E124 WeakPolarHBondContact CA-OE2 3.39Å; E124-L127 PolarHBondContact O-N 2.93Å; E124-M128 VanDerWaalsContact O-CG 3.31Å; E124-M128 WeakPolarHBondContact O-CG 3.18Å; E124-M128 PolarHBondContact O-N 3.35Å
125	G	97.6	Very high	97.5	Very high	40 Å²	40	99.9 Å²	99.9	41%	0.412	51%	0.505	S	S	.	.	H	α-helix	trans	-61.2	-47.1	172.3	0	0	0	0	0	113.4	T121 K122 L127 M128 A129	T121-G125 PolarHBondContact O-N 2.92Å; K122-G125 PolarHBondContact O-N 3.33Å; G125-L127 VanDerWaalsContact C-N 3.31Å; G125-L127 PolarHBondContact O-N 3.09Å; G125-M128 PolarHBondContact O-N 2.86Å; G125-A129 WeakPolarHBondContact O-CB 3.35Å; G125-A129 PolarHBondContact O-N 3.34Å
126	D	97.6	Very high	97.5	Very high	84 Å²	84	98.6 Å²	98.6	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-58.5	-42.8	175.2	-66.6	-33.8	0	0	0	111.6	K122 K123 A129 A130	K122-D126 VanDerWaalsContact O-CG 3.22Å; K122-D126 PolarHBondContact O-N 2.94Å; K123-D126 WeakPolarHBondContact CE-OD2 3.27Å; K123-D126 IonicContact NZ-OD2 2.73Å; K123-D126 PolarHBondContact NZ-OD2 3.34Å; D126-A129 PolarHBondContact O-N 2.95Å; D126-A130 WeakPolarHBondContact O-CB 3.34Å; D126-A130 PolarHBondContact O-N 3.3Å
127	L	97.4	Very high	97.6	Very high	98 Å²	98	98.3 Å²	98.3	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-45.2	179.1	178.2	62	0	0	0	111.7	K123 E124 G125 A129 A130 Q131	K123-L127 VanDerWaalsContact O-CB 3.24Å; K123-L127 WeakPolarHBondContact O-CB 3.4Å; K123-L127 PolarHBondContact O-N 2.91Å; E124-L127 PolarHBondContact O-N 2.93Å; G125-L127 VanDerWaalsContact C-N 3.31Å; G125-L127 PolarHBondContact O-N 3.09Å; L127-A129 VanDerWaalsContact C-N 3.32Å; L127-A129 PolarHBondContact O-N 2.84Å; L127-A130 PolarHBondContact O-N 3.27Å; L127-Q131 HydrophobicContact CD1-CG 4.37Å; L127-Q131 WeakPolarHBondContact O-CB 3.36Å; L127-Q131 WeakPolarHBondContact O-CG 3.34Å; L127-Q131 PolarHBondContact O-N 2.95Å
128	M	97.6	Very high	97.6	Very high	124 Å²	124	97.4 Å²	97.4	61%	0.611	50%	0.499	S	S	*	.	H	α-helix	trans	-62.1	-40.1	175.9	-71.1	-63.6	-65.4	0	0	111.7	E124 G125 Q131 A132	E124-M128 VanDerWaalsContact O-CG 3.31Å; E124-M128 WeakPolarHBondContact O-CG 3.18Å; E124-M128 PolarHBondContact O-N 3.35Å; G125-M128 PolarHBondContact O-N 2.86Å; M128-Q131 PolarHBondContact O-N 2.62Å; M128-A132 PolarHBondContact O-N 2.92Å
129	A	97.8	Very high	97.6	Very high	45 Å²	45	98.1 Å²	98.1	37%	0.372	51%	0.505	S	S	.	.	H	α-helix	trans	-66.7	-35.9	175	0	0	0	0	0	112.7	G125 D126 L127 R133	G125-A129 WeakPolarHBondContact O-CB 3.35Å; G125-A129 PolarHBondContact O-N 3.34Å; D126-A129 PolarHBondContact O-N 2.95Å; L127-A129 VanDerWaalsContact C-N 3.32Å; L127-A129 PolarHBondContact O-N 2.84Å; A129-R133 WeakPolarHBondContact O-CG 3.28Å; A129-R133 PolarHBondContact O-N 3.46Å
130	A	97	Very high	97.7	Very high	43 Å²	43	94 Å²	94	36%	0.355	50%	0.496	S	S	.	.	H	α-helix	trans	-68.2	-42.4	173.1	0	0	0	0	0	112.1	D126 L127 A132 R133 L134	D126-A130 WeakPolarHBondContact O-CB 3.34Å; D126-A130 PolarHBondContact O-N 3.3Å; L127-A130 PolarHBondContact O-N 3.27Å; A130-A132 VanDerWaalsContact C-N 3.35Å; A130-A132 PolarHBondContact O-N 2.88Å; A130-R133 PolarHBondContact O-N 3.35Å; A130-L134 WeakPolarHBondContact O-CG 3.4Å; A130-L134 PolarHBondContact O-N 2.94Å
131	Q	97.6	Very high	97.7	Very high	81 Å²	81	94.6 Å²	94.6	38%	0.379	50%	0.498	S	S	.	.	H	α-helix	trans	-64.6	-35.1	176.4	-73.6	178	4.5	0	0	113	L127 M128 K135	L127-Q131 HydrophobicContact CD1-CG 4.37Å; L127-Q131 WeakPolarHBondContact O-CB 3.36Å; L127-Q131 WeakPolarHBondContact O-CG 3.34Å; L127-Q131 PolarHBondContact O-N 2.95Å; M128-Q131 PolarHBondContact O-N 2.62Å; Q131-K135 WeakPolarHBondContact O-CG 3.13Å; Q131-K135 PolarHBondContact O-N 3.47Å
132	A	97.6	Very high	97.7	Very high	45 Å²	45	95.9 Å²	95.9	37%	0.372	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-52.1	171.8	0	0	0	0	0	111	M128 A130 L134 K135 D136	M128-A132 PolarHBondContact O-N 2.92Å; A130-A132 VanDerWaalsContact C-N 3.35Å; A130-A132 PolarHBondContact O-N 2.88Å; A132-L134 VanDerWaalsContact C-N 3.29Å; A132-L134 PolarHBondContact O-N 3.19Å; A132-K135 WeakPolarHBondContact O-CB 3.3Å; A132-K135 PolarHBondContact O-N 2.82Å; A132-K135 VanDerWaalsContact O-N 3.09Å; A132-D136 PolarHBondContact O-N 3.43Å
133	R	97.9	Very high	97.7	Very high	173 Å²	173	92.4 Å²	92.4	65%	0.653	50%	0.496	S	S	*	.	H	α-helix	trans	-59.8	-34.8	178.5	-70	171.5	-178.1	173.8	1.9	113.5	A129 A130 D136 L137	A129-R133 WeakPolarHBondContact O-CG 3.28Å; A129-R133 PolarHBondContact O-N 3.46Å; A130-R133 PolarHBondContact O-N 3.35Å; R133-D136 PolarHBondContact O-N 2.96Å; R133-L137 WeakPolarHBondContact O-CB 3.32Å; R133-L137 VanDerWaalsContact O-CG 3.25Å; R133-L137 WeakPolarHBondContact O-CG 3.35Å; R133-L137 PolarHBondContact O-N 3.38Å
134	L	97.8	Very high	97.8	Very high	97 Å²	97	93 Å²	93	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-62.6	-46.7	174.5	-76.6	169.2	0	0	0	111.2	A130 A132 D136 L137 E138	A130-L134 WeakPolarHBondContact O-CG 3.4Å; A130-L134 PolarHBondContact O-N 2.94Å; A132-L134 VanDerWaalsContact C-N 3.29Å; A132-L134 PolarHBondContact O-N 3.19Å; L134-D136 VanDerWaalsContact C-N 3.34Å; L134-D136 PolarHBondContact O-N 2.79Å; L134-L137 PolarHBondContact O-N 3.33Å; L134-E138 WeakPolarHBondContact O-CB 3.31Å; L134-E138 VanDerWaalsContact O-CG 3.3Å; L134-E138 WeakPolarHBondContact O-CG 3.32Å; L134-E138 PolarHBondContact O-N 2.92Å
135	K	98	Very high	97.8	Very high	138 Å²	138	93.5 Å²	93.5	60%	0.6	50%	0.501	S	S	*	.	H	α-helix	trans	-62.7	-39.5	176.6	-67.5	171.3	-177.7	178.8	0	112.6	Q131 A132 L137 E138 A139	Q131-K135 WeakPolarHBondContact O-CG 3.13Å; Q131-K135 PolarHBondContact O-N 3.47Å; A132-K135 WeakPolarHBondContact O-CB 3.3Å; A132-K135 PolarHBondContact O-N 2.82Å; A132-K135 VanDerWaalsContact O-N 3.09Å; K135-L137 VanDerWaalsContact C-N 3.33Å; K135-E138 PolarHBondContact O-N 3.41Å; K135-A139 WeakPolarHBondContact O-CB 3.41Å; K135-A139 PolarHBondContact O-N 2.76Å
136	D	97.9	Very high	97.9	Very high	109 Å²	109	94.3 Å²	94.3	58%	0.583	50%	0.504	S	S	*	.	H	α-helix	trans	-63.2	-40.2	175.6	-61.8	-31.5	0	0	0	111.5	A132 R133 L134 L140	A132-D136 PolarHBondContact O-N 3.43Å; R133-D136 PolarHBondContact O-N 2.96Å; L134-D136 VanDerWaalsContact C-N 3.34Å; L134-D136 PolarHBondContact O-N 2.79Å; D136-L140 WeakPolarHBondContact O-CB 3.37Å; D136-L140 PolarHBondContact O-N 3.28Å
137	L	97.6	Very high	97.9	Very high	109 Å²	109	93 Å²	93	57%	0.571	51%	0.505	S	S	*	.	H	α-helix	trans	-72.5	-38.1	177.1	-72	170.8	0	0	0	112.8	R133 L134 K135 L140 L141	R133-L137 WeakPolarHBondContact O-CB 3.32Å; R133-L137 VanDerWaalsContact O-CG 3.25Å; R133-L137 WeakPolarHBondContact O-CG 3.35Å; R133-L137 PolarHBondContact O-N 3.38Å; L134-L137 PolarHBondContact O-N 3.33Å; K135-L137 VanDerWaalsContact C-N 3.33Å; L137-L140 PolarHBondContact O-N 3.26Å; L137-L141 WeakPolarHBondContact O-CB 3.49Å; L137-L141 PolarHBondContact O-N 2.93Å
138	E	98	Very high	97.9	Very high	109 Å²	109	93.5 Å²	93.5	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-46	172.6	-74	164.7	-173.2	0	0	110.9	L134 K135 L140 L141 N142	L134-E138 WeakPolarHBondContact O-CB 3.31Å; L134-E138 VanDerWaalsContact O-CG 3.3Å; L134-E138 WeakPolarHBondContact O-CG 3.32Å; L134-E138 PolarHBondContact O-N 2.92Å; K135-E138 PolarHBondContact O-N 3.41Å; E138-L140 VanDerWaalsContact C-N 3.35Å; E138-L140 PolarHBondContact O-N 3.03Å; E138-L141 PolarHBondContact O-N 2.86Å; E138-N142 WeakPolarHBondContact O-CB 3.2Å; E138-N142 PolarHBondContact O-N 2.92Å; E138-N142 PolarHBondContact O-ND2 3.02Å
139	A	97.9	Very high	97.9	Very high	61 Å²	61	91.3 Å²	91.3	50%	0.504	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-40.5	175.3	0	0	0	0	0	112.3	K135 S143	K135-A139 WeakPolarHBondContact O-CB 3.41Å; K135-A139 PolarHBondContact O-N 2.76Å; A139-S143 WeakPolarHBondContact O-CB 3.17Å; A139-S143 PolarHBondContact O-N 2.85Å
140	L	98.3	Very high	98	Very high	93 Å²	93	92.6 Å²	92.6	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-66.4	-40.8	175.2	-178.7	60.6	0	0	0	112.1	D136 L137 E138 S143 K144	D136-L140 WeakPolarHBondContact O-CB 3.37Å; D136-L140 PolarHBondContact O-N 3.28Å; L137-L140 PolarHBondContact O-N 3.26Å; E138-L140 VanDerWaalsContact C-N 3.35Å; E138-L140 PolarHBondContact O-N 3.03Å; L140-S143 WeakPolarHBondContact O-CB 3.25Å; L140-S143 PolarHBondContact O-N 3.32Å; L140-K144 HydrophobicContact CD1-CG 4.46Å; L140-K144 WeakPolarHBondContact O-CG 3.34Å; L140-K144 PolarHBondContact O-N 3.09Å
141	L	97.7	Very high	98	Very high	96 Å²	96	92.9 Å²	92.9	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-53.3	176.2	178	61.1	0	0	0	110.6	L137 E138 S143 K144 E145	L137-L141 WeakPolarHBondContact O-CB 3.49Å; L137-L141 PolarHBondContact O-N 2.93Å; E138-L141 PolarHBondContact O-N 2.86Å; L141-S143 PolarHBondContact O-N 2.87Å; L141-K144 WeakPolarHBondContact O-CA 3.41Å; L141-K144 PolarHBondContact O-N 2.73Å; L141-E145 HydrophobicContact CD1-CG 4.18Å; L141-E145 HydrophobicContact CG-CG 4.45Å; L141-E145 WeakPolarHBondContact O-CG 3.34Å; L141-E145 PolarHBondContact O-N 3.23Å
142	N	98.3	Very high	98	Very high	100 Å²	100	92.7 Å²	92.7	54%	0.535	51%	0.512	S	S	.	.	H	α-helix	trans	-55.5	-39.5	177.2	-65.8	-23.3	0	0	0	111.8	E138 A146	E138-N142 WeakPolarHBondContact O-CB 3.2Å; E138-N142 PolarHBondContact O-N 2.92Å; E138-N142 PolarHBondContact O-ND2 3.02Å; N142-A146 WeakPolarHBondContact O-CB 3.44Å; N142-A146 PolarHBondContact O-N 2.77Å
143	S	98.3	Very high	98.1	Very high	73 Å²	73	93.4 Å²	93.4	51%	0.51	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-39.4	174.7	178.2	0	0	0	0	112.9	A139 L140 L141 A147	A139-S143 WeakPolarHBondContact O-CB 3.17Å; A139-S143 PolarHBondContact O-N 2.85Å; L140-S143 WeakPolarHBondContact O-CB 3.25Å; L140-S143 PolarHBondContact O-N 3.32Å; L141-S143 PolarHBondContact O-N 2.87Å; S143-A147 WeakPolarHBondContact O-CB 3.22Å; S143-A147 PolarHBondContact O-N 2.82Å; S143-A147 VanDerWaalsContact O-N 3.07Å
144	K	98	Very high	98.1	Very high	136 Å²	136	90.2 Å²	90.2	59%	0.591	51%	0.506	S	S	*	.	H	α-helix	trans	-72.5	-37.3	176.8	-68.1	-63.1	178.9	-172.7	0	112.7	L140 L141 A147 L148	L140-K144 HydrophobicContact CD1-CG 4.46Å; L140-K144 WeakPolarHBondContact O-CG 3.34Å; L140-K144 PolarHBondContact O-N 3.09Å; L141-K144 WeakPolarHBondContact O-CA 3.41Å; L141-K144 PolarHBondContact O-N 2.73Å; K144-A147 PolarHBondContact O-N 2.92Å; K144-L148 VanDerWaalsContact O-CB 3.3Å; K144-L148 WeakPolarHBondContact O-CB 3.33Å; K144-L148 PolarHBondContact O-N 3.08Å
145	E	98.3	Very high	98.1	Very high	109 Å²	109	90.8 Å²	90.8	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-43.1	174.8	-69.9	-178.8	167.8	0	0	111.6	L141 L148 S149	L141-E145 HydrophobicContact CD1-CG 4.18Å; L141-E145 HydrophobicContact CG-CG 4.45Å; L141-E145 WeakPolarHBondContact O-CG 3.34Å; L141-E145 PolarHBondContact O-N 3.23Å; E145-L148 PolarHBondContact O-N 3.25Å; E145-S149 PolarHBondContact O-N 2.58Å
146	A	98.3	Very high	98.1	Very high	57 Å²	57	91.7 Å²	91.7	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-59.5	-49.2	172.9	0	0	0	0	0	111.7	N142 L148 S149 T150	N142-A146 WeakPolarHBondContact O-CB 3.44Å; N142-A146 PolarHBondContact O-N 2.77Å; A146-L148 VanDerWaalsContact C-N 3.32Å; A146-L148 PolarHBondContact O-N 3.49Å; A146-S149 WeakPolarHBondContact O-CB 3.49Å; A146-S149 PolarHBondContact O-N 3.05Å; A146-S149 VanDerWaalsContact O-N 3.16Å; A146-T150 PolarHBondContact O-N 2.79Å; A146-T150 PolarHBondContact O-OG1 3.43Å
147	A	98.1	Very high	98.1	Very high	56 Å²	56	90.6 Å²	90.6	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-36.8	177.9	0	0	0	0	0	113	S143 K144 T150 A151	S143-A147 WeakPolarHBondContact O-CB 3.22Å; S143-A147 PolarHBondContact O-N 2.82Å; S143-A147 VanDerWaalsContact O-N 3.07Å; K144-A147 PolarHBondContact O-N 2.92Å; A147-T150 PolarHBondContact O-N 3.43Å; A147-A151 WeakPolarHBondContact O-CB 3.48Å; A147-A151 PolarHBondContact O-N 2.89Å
148	L	98.1	Very high	98.2	Very high	109 Å²	109	89.9 Å²	89.9	57%	0.571	50%	0.498	S	S	*	.	H	α-helix	trans	-66.5	-39.8	174.3	179.6	148	0	0	0	111.5	K144 E145 A146 A151 L152	K144-L148 VanDerWaalsContact O-CB 3.3Å; K144-L148 WeakPolarHBondContact O-CB 3.33Å; K144-L148 PolarHBondContact O-N 3.08Å; E145-L148 PolarHBondContact O-N 3.25Å; A146-L148 VanDerWaalsContact C-N 3.32Å; A146-L148 PolarHBondContact O-N 3.49Å; L148-A151 PolarHBondContact O-N 2.92Å; L148-L152 HydrophobicContact CD2-CD1 3.64Å; L148-L152 HydrophobicContact CD2-CG 4.33Å; L148-L152 HydrophobicContact CG-CD1 4.46Å; L148-L152 WeakPolarHBondContact O-CB 3.32Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.39Å; L148-L152 PolarHBondContact O-N 3.31Å
149	S	98.4	Very high	98.2	Very high	78 Å²	78	89.2 Å²	89.2	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-45.3	174.2	-167.7	0	0	0	0	111.7	E145 A146 L152 S153	E145-S149 PolarHBondContact O-N 2.58Å; A146-S149 WeakPolarHBondContact O-CB 3.49Å; A146-S149 PolarHBondContact O-N 3.05Å; A146-S149 VanDerWaalsContact O-N 3.16Å; S149-L152 PolarHBondContact O-N 2.63Å; S149-S153 PolarHBondContact O-N 3.44Å
150	T	98.3	Very high	98.2	Very high	72 Å²	72	87.8 Å²	87.8	44%	0.442	49%	0.486	S	S	.	.	H	α-helix	trans	-58.5	-52.8	173.8	-59.4	0	0	0	0	111.5	A146 A147 L152 S153 E154	A146-T150 PolarHBondContact O-N 2.79Å; A146-T150 PolarHBondContact O-OG1 3.43Å; A147-T150 PolarHBondContact O-N 3.43Å; T150-L152 VanDerWaalsContact C-N 3.27Å; T150-L152 PolarHBondContact O-N 3.36Å; T150-S153 WeakPolarHBondContact O-CA 3.24Å; T150-S153 WeakPolarHBondContact O-CB 3.29Å; T150-S153 PolarHBondContact O-N 2.88Å; T150-S153 PolarHBondContact O-OG 3.04Å; T150-E154 HydrophobicContact CG2-CG 4.44Å; T150-E154 WeakPolarHBondContact CG2-OE1 3.5Å; T150-E154 PolarHBondContact O-N 2.93Å
151	A	97.8	Very high	98.2	Very high	50 Å²	50	88.7 Å²	88.7	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-33.7	179.9	0	0	0	0	0	112.9	A147 L148 S153 K155	A147-A151 WeakPolarHBondContact O-CB 3.48Å; A147-A151 PolarHBondContact O-N 2.89Å; L148-A151 PolarHBondContact O-N 2.92Å; A151-S153 VanDerWaalsContact C-N 3.34Å; A151-K155 VanDerWaalsContact O-CB 3.3Å; A151-K155 WeakPolarHBondContact O-CB 3.33Å; A151-K155 PolarHBondContact O-N 3.42Å
152	L	98.3	Very high	98.2	Very high	77 Å²	77	88.3 Å²	88.3	40%	0.403	49%	0.486	S	S	.	.	H	α-helix	trans	-71.2	-26.1	171.8	-72.9	178.9	0	0	0	113	L148 S149 T150 R156	L148-L152 HydrophobicContact CD2-CD1 3.64Å; L148-L152 HydrophobicContact CD2-CG 4.33Å; L148-L152 HydrophobicContact CG-CD1 4.46Å; L148-L152 WeakPolarHBondContact O-CB 3.32Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.39Å; L148-L152 PolarHBondContact O-N 3.31Å; S149-L152 PolarHBondContact O-N 2.63Å; T150-L152 VanDerWaalsContact C-N 3.27Å; T150-L152 PolarHBondContact O-N 3.36Å; L152-R156 WeakPolarHBondContact O-CG 3.37Å; L152-R156 PolarHBondContact O-N 2.98Å; L152-R156 PolarHBondContact O-NH1 3.43Å
153	S	98.3	Very high	98.2	Very high	59 Å²	59	89.4 Å²	89.4	41%	0.413	49%	0.487	S	S	.	.	H	α-helix	trans	-74.4	-46.4	172.7	75.6	0	0	0	0	111.4	S149 T150 A151 K155 R156 T157	S149-S153 PolarHBondContact O-N 3.44Å; T150-S153 WeakPolarHBondContact O-CA 3.24Å; T150-S153 WeakPolarHBondContact O-CB 3.29Å; T150-S153 PolarHBondContact O-N 2.88Å; T150-S153 PolarHBondContact O-OG 3.04Å; A151-S153 VanDerWaalsContact C-N 3.34Å; S153-K155 VanDerWaalsContact C-N 3.31Å; S153-K155 PolarHBondContact O-N 3.05Å; S153-R156 PolarHBondContact O-N 2.81Å; S153-T157 PolarHBondContact O-N 2.63Å; S153-T157 VanDerWaalsContact O-N 3.13Å
154	E	98.2	Very high	98.2	Very high	106 Å²	106	90.8 Å²	90.8	50%	0.495	49%	0.489	S	S	.	.	H	α-helix	trans	-60.8	-39.9	175.9	-66.8	169.2	170.8	0	0	111.5	T150 R156 T157 L158	T150-E154 HydrophobicContact CG2-CG 4.44Å; T150-E154 WeakPolarHBondContact CG2-OE1 3.5Å; T150-E154 PolarHBondContact O-N 2.93Å; E154-R156 VanDerWaalsContact C-N 3.3Å; E154-R156 PolarHBondContact O-N 3.16Å; E154-T157 PolarHBondContact O-N 2.81Å; E154-T157 PolarHBondContact O-OG1 3.17Å; E154-L158 WeakPolarHBondContact O-CB 3.38Å; E154-L158 VanDerWaalsContact O-CG 3.31Å; E154-L158 WeakPolarHBondContact O-CG 3.39Å; E154-L158 PolarHBondContact O-N 3.32Å
155	K	98.1	Very high	98.2	Very high	110 Å²	110	88.7 Å²	88.7	48%	0.478	48%	0.483	S	S	.	.	H	α-helix	trans	-56.1	-45	172.6	177.6	-179.8	166.8	-178.1	0	111.6	A151 S153 L158 E159	A151-K155 VanDerWaalsContact O-CB 3.3Å; A151-K155 WeakPolarHBondContact O-CB 3.33Å; A151-K155 PolarHBondContact O-N 3.42Å; S153-K155 VanDerWaalsContact C-N 3.31Å; S153-K155 PolarHBondContact O-N 3.05Å; K155-L158 PolarHBondContact O-N 2.92Å; K155-E159 WeakPolarHBondContact CE-OE1 3.34Å; K155-E159 WeakPolarHBondContact CE-OE2 3.44Å; K155-E159 HydrophobicContact CG-CG 4.42Å; K155-E159 IonicContact NZ-OE1 3.4Å; K155-E159 PolarHBondContact NZ-OE1 3.38Å; K155-E159 WeakPolarHBondContact O-CB 3.37Å; K155-E159 WeakPolarHBondContact O-CG 3.47Å; K155-E159 PolarHBondContact O-N 2.93Å
156	R	98.4	Very high	98.2	Very high	157 Å²	157	91.2 Å²	91.2	59%	0.592	49%	0.488	S	S	*	.	H	α-helix	trans	-69.7	-35.4	-177.8	-69.2	175	-168.5	106.6	-14.9	112.3	L152 S153 E154 E159 G160	L152-R156 WeakPolarHBondContact O-CG 3.37Å; L152-R156 PolarHBondContact O-N 2.98Å; L152-R156 PolarHBondContact O-NH1 3.43Å; S153-R156 PolarHBondContact O-N 2.81Å; E154-R156 VanDerWaalsContact C-N 3.3Å; E154-R156 PolarHBondContact O-N 3.16Å; R156-E159 PolarHBondContact O-N 2.84Å; R156-G160 PolarHBondContact O-N 2.89Å; R156-G160 VanDerWaalsContact O-N 3.09Å
157	T	98.4	Very high	98.2	Very high	85 Å²	85	90 Å²	90	52%	0.521	48%	0.481	S	S	.	.	H	α-helix	trans	-67.7	-44.1	175.2	56	0	0	0	0	110.7	S153 E154 E159 G160 E161	S153-T157 PolarHBondContact O-N 2.63Å; S153-T157 VanDerWaalsContact O-N 3.13Å; E154-T157 PolarHBondContact O-N 2.81Å; E154-T157 PolarHBondContact O-OG1 3.17Å; T157-E159 PolarHBondContact O-N 3.36Å; T157-G160 WeakPolarHBondContact O-CA 3.42Å; T157-G160 PolarHBondContact O-N 3.41Å; T157-G160 VanDerWaalsContact O-N 3.1Å; T157-E161 PolarHBondContact O-N 2.75Å
158	L	98.1	Very high	98.2	Very high	94 Å²	94	92.5 Å²	92.5	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-63.5	-36.3	174.5	-68.2	170.2	0	0	0	112.9	E154 K155 G160 E161 L162	E154-L158 WeakPolarHBondContact O-CB 3.38Å; E154-L158 VanDerWaalsContact O-CG 3.31Å; E154-L158 WeakPolarHBondContact O-CG 3.39Å; E154-L158 PolarHBondContact O-N 3.32Å; K155-L158 PolarHBondContact O-N 2.92Å; L158-G160 VanDerWaalsContact C-N 3.3Å; L158-G160 PolarHBondContact O-N 3.48Å; L158-E161 PolarHBondContact O-N 3.49Å; L158-L162 WeakPolarHBondContact O-CB 3.39Å; L158-L162 VanDerWaalsContact O-CG 3.25Å; L158-L162 WeakPolarHBondContact O-CG 3.35Å; L158-L162 PolarHBondContact O-N 2.88Å
159	E	98.2	Very high	98.2	Very high	95 Å²	95	90.9 Å²	90.9	44%	0.444	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-34.7	172.6	-78.2	174.6	149.9	0	0	112.1	K155 R156 T157 H163	K155-E159 WeakPolarHBondContact CE-OE1 3.34Å; K155-E159 WeakPolarHBondContact CE-OE2 3.44Å; K155-E159 HydrophobicContact CG-CG 4.42Å; K155-E159 IonicContact NZ-OE1 3.4Å; K155-E159 PolarHBondContact NZ-OE1 3.38Å; K155-E159 WeakPolarHBondContact O-CB 3.37Å; K155-E159 WeakPolarHBondContact O-CG 3.47Å; K155-E159 PolarHBondContact O-N 2.93Å; R156-E159 PolarHBondContact O-N 2.84Å; T157-E159 PolarHBondContact O-N 3.36Å; E159-H163 PolarHBondContact O-N 2.87Å; E159-H163 VanDerWaalsContact O-N 3.1Å
160	G	98.2	Very high	98.2	Very high	31 Å²	31	89.8 Å²	89.8	32%	0.32	47%	0.473	S	S	.	.	H	α-helix	trans	-68.2	-49.3	171.2	0	0	0	0	0	113.2	R156 T157 L158 L162 H163 D164	R156-G160 PolarHBondContact O-N 2.89Å; R156-G160 VanDerWaalsContact O-N 3.09Å; T157-G160 WeakPolarHBondContact O-CA 3.42Å; T157-G160 PolarHBondContact O-N 3.41Å; T157-G160 VanDerWaalsContact O-N 3.1Å; L158-G160 VanDerWaalsContact C-N 3.3Å; L158-G160 PolarHBondContact O-N 3.48Å; G160-L162 VanDerWaalsContact C-N 3.29Å; G160-L162 PolarHBondContact O-N 3.34Å; G160-H163 WeakPolarHBondContact O-CA 3.29Å; G160-H163 WeakPolarHBondContact O-CB 3.42Å; G160-H163 PolarHBondContact O-N 3.17Å; G160-D164 PolarHBondContact O-N 3.46Å
161	E	98.3	Very high	98.2	Very high	113 Å²	113	93.8 Å²	93.8	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-57.4	-42.3	175.7	-71.2	170.5	-149.8	0	0	111.8	T157 L158 H163 D164 L165	T157-E161 PolarHBondContact O-N 2.75Å; L158-E161 PolarHBondContact O-N 3.49Å; E161-H163 VanDerWaalsContact C-N 3.33Å; E161-H163 PolarHBondContact O-N 3.25Å; E161-D164 PolarHBondContact O-N 2.93Å; E161-L165 WeakPolarHBondContact O-CB 3.23Å; E161-L165 VanDerWaalsContact O-CG 3.27Å; E161-L165 WeakPolarHBondContact O-CG 3.46Å; E161-L165 PolarHBondContact O-N 3.07Å
162	L	97.9	Very high	98.2	Very high	88 Å²	88	97.2 Å²	97.2	46%	0.461	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-31.2	174.6	-73.9	172.3	0	0	0	113.2	L158 G160 R166	L158-L162 WeakPolarHBondContact O-CB 3.39Å; L158-L162 VanDerWaalsContact O-CG 3.25Å; L158-L162 WeakPolarHBondContact O-CG 3.35Å; L158-L162 PolarHBondContact O-N 2.88Å; G160-L162 VanDerWaalsContact C-N 3.29Å; G160-L162 PolarHBondContact O-N 3.34Å; L162-R166 VanDerWaalsContact O-CD 3.25Å; L162-R166 WeakPolarHBondContact O-CD 3.26Å; L162-R166 WeakPolarHBondContact O-CG 3.46Å; L162-R166 PolarHBondContact O-N 3.27Å
163	H	98.3	Very high	98.2	Very high	123 Å²	123	99.6 Å²	99.6	57%	0.569	51%	0.505	S	S	*	.	H	α-helix	trans	-67.6	-47.2	172.4	175.8	-85.5	0	0	0	111	E159 G160 E161 R166 G167	E159-H163 PolarHBondContact O-N 2.87Å; E159-H163 VanDerWaalsContact O-N 3.1Å; G160-H163 WeakPolarHBondContact O-CA 3.29Å; G160-H163 WeakPolarHBondContact O-CB 3.42Å; G160-H163 PolarHBondContact O-N 3.17Å; E161-H163 VanDerWaalsContact C-N 3.33Å; E161-H163 PolarHBondContact O-N 3.25Å; H163-R166 WeakPolarHBondContact O-CB 3.4Å; H163-R166 PolarHBondContact O-N 2.93Å; H163-G167 PolarHBondContact O-N 3.48Å
164	D	98.2	Very high	98.2	Very high	101 Å²	101	99.9 Å²	99.9	54%	0.54	51%	0.51	S	S	.	.	H	α-helix	trans	-70.2	-35.6	-177.6	-71.5	-6.1	0	0	0	112.4	G160 E161 G167 Q168	G160-D164 PolarHBondContact O-N 3.46Å; E161-D164 PolarHBondContact O-N 2.93Å; D164-G167 CarbonylContact O-C 3.58Å; D164-G167 PolarHBondContact O-N 3.39Å; D164-Q168 WeakPolarHBondContact O-CG 3.35Å; D164-Q168 PolarHBondContact O-N 2.81Å
165	L	98	Very high	98.2	Very high	92 Å²	92	97.4 Å²	97.4	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-40.5	170.9	-73.8	170.4	0	0	0	112.1	E161 G167 Q168 V169	E161-L165 WeakPolarHBondContact O-CB 3.23Å; E161-L165 VanDerWaalsContact O-CG 3.27Å; E161-L165 WeakPolarHBondContact O-CG 3.46Å; E161-L165 PolarHBondContact O-N 3.07Å; L165-G167 VanDerWaalsContact C-N 3.31Å; L165-G167 PolarHBondContact O-N 3.03Å; L165-Q168 PolarHBondContact O-N 3.24Å; L165-V169 WeakPolarHBondContact O-CG2 3.41Å; L165-V169 PolarHBondContact O-N 2.81Å
166	R	98.3	Very high	98.2	Very high	162 Å²	162	96.7 Å²	96.7	61%	0.611	51%	0.509	S	S	*	.	H	α-helix	trans	-61.8	-40.6	171.5	-71.7	162.9	-174.5	142	-1.1	111.3	L162 H163 Q168 V169 A170	L162-R166 VanDerWaalsContact O-CD 3.25Å; L162-R166 WeakPolarHBondContact O-CD 3.26Å; L162-R166 WeakPolarHBondContact O-CG 3.46Å; L162-R166 PolarHBondContact O-N 3.27Å; H163-R166 WeakPolarHBondContact O-CB 3.4Å; H163-R166 PolarHBondContact O-N 2.93Å; R166-Q168 VanDerWaalsContact C-N 3.31Å; R166-Q168 PolarHBondContact O-N 2.92Å; R166-V169 PolarHBondContact O-N 2.82Å; R166-A170 PolarHBondContact O-N 2.81Å
167	G	98.2	Very high	98.2	Very high	31 Å²	31	91 Å²	91	32%	0.32	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-32.4	174.2	0	0	0	0	0	113.7	H163 D164 L165 K171	H163-G167 PolarHBondContact O-N 3.48Å; D164-G167 CarbonylContact O-C 3.58Å; D164-G167 PolarHBondContact O-N 3.39Å; L165-G167 VanDerWaalsContact C-N 3.31Å; L165-G167 PolarHBondContact O-N 3.03Å; G167-K171 WeakPolarHBondContact O-CD 3.47Å; G167-K171 VanDerWaalsContact O-CG 3.27Å; G167-K171 WeakPolarHBondContact O-CG 3.47Å; G167-K171 PolarHBondContact O-N 3.38Å
168	Q	98.1	Very high	98.2	Very high	109 Å²	109	92.9 Å²	92.9	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-72	-45.6	172.2	-70.3	172.1	48.6	0	0	111.7	D164 L165 R166 A170 K171 L172	D164-Q168 WeakPolarHBondContact O-CG 3.35Å; D164-Q168 PolarHBondContact O-N 2.81Å; L165-Q168 PolarHBondContact O-N 3.24Å; R166-Q168 VanDerWaalsContact C-N 3.31Å; R166-Q168 PolarHBondContact O-N 2.92Å; Q168-A170 PolarHBondContact O-N 3.03Å; Q168-K171 PolarHBondContact O-N 3.35Å; Q168-L172 WeakPolarHBondContact O-CG 3.31Å; Q168-L172 PolarHBondContact O-N 3.11Å
169	V	97.9	Very high	98.2	Very high	75 Å²	75	90.7 Å²	90.7	46%	0.455	50%	0.498	S	S	.	.	H	α-helix	trans	-57.4	-49.5	176.6	170.9	0	0	0	0	110.9	L165 R166 K171 L172 E173	L165-V169 WeakPolarHBondContact O-CG2 3.41Å; L165-V169 PolarHBondContact O-N 2.81Å; R166-V169 PolarHBondContact O-N 2.82Å; V169-K171 VanDerWaalsContact C-N 3.28Å; V169-K171 PolarHBondContact O-N 2.92Å; V169-L172 PolarHBondContact O-N 3.21Å; V169-E173 HydrophobicContact CG1-CG 4.22Å; V169-E173 WeakPolarHBondContact O-CG 3.46Å; V169-E173 PolarHBondContact O-N 2.81Å
170	A	98.3	Very high	98.2	Very high	55 Å²	55	91.9 Å²	91.9	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-35.3	179.2	0	0	0	0	0	113.3	R166 Q168 A174	R166-A170 PolarHBondContact O-N 2.81Å; Q168-A170 PolarHBondContact O-N 3.03Å; A170-A174 WeakPolarHBondContact O-CB 3.33Å; A170-A174 PolarHBondContact O-N 3.45Å
171	K	98.3	Very high	98.2	Very high	156 Å²	156	96.2 Å²	96.2	68%	0.678	51%	0.512	S	S	*	.	H	α-helix	trans	-68.1	-40.7	173.8	-72.5	168.9	-175.7	176.2	0	112.1	G167 Q168 V169 A174 A175	G167-K171 WeakPolarHBondContact O-CD 3.47Å; G167-K171 VanDerWaalsContact O-CG 3.27Å; G167-K171 WeakPolarHBondContact O-CG 3.47Å; G167-K171 PolarHBondContact O-N 3.38Å; Q168-K171 PolarHBondContact O-N 3.35Å; V169-K171 VanDerWaalsContact C-N 3.28Å; V169-K171 PolarHBondContact O-N 2.92Å; K171-A174 PolarHBondContact O-N 3.41Å; K171-A175 WeakPolarHBondContact O-CB 3.48Å; K171-A175 PolarHBondContact O-N 2.86Å
172	L	98.1	Very high	98.2	Very high	122 Å²	122	95.8 Å²	95.8	64%	0.639	51%	0.51	S	S	*	.	H	α-helix	trans	-69.2	-37.3	177.3	-68.5	171	0	0	0	112	Q168 V169 A175 L176	Q168-L172 WeakPolarHBondContact O-CG 3.31Å; Q168-L172 PolarHBondContact O-N 3.11Å; V169-L172 PolarHBondContact O-N 3.21Å; L172-A175 PolarHBondContact O-N 3Å; L172-L176 VanDerWaalsContact O-CB 3.24Å; L172-L176 WeakPolarHBondContact O-CB 3.27Å; L172-L176 PolarHBondContact O-N 3.25Å
173	E	98.3	Very high	98.2	Very high	127 Å²	127	97.5 Å²	97.5	59%	0.593	52%	0.519	S	S	*	.	H	α-helix	trans	-64.1	-42.6	173.4	-72	177.9	152.2	0	0	111.8	V169 L176 G177	V169-E173 HydrophobicContact CG1-CG 4.22Å; V169-E173 WeakPolarHBondContact O-CG 3.46Å; V169-E173 PolarHBondContact O-N 2.81Å; E173-L176 PolarHBondContact O-N 2.89Å; E173-G177 PolarHBondContact O-N 2.82Å
174	A	98.4	Very high	98.3	Very high	65 Å²	65	97.4 Å²	97.4	54%	0.537	52%	0.519	S	S	.	.	H	α-helix	trans	-62.3	-48.1	174.1	0	0	0	0	0	112	A170 K171 L176 G177 E178	A170-A174 WeakPolarHBondContact O-CB 3.33Å; A170-A174 PolarHBondContact O-N 3.45Å; K171-A174 PolarHBondContact O-N 3.41Å; A174-L176 VanDerWaalsContact C-N 3.33Å; A174-L176 PolarHBondContact O-N 2.9Å; A174-G177 WeakPolarHBondContact O-CA 3.32Å; A174-G177 PolarHBondContact O-N 3.38Å; A174-G177 VanDerWaalsContact O-N 3.11Å; A174-E178 PolarHBondContact O-N 2.65Å
175	A	98.1	Very high	98.3	Very high	54 Å²	54	95.2 Å²	95.2	45%	0.446	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-37.8	177.2	0	0	0	0	0	112.5	K171 L172 G177 E178 A179	K171-A175 WeakPolarHBondContact O-CB 3.48Å; K171-A175 PolarHBondContact O-N 2.86Å; L172-A175 PolarHBondContact O-N 3Å; A175-G177 VanDerWaalsContact C-N 3.35Å; A175-E178 PolarHBondContact O-N 2.82Å; A175-A179 WeakPolarHBondContact O-CB 3.17Å; A175-A179 PolarHBondContact O-N 3.29Å
176	L	98.3	Very high	98.3	Very high	95 Å²	95	95.9 Å²	95.9	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-65.9	-36.6	173	178.9	63.1	0	0	0	112	L172 E173 A174 K180	L172-L176 VanDerWaalsContact O-CB 3.24Å; L172-L176 WeakPolarHBondContact O-CB 3.27Å; L172-L176 PolarHBondContact O-N 3.25Å; E173-L176 PolarHBondContact O-N 2.89Å; A174-L176 VanDerWaalsContact C-N 3.33Å; A174-L176 PolarHBondContact O-N 2.9Å; L176-K180 HydrophobicContact CG-CD 4.36Å; L176-K180 WeakPolarHBondContact O-CB 3.46Å; L176-K180 WeakPolarHBondContact O-CD 3.18Å; L176-K180 VanDerWaalsContact O-CG 3.23Å; L176-K180 WeakPolarHBondContact O-CG 3.19Å; L176-K180 PolarHBondContact O-N 3.47Å
177	G	98.4	Very high	98.2	Very high	39 Å²	39	93.8 Å²	93.8	40%	0.402	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-45.2	172.8	0	0	0	0	0	112.3	E173 A174 A175 K180 K181	E173-G177 PolarHBondContact O-N 2.82Å; A174-G177 WeakPolarHBondContact O-CA 3.32Å; A174-G177 PolarHBondContact O-N 3.38Å; A174-G177 VanDerWaalsContact O-N 3.11Å; A175-G177 VanDerWaalsContact C-N 3.35Å; G177-K180 PolarHBondContact O-N 2.98Å; G177-K181 PolarHBondContact O-N 2.72Å
178	E	98.4	Very high	98.3	Very high	123 Å²	123	98 Å²	98	58%	0.575	52%	0.521	S	S	*	.	H	α-helix	trans	-66.1	-45.2	177.4	-170.5	173.4	-175.4	0	0	112.1	A174 A175 K180 K181 Q182	A174-E178 PolarHBondContact O-N 2.65Å; A175-E178 PolarHBondContact O-N 2.82Å; E178-K180 VanDerWaalsContact C-N 3.3Å; E178-K180 PolarHBondContact O-N 2.97Å; E178-K181 WeakPolarHBondContact O-CB 3.35Å; E178-K181 PolarHBondContact O-N 2.71Å; E178-K181 VanDerWaalsContact O-N 3.07Å; E178-Q182 WeakPolarHBondContact O-CG 3.3Å; E178-Q182 PolarHBondContact O-N 2.93Å
179	A	98.1	Very high	98.2	Very high	49 Å²	49	99.4 Å²	99.4	41%	0.405	52%	0.521	S	S	.	.	H	α-helix	trans	-60.4	-37.6	175.6	0	0	0	0	0	112.6	A175 Q182 L183	A175-A179 WeakPolarHBondContact O-CB 3.17Å; A175-A179 PolarHBondContact O-N 3.29Å; A179-Q182 PolarHBondContact O-N 3.14Å; A179-L183 WeakPolarHBondContact O-CB 3.28Å; A179-L183 PolarHBondContact O-N 2.89Å
180	K	98.5	Very high	98.3	Very high	119 Å²	119	103.3 Å²	103.3	52%	0.517	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-40.8	172.5	-77.7	168.6	-179.3	172.4	0	112.1	L176 G177 E178 L183 Q184	L176-K180 HydrophobicContact CG-CD 4.36Å; L176-K180 WeakPolarHBondContact O-CB 3.46Å; L176-K180 WeakPolarHBondContact O-CD 3.18Å; L176-K180 VanDerWaalsContact O-CG 3.23Å; L176-K180 WeakPolarHBondContact O-CG 3.19Å; L176-K180 PolarHBondContact O-N 3.47Å; G177-K180 PolarHBondContact O-N 2.98Å; E178-K180 VanDerWaalsContact C-N 3.3Å; E178-K180 PolarHBondContact O-N 2.97Å; K180-L183 PolarHBondContact O-N 2.83Å; K180-Q184 WeakPolarHBondContact O-CG 3.32Å; K180-Q184 PolarHBondContact O-N 2.86Å
181	K	98.6	Very high	98.3	Very high	123 Å²	123	103.8 Å²	103.8	54%	0.535	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-47.6	174.9	-174.7	-166.9	168	-168.8	0	111.1	G177 E178 L183 Q184 D185	G177-K181 PolarHBondContact O-N 2.72Å; E178-K181 WeakPolarHBondContact O-CB 3.35Å; E178-K181 PolarHBondContact O-N 2.71Å; E178-K181 VanDerWaalsContact O-N 3.07Å; K181-L183 VanDerWaalsContact C-N 3.26Å; K181-L183 PolarHBondContact O-N 3.07Å; K181-Q184 WeakPolarHBondContact O-CA 3.34Å; K181-Q184 WeakPolarHBondContact O-CB 3.34Å; K181-Q184 PolarHBondContact O-N 3.02Å; K181-D185 PolarHBondContact O-N 2.94Å
182	Q	98.4	Very high	98.3	Very high	104 Å²	104	99.6 Å²	99.6	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-57.4	-40.4	177.5	-68.7	172.4	5.8	0	0	111.6	E178 A179 D185 E186	E178-Q182 WeakPolarHBondContact O-CG 3.3Å; E178-Q182 PolarHBondContact O-N 2.93Å; A179-Q182 PolarHBondContact O-N 3.14Å; Q182-D185 PolarHBondContact O-N 3.01Å; Q182-E186 PolarHBondContact O-N 2.83Å
183	L	98.3	Very high	98.2	Very high	124 Å²	124	96.5 Å²	96.5	65%	0.649	50%	0.502	S	S	*	.	H	α-helix	trans	-64.6	-37.7	173.6	179.3	62.3	0	0	0	113	A179 K180 K181 M187	A179-L183 WeakPolarHBondContact O-CB 3.28Å; A179-L183 PolarHBondContact O-N 2.89Å; K180-L183 PolarHBondContact O-N 2.83Å; K181-L183 VanDerWaalsContact C-N 3.26Å; K181-L183 PolarHBondContact O-N 3.07Å; L183-M187 VanDerWaalsContact O-CB 3.27Å; L183-M187 WeakPolarHBondContact O-CB 3.35Å; L183-M187 PolarHBondContact O-N 3.05Å
184	Q	98.4	Very high	98.2	Very high	121 Å²	121	94.7 Å²	94.7	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-68.3	-41.9	174.6	-72.8	171.3	-26.3	0	0	111.9	K180 K181 M187 L188	K180-Q184 WeakPolarHBondContact O-CG 3.32Å; K180-Q184 PolarHBondContact O-N 2.86Å; K181-Q184 WeakPolarHBondContact O-CA 3.34Å; K181-Q184 WeakPolarHBondContact O-CB 3.34Å; K181-Q184 PolarHBondContact O-N 3.02Å; Q184-M187 PolarHBondContact O-N 3.03Å; Q184-L188 WeakPolarHBondContact O-CB 3.2Å; Q184-L188 PolarHBondContact O-N 2.79Å
185	D	98.3	Very high	98.2	Very high	54 Å²	54	96.2 Å²	96.2	29%	0.289	49%	0.493	S	S	.	.	H	α-helix	trans	-63	-42.7	176.5	-68.7	-20.6	0	0	0	111.1	K181 Q182 L188 R189	K181-D185 PolarHBondContact O-N 2.94Å; Q182-D185 PolarHBondContact O-N 3.01Å; D185-L188 PolarHBondContact O-N 2.87Å; D185-R189 WeakPolarHBondContact O-CG 3.35Å; D185-R189 PolarHBondContact O-N 2.86Å
186	E	97.9	Very high	98.2	Very high	106 Å²	106	100.9 Å²	100.9	50%	0.495	50%	0.499	S	S	.	.	H	α-helix	trans	-69	-38.6	174.2	-78.1	-56.3	131.5	0	0	113.2	Q182 L188 R189 R190	Q182-E186 PolarHBondContact O-N 2.83Å; E186-L188 VanDerWaalsContact C-N 3.28Å; E186-L188 PolarHBondContact O-N 2.86Å; E186-R189 PolarHBondContact O-N 2.96Å; E186-R189 WeakPolarHBondContact OE1-CD 3.47Å; E186-R189 IonicContact OE1-CZ 2.94Å; E186-R189 IonicContact OE1-NE 3.55Å; E186-R189 IonicContact OE1-NH1 2.76Å; E186-R189 PolarHBondContact OE1-NH1 2.86Å; E186-R190 WeakPolarHBondContact O-CB 3.2Å; E186-R190 PolarHBondContact O-N 3.36Å
187	M	97.9	Very high	98.2	Very high	118 Å²	118	102.2 Å²	102.2	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-61.3	-39	173.8	-175.8	177.3	67.2	0	0	111.3	L183 Q184 R190 V191	L183-M187 VanDerWaalsContact O-CB 3.27Å; L183-M187 WeakPolarHBondContact O-CB 3.35Å; L183-M187 PolarHBondContact O-N 3.05Å; Q184-M187 PolarHBondContact O-N 3.03Å; M187-R190 PolarHBondContact O-N 2.9Å; M187-V191 WeakPolarHBondContact O-CG2 3.41Å; M187-V191 PolarHBondContact O-N 3.03Å; M187-V191 VanDerWaalsContact O-N 3.09Å
188	L	98.4	Very high	98.2	Very high	120 Å²	120	104.3 Å²	104.3	63%	0.628	51%	0.505	S	S	*	.	H	α-helix	trans	-66.6	-44.9	174.7	-178.1	61.7	0	0	0	111.9	Q184 D185 E186 R190 V191 D192	Q184-L188 WeakPolarHBondContact O-CB 3.2Å; Q184-L188 PolarHBondContact O-N 2.79Å; D185-L188 PolarHBondContact O-N 2.87Å; E186-L188 VanDerWaalsContact C-N 3.28Å; E186-L188 PolarHBondContact O-N 2.86Å; L188-R190 VanDerWaalsContact C-N 3.32Å; L188-R190 PolarHBondContact O-N 3.24Å; L188-V191 PolarHBondContact O-N 3.28Å; L188-D192 WeakPolarHBondContact O-CB 3.5Å; L188-D192 PolarHBondContact O-N 3.48Å
189	R	97.8	Very high	98.2	Very high	138 Å²	138	102.5 Å²	102.5	52%	0.521	50%	0.503	S	S	.	.	H	α-helix	trans	-59.3	-41.4	174.7	-72.7	168.5	-170.6	133.6	15.7	112.1	D185 E186 A193	D185-R189 WeakPolarHBondContact O-CG 3.35Å; D185-R189 PolarHBondContact O-N 2.86Å; E186-R189 PolarHBondContact O-N 2.96Å; E186-R189 WeakPolarHBondContact OE1-CD 3.47Å; E186-R189 IonicContact OE1-CZ 2.94Å; E186-R189 IonicContact OE1-NE 3.55Å; E186-R189 IonicContact OE1-NH1 2.76Å; E186-R189 PolarHBondContact OE1-NH1 2.86Å; R189-A193 WeakPolarHBondContact O-CB 3.47Å; R189-A193 PolarHBondContact O-N 2.89Å
190	R	98.4	Very high	98.2	Very high	158 Å²	158	105.6 Å²	105.6	60%	0.596	51%	0.51	S	S	*	.	H	α-helix	trans	-60.7	-48.5	175	178.7	-177	164.1	-143.7	-18.7	111.5	E186 M187 L188 A193 E194	E186-R190 WeakPolarHBondContact O-CB 3.2Å; E186-R190 PolarHBondContact O-N 3.36Å; M187-R190 PolarHBondContact O-N 2.9Å; L188-R190 VanDerWaalsContact C-N 3.32Å; L188-R190 PolarHBondContact O-N 3.24Å; R190-A193 PolarHBondContact O-N 2.66Å; R190-E194 HydrophobicContact CG-CG 4.41Å; R190-E194 IonicContact CZ-OE1 2.82Å; R190-E194 IonicContact CZ-OE2 3.14Å; R190-E194 IonicContact NE-OE1 3.26Å; R190-E194 PolarHBondContact NE-OE1 2.8Å; R190-E194 IonicContact NE-OE2 2.66Å; R190-E194 IonicContact NH2-OE1 3.53Å; R190-E194 PolarHBondContact NH2-OE1 2.88Å; R190-E194 IonicContact NH2-OE2 3.22Å; R190-E194 PolarHBondContact NH2-OE2 2.98Å; R190-E194 WeakPolarHBondContact O-CG 3.49Å; R190-E194 PolarHBondContact O-N 3.15Å
191	V	98.6	Very high	98.2	Very high	65 Å²	65	105.1 Å²	105.1	39%	0.394	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-39.8	-179.2	169.9	0	0	0	0	111.6	M187 L188 E194 N195	M187-V191 WeakPolarHBondContact O-CG2 3.41Å; M187-V191 PolarHBondContact O-N 3.03Å; M187-V191 VanDerWaalsContact O-N 3.09Å; L188-V191 PolarHBondContact O-N 3.28Å; V191-E194 PolarHBondContact O-N 2.92Å; V191-N195 WeakPolarHBondContact O-CB 3.4Å; V191-N195 PolarHBondContact O-N 2.85Å; V191-N195 PolarHBondContact O-ND2 2.98Å
192	D	98.3	Very high	98.1	Very high	68 Å²	68	104.4 Å²	104.4	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-61	-43.5	172.3	177.9	27.8	0	0	0	111.9	L188 N195 R196	L188-D192 WeakPolarHBondContact O-CB 3.5Å; L188-D192 PolarHBondContact O-N 3.48Å; D192-N195 PolarHBondContact O-N 2.91Å; D192-R196 VanDerWaalsContact O-CG 3.28Å; D192-R196 WeakPolarHBondContact O-CG 3.41Å; D192-R196 PolarHBondContact O-N 2.94Å; D192-R196 IonicContact OD1-CZ 3.55Å; D192-R196 VanDerWaalsContact OD1-CZ 3.3Å; D192-R196 IonicContact OD1-NE 3.3Å; D192-R196 PolarHBondContact OD1-NE 3.23Å; D192-R196 IonicContact OD1-NH2 2.89Å; D192-R196 PolarHBondContact OD1-NH2 3.4Å; D192-R196 IonicContact OD2-CZ 2.64Å; D192-R196 IonicContact OD2-NE 2.75Å; D192-R196 IonicContact OD2-NH2 3.77Å; D192-R196 PolarHBondContact OD2-NH2 3.45Å
193	A	97.5	Very high	98.1	Very high	56 Å²	56	103.7 Å²	103.7	46%	0.463	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-39.8	174.5	0	0	0	0	0	113.3	R189 R190 R196 L197	R189-A193 WeakPolarHBondContact O-CB 3.47Å; R189-A193 PolarHBondContact O-N 2.89Å; R190-A193 PolarHBondContact O-N 2.66Å; A193-R196 PolarHBondContact O-N 3.41Å; A193-L197 WeakPolarHBondContact O-CB 3.44Å; A193-L197 PolarHBondContact O-N 3.36Å
194	E	98	Very high	98.1	Very high	89 Å²	89	101.8 Å²	101.8	42%	0.416	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-40.8	175.7	-75.1	176.1	169.4	0	0	111.7	R190 V191 L197 Q198	R190-E194 HydrophobicContact CG-CG 4.41Å; R190-E194 IonicContact CZ-OE1 2.82Å; R190-E194 IonicContact CZ-OE2 3.14Å; R190-E194 IonicContact NE-OE1 3.26Å; R190-E194 PolarHBondContact NE-OE1 2.8Å; R190-E194 IonicContact NE-OE2 2.66Å; R190-E194 IonicContact NH2-OE1 3.53Å; R190-E194 PolarHBondContact NH2-OE1 2.88Å; R190-E194 IonicContact NH2-OE2 3.22Å; R190-E194 PolarHBondContact NH2-OE2 2.98Å; R190-E194 WeakPolarHBondContact O-CG 3.49Å; R190-E194 PolarHBondContact O-N 3.15Å; V191-E194 PolarHBondContact O-N 2.92Å; E194-L197 PolarHBondContact O-N 3.31Å; E194-Q198 PolarHBondContact O-N 2.84Å
195	N	98.4	Very high	98.1	Very high	98 Å²	98	99.1 Å²	99.1	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-48.2	173.4	-71.1	-25.4	0	0	0	111.4	V191 D192 L197 Q198 T199	V191-N195 WeakPolarHBondContact O-CB 3.4Å; V191-N195 PolarHBondContact O-N 2.85Å; V191-N195 PolarHBondContact O-ND2 2.98Å; D192-N195 PolarHBondContact O-N 2.91Å; N195-L197 VanDerWaalsContact C-N 3.34Å; N195-L197 PolarHBondContact O-N 3Å; N195-Q198 PolarHBondContact O-N 3.12Å; N195-T199 PolarHBondContact O-N 3Å; N195-T199 PolarHBondContact O-OG1 3.41Å
196	R	98.3	Very high	98.1	Very high	151 Å²	151	102.7 Å²	102.7	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-61.3	-40.8	176.6	-69.6	171.4	-162.2	-156.1	5.5	112.1	D192 A193 Q198 T199 M200	D192-R196 VanDerWaalsContact O-CG 3.28Å; D192-R196 WeakPolarHBondContact O-CG 3.41Å; D192-R196 PolarHBondContact O-N 2.94Å; D192-R196 IonicContact OD1-CZ 3.55Å; D192-R196 VanDerWaalsContact OD1-CZ 3.3Å; D192-R196 IonicContact OD1-NE 3.3Å; D192-R196 PolarHBondContact OD1-NE 3.23Å; D192-R196 IonicContact OD1-NH2 2.89Å; D192-R196 PolarHBondContact OD1-NH2 3.4Å; D192-R196 IonicContact OD2-CZ 2.64Å; D192-R196 IonicContact OD2-NE 2.75Å; D192-R196 IonicContact OD2-NH2 3.77Å; D192-R196 PolarHBondContact OD2-NH2 3.45Å; A193-R196 PolarHBondContact O-N 3.41Å; R196-Q198 VanDerWaalsContact C-N 3.31Å; R196-Q198 PolarHBondContact O-N 2.97Å; R196-T199 PolarHBondContact O-N 3.44Å; R196-M200 WeakPolarHBondContact O-CG 3.44Å; R196-M200 PolarHBondContact O-N 2.82Å
197	L	97.8	Very high	98.1	Very high	124 Å²	124	101.1 Å²	101.1	65%	0.649	49%	0.489	S	S	*	.	H	α-helix	trans	-61.5	-40.5	176	180	63.4	0	0	0	111.5	A193 E194 N195 K201	A193-L197 WeakPolarHBondContact O-CB 3.44Å; A193-L197 PolarHBondContact O-N 3.36Å; E194-L197 PolarHBondContact O-N 3.31Å; N195-L197 VanDerWaalsContact C-N 3.34Å; N195-L197 PolarHBondContact O-N 3Å; L197-K201 VanDerWaalsContact O-CB 3.3Å; L197-K201 WeakPolarHBondContact O-CB 3.36Å; L197-K201 PolarHBondContact O-N 2.97Å
198	Q	98.3	Very high	98.1	Very high	83 Å²	83	100.4 Å²	100.4	39%	0.388	48%	0.482	S	S	.	.	H	α-helix	trans	-66.4	-43.1	175.2	-179	60.1	20.9	0	0	111.6	E194 N195 R196 K201 E202	E194-Q198 PolarHBondContact O-N 2.84Å; N195-Q198 PolarHBondContact O-N 3.12Å; R196-Q198 VanDerWaalsContact C-N 3.31Å; R196-Q198 PolarHBondContact O-N 2.97Å; Q198-K201 WeakPolarHBondContact O-CB 3.37Å; Q198-K201 PolarHBondContact O-N 3.08Å; Q198-E202 PolarHBondContact NE2-OE1 2.89Å; Q198-E202 WeakPolarHBondContact O-CG 3.43Å; Q198-E202 PolarHBondContact O-N 3.07Å
199	T	98.3	Very high	98	Very high	85 Å²	85	99.5 Å²	99.5	52%	0.521	48%	0.478	S	S	.	.	H	α-helix	trans	-60.6	-46.6	173.6	-54.6	0	0	0	0	112.2	N195 R196 K201 E202 E203	N195-T199 PolarHBondContact O-N 3Å; N195-T199 PolarHBondContact O-OG1 3.41Å; R196-T199 PolarHBondContact O-N 3.44Å; T199-K201 PolarHBondContact O-N 2.85Å; T199-E202 PolarHBondContact O-N 2.88Å; T199-E203 PolarHBondContact O-N 2.8Å
200	M	97.5	Very high	98	Very high	113 Å²	113	96.6 Å²	96.6	56%	0.557	47%	0.472	S	S	*	.	H	α-helix	trans	-63.2	-31.1	176.8	-69.2	-54.9	-47.4	0	0	112.6	R196 L204	R196-M200 WeakPolarHBondContact O-CG 3.44Å; R196-M200 PolarHBondContact O-N 2.82Å; M200-L204 VanDerWaalsContact O-CB 3.23Å; M200-L204 WeakPolarHBondContact O-CB 3.32Å; M200-L204 PolarHBondContact O-N 2.83Å
201	K	98.1	Very high	97.9	Very high	109 Å²	109	96.2 Å²	96.2	47%	0.474	47%	0.472	S	S	.	.	H	α-helix	trans	-72.4	-43.4	175.3	179.1	-172	168.6	-164	0	111.6	L197 Q198 T199 E203 L204 D205	L197-K201 VanDerWaalsContact O-CB 3.3Å; L197-K201 WeakPolarHBondContact O-CB 3.36Å; L197-K201 PolarHBondContact O-N 2.97Å; Q198-K201 WeakPolarHBondContact O-CB 3.37Å; Q198-K201 PolarHBondContact O-N 3.08Å; T199-K201 PolarHBondContact O-N 2.85Å; K201-E203 VanDerWaalsContact C-N 3.34Å; K201-L204 PolarHBondContact O-N 2.88Å; K201-D205 WeakPolarHBondContact O-CB 3.5Å; K201-D205 PolarHBondContact O-N 2.87Å
202	E	98.1	Very high	97.9	Very high	108 Å²	108	96.2 Å²	96.2	51%	0.505	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-41.1	174.4	-73	167.4	-178	0	0	111.3	Q198 T199 D205 F206	Q198-E202 PolarHBondContact NE2-OE1 2.89Å; Q198-E202 WeakPolarHBondContact O-CG 3.43Å; Q198-E202 PolarHBondContact O-N 3.07Å; T199-E202 PolarHBondContact O-N 2.88Å; E202-D205 PolarHBondContact O-N 2.89Å; E202-F206 WeakPolarHBondContact O-CB 3.18Å; E202-F206 PolarHBondContact O-N 2.81Å
203	E	98.3	Very high	97.7	Very high	89 Å²	89	98 Å²	98	42%	0.416	48%	0.481	S	S	.	.	H	α-helix	trans	-62.9	-46	172.3	-165.2	-166.7	159.2	0	0	111.6	T199 K201 D205 F206 Q207	T199-E203 PolarHBondContact O-N 2.8Å; K201-E203 VanDerWaalsContact C-N 3.34Å; E203-D205 PolarHBondContact O-N 2.89Å; E203-F206 WeakPolarHBondContact O-CB 3.24Å; E203-F206 PolarHBondContact O-N 3.29Å; E203-Q207 WeakPolarHBondContact O-CB 3.48Å; E203-Q207 VanDerWaalsContact O-CG 3.31Å; E203-Q207 WeakPolarHBondContact O-CG 3.28Å; E203-Q207 PolarHBondContact O-N 3.02Å; E203-Q207 PolarHBondContact OE1-NE2 3.25Å
204	L	97.9	Very high	97.7	Very high	85 Å²	85	100.8 Å²	100.8	45%	0.445	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-40.7	177.9	175	63.1	0	0	0	112.3	M200 K201 Q207 K208	M200-L204 VanDerWaalsContact O-CB 3.23Å; M200-L204 WeakPolarHBondContact O-CB 3.32Å; M200-L204 PolarHBondContact O-N 2.83Å; K201-L204 PolarHBondContact O-N 2.88Å; L204-Q207 PolarHBondContact O-N 2.87Å; L204-K208 VanDerWaalsContact O-CG 3.29Å; L204-K208 WeakPolarHBondContact O-CG 3.27Å; L204-K208 PolarHBondContact O-N 2.86Å
205	D	97.9	Very high	97.5	Very high	64 Å²	64	101 Å²	101	34%	0.342	49%	0.488	S	S	.	.	H	α-helix	trans	-73	-33.4	177.4	-71.5	-24.2	0	0	0	111.6	K201 E202 E203 K208 N209	K201-D205 WeakPolarHBondContact O-CB 3.5Å; K201-D205 PolarHBondContact O-N 2.87Å; E202-D205 PolarHBondContact O-N 2.89Å; E203-D205 PolarHBondContact O-N 2.89Å; D205-K208 IonicContact OD1-NZ 3.64Å; D205-K208 PolarHBondContact OD1-NZ 3.33Å; D205-N209 PolarHBondContact O-N 2.92Å; D205-N209 PolarHBondContact O-ND2 2.84Å
206	F	98.3	Very high	97.4	Very high	129 Å²	129	102.2 Å²	102.2	57%	0.566	49%	0.485	S	S	*	.	H	α-helix	trans	-62	-49	167.6	173	-100.8	0	0	0	112	E202 E203 K208 N209 I210	E202-F206 WeakPolarHBondContact O-CB 3.18Å; E202-F206 PolarHBondContact O-N 2.81Å; E203-F206 WeakPolarHBondContact O-CB 3.24Å; E203-F206 PolarHBondContact O-N 3.29Å; F206-K208 PolarHBondContact O-N 2.78Å; F206-N209 WeakPolarHBondContact O-CB 3.14Å; F206-N209 PolarHBondContact O-N 3.03Å; F206-N209 VanDerWaalsContact O-N 3.11Å; F206-I210 HydrophobicContact CD1-CG1 4.37Å; F206-I210 HydrophobicContact CD2-CG1 4.44Å; F206-I210 HydrophobicContact CE1-CG1 3.93Å; F206-I210 HydrophobicContact CE2-CD1 4.05Å; F206-I210 HydrophobicContact CE2-CG1 4.01Å; F206-I210 HydrophobicContact CZ-CD1 3.91Å; F206-I210 HydrophobicContact CZ-CG1 3.73Å; F206-I210 WeakPolarHBondContact O-CG1 3.38Å; F206-I210 PolarHBondContact O-N 2.8Å
207	Q	97.8	Very high	97.3	Very high	73 Å²	73	97.7 Å²	97.7	34%	0.341	47%	0.47	S	S	.	.	H	α-helix	trans	-58.9	-44.4	177	-72.3	177.7	15.1	0	0	111.5	E203 L204 N209 I210 Y211	E203-Q207 WeakPolarHBondContact O-CB 3.48Å; E203-Q207 VanDerWaalsContact O-CG 3.31Å; E203-Q207 WeakPolarHBondContact O-CG 3.28Å; E203-Q207 PolarHBondContact O-N 3.02Å; E203-Q207 PolarHBondContact OE1-NE2 3.25Å; L204-Q207 PolarHBondContact O-N 2.87Å; Q207-N209 VanDerWaalsContact C-N 3.32Å; Q207-N209 PolarHBondContact O-N 2.8Å; Q207-I210 PolarHBondContact O-N 3.23Å; Q207-Y211 HydrophobicContact CB-CD2 4.5Å; Q207-Y211 HydrophobicContact CB-CE2 4.3Å; Q207-Y211 WeakPolarHBondContact O-CD2 3.47Å; Q207-Y211 PolarHBondContact O-N 2.88Å
208	K	97.8	Very high	97.1	Very high	103 Å²	103	95.1 Å²	95.1	45%	0.448	46%	0.46	S	S	.	.	H	α-helix	trans	-56.7	-44.5	173.1	-74.5	169.6	-162.7	153.3	0	112.1	L204 D205 F206 Y211 S212	L204-K208 VanDerWaalsContact O-CG 3.29Å; L204-K208 WeakPolarHBondContact O-CG 3.27Å; L204-K208 PolarHBondContact O-N 2.86Å; D205-K208 IonicContact OD1-NZ 3.64Å; D205-K208 PolarHBondContact OD1-NZ 3.33Å; F206-K208 PolarHBondContact O-N 2.78Å; K208-Y211 PolarHBondContact O-N 3.07Å; K208-S212 WeakPolarHBondContact O-CB 3.37Å; K208-S212 PolarHBondContact O-N 2.86Å
209	N	97.8	Very high	97	Very high	102 Å²	102	97.3 Å²	97.3	55%	0.545	47%	0.468	S	S	.	.	H	α-helix	trans	-62.8	-48.3	179.4	-69.6	-19.1	0	0	0	110.6	D205 F206 Q207 Y211 S212 E213	D205-N209 PolarHBondContact O-N 2.92Å; D205-N209 PolarHBondContact O-ND2 2.84Å; F206-N209 WeakPolarHBondContact O-CB 3.14Å; F206-N209 PolarHBondContact O-N 3.03Å; F206-N209 VanDerWaalsContact O-N 3.11Å; Q207-N209 VanDerWaalsContact C-N 3.32Å; Q207-N209 PolarHBondContact O-N 2.8Å; N209-Y211 PolarHBondContact O-N 2.94Å; N209-S212 WeakPolarHBondContact O-CA 3.45Å; N209-S212 WeakPolarHBondContact O-CB 3.19Å; N209-S212 PolarHBondContact O-N 3.07Å; N209-S212 PolarHBondContact O-OG 2.89Å; N209-E213 PolarHBondContact O-N 2.73Å
210	I	97.9	Very high	96.8	Very high	77 Å²	77	100 Å²	100	40%	0.395	47%	0.469	S	S	.	.	H	α-helix	trans	-56.7	-49.1	175.3	-65	-63.9	0	0	0	111.6	F206 Q207 S212 E213 E214	F206-I210 HydrophobicContact CD1-CG1 4.37Å; F206-I210 HydrophobicContact CD2-CG1 4.44Å; F206-I210 HydrophobicContact CE1-CG1 3.93Å; F206-I210 HydrophobicContact CE2-CD1 4.05Å; F206-I210 HydrophobicContact CE2-CG1 4.01Å; F206-I210 HydrophobicContact CZ-CD1 3.91Å; F206-I210 HydrophobicContact CZ-CG1 3.73Å; F206-I210 WeakPolarHBondContact O-CG1 3.38Å; F206-I210 PolarHBondContact O-N 2.8Å; Q207-I210 PolarHBondContact O-N 3.23Å; I210-S212 VanDerWaalsContact C-N 3.27Å; I210-S212 PolarHBondContact O-N 3.48Å; I210-E213 PolarHBondContact O-N 3.27Å; I210-E214 PolarHBondContact O-N 2.71Å
211	Y	96.2	Very high	96.6	Very high	149 Å²	149	101.9 Å²	101.9	58%	0.584	47%	0.47	S	S	*	.	H	α-helix	trans	-62.6	-32.9	176.1	-71.2	-52.5	0	0	0	112.8	Q207 K208 N209 L215	Q207-Y211 HydrophobicContact CB-CD2 4.5Å; Q207-Y211 HydrophobicContact CB-CE2 4.3Å; Q207-Y211 WeakPolarHBondContact O-CD2 3.47Å; Q207-Y211 PolarHBondContact O-N 2.88Å; K208-Y211 PolarHBondContact O-N 3.07Å; N209-Y211 PolarHBondContact O-N 2.94Å; Y211-L215 WeakPolarHBondContact O-CB 3.43Å; Y211-L215 PolarHBondContact O-N 3.03Å
212	S	97	Very high	96.3	Very high	65 Å²	65	101.8 Å²	101.8	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-69.7	-36.2	175.7	83	0	0	0	0	112.3	K208 N209 I210 R216	K208-S212 WeakPolarHBondContact O-CB 3.37Å; K208-S212 PolarHBondContact O-N 2.86Å; N209-S212 WeakPolarHBondContact O-CA 3.45Å; N209-S212 WeakPolarHBondContact O-CB 3.19Å; N209-S212 PolarHBondContact O-N 3.07Å; N209-S212 PolarHBondContact O-OG 2.89Å; I210-S212 VanDerWaalsContact C-N 3.27Å; I210-S212 PolarHBondContact O-N 3.48Å; S212-R216 VanDerWaalsContact O-CB 3.32Å; S212-R216 WeakPolarHBondContact O-CB 3.39Å; S212-R216 PolarHBondContact O-N 3.48Å
213	E	95.4	Very high	96.1	Very high	105 Å²	105	102.7 Å²	102.7	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-74.3	-39.7	175.7	-67.3	-153.8	116.6	0	0	112.1	N209 I210 L215 R216 E217	N209-E213 PolarHBondContact O-N 2.73Å; I210-E213 PolarHBondContact O-N 3.27Å; E213-L215 VanDerWaalsContact C-N 3.34Å; E213-R216 WeakPolarHBondContact O-CB 3.42Å; E213-R216 PolarHBondContact O-N 2.78Å; E213-E217 VanDerWaalsContact O-CB 3.24Å; E213-E217 WeakPolarHBondContact O-CB 3.2Å; E213-E217 PolarHBondContact O-N 2.84Å
214	E	96.1	Very high	95.8	Very high	116 Å²	116	101.3 Å²	101.3	54%	0.542	47%	0.473	S	S	.	.	H	α-helix	trans	-62.7	-41.8	172	-174.2	176.3	-156.7	0	0	111	I210 E217 T218	I210-E214 PolarHBondContact O-N 2.71Å; E214-E217 PolarHBondContact O-N 2.88Å; E214-T218 WeakPolarHBondContact O-CB 3.36Å; E214-T218 WeakPolarHBondContact O-CG2 3.39Å; E214-T218 PolarHBondContact O-N 3.39Å; E214-T218 PolarHBondContact O-OG1 2.9Å
215	L	95.6	Very high	95.6	Very high	92 Å²	92	104.4 Å²	104.4	48%	0.482	48%	0.478	S	S	.	.	H	α-helix	trans	-66.9	-36.7	173.9	-174.3	61.7	0	0	0	112.3	Y211 E213 T218 K219	Y211-L215 WeakPolarHBondContact O-CB 3.43Å; Y211-L215 PolarHBondContact O-N 3.03Å; E213-L215 VanDerWaalsContact C-N 3.34Å; L215-T218 WeakPolarHBondContact CA-OG1 3.45Å; L215-T218 PolarHBondContact O-OG1 2.72Å; L215-K219 HydrophobicContact CD1-CD 4.44Å; L215-K219 HydrophobicContact CD1-CG 4.49Å; L215-K219 HydrophobicContact CG-CD 4.24Å; L215-K219 VanDerWaalsContact O-CB 3.25Å; L215-K219 WeakPolarHBondContact O-CB 3.5Å; L215-K219 WeakPolarHBondContact O-CD 3.45Å; L215-K219 WeakPolarHBondContact O-CG 3.49Å; L215-K219 PolarHBondContact O-N 2.95Å
216	R	95.8	Very high	95.2	Very high	124 Å²	124	105 Å²	105	47%	0.468	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-43.1	172.6	-176.4	-166.4	56.4	55.2	-2.1	110.8	S212 E213 R220	S212-R216 VanDerWaalsContact O-CB 3.32Å; S212-R216 WeakPolarHBondContact O-CB 3.39Å; S212-R216 PolarHBondContact O-N 3.48Å; E213-R216 WeakPolarHBondContact O-CB 3.42Å; E213-R216 PolarHBondContact O-N 2.78Å; R216-R220 VanDerWaalsContact O-CB 3.29Å; R216-R220 WeakPolarHBondContact O-CB 3.43Å; R216-R220 PolarHBondContact O-N 3.02Å
217	E	95.1	Very high	94.9	Very high	57 Å²	57	102.5 Å²	102.5	27%	0.266	48%	0.476	S	S	.	.	H	α-helix	trans	-76.4	-39.2	-174.5	-172	54.7	-150.9	0	0	112.4	E213 E214 R220 R221	E213-E217 VanDerWaalsContact O-CB 3.24Å; E213-E217 WeakPolarHBondContact O-CB 3.2Å; E213-E217 PolarHBondContact O-N 2.84Å; E214-E217 PolarHBondContact O-N 2.88Å; E217-R220 PolarHBondContact O-N 2.95Å; E217-R221 WeakPolarHBondContact O-CB 3.4Å; E217-R221 VanDerWaalsContact O-CG 3.25Å; E217-R221 WeakPolarHBondContact O-CG 3.31Å; E217-R221 PolarHBondContact O-N 2.84Å; E217-R221 IonicContact OE1-CZ 2.67Å; E217-R221 IonicContact OE1-NE 3.33Å; E217-R221 PolarHBondContact OE1-NE 2.81Å; E217-R221 VanDerWaalsContact OE1-NE 3.1Å; E217-R221 IonicContact OE1-NH2 3.87Å
218	T	94.4	Very high	94.6	Very high	70 Å²	70	104.9 Å²	104.9	43%	0.429	49%	0.487	S	S	.	.	H	α-helix	trans	-64.9	-41.3	170.7	49.5	0	0	0	0	111.9	E214 L215 R221 H222	E214-T218 WeakPolarHBondContact O-CB 3.36Å; E214-T218 WeakPolarHBondContact O-CG2 3.39Å; E214-T218 PolarHBondContact O-N 3.39Å; E214-T218 PolarHBondContact O-OG1 2.9Å; L215-T218 WeakPolarHBondContact CA-OG1 3.45Å; L215-T218 PolarHBondContact O-OG1 2.72Å; T218-R221 PolarHBondContact O-N 3.28Å; T218-H222 PolarHBondContact O-N 3.09Å
219	K	95	Very high	94.3	Very high	129 Å²	129	103.8 Å²	103.8	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-60.1	-48.9	170.8	-77.6	173.3	179.5	176.9	0	111.8	L215 R221 H222 E223	L215-K219 HydrophobicContact CD1-CD 4.44Å; L215-K219 HydrophobicContact CD1-CG 4.49Å; L215-K219 HydrophobicContact CG-CD 4.24Å; L215-K219 VanDerWaalsContact O-CB 3.25Å; L215-K219 WeakPolarHBondContact O-CB 3.5Å; L215-K219 WeakPolarHBondContact O-CD 3.45Å; L215-K219 WeakPolarHBondContact O-CG 3.49Å; L215-K219 PolarHBondContact O-N 2.95Å; K219-R221 VanDerWaalsContact C-N 3.33Å; K219-R221 PolarHBondContact O-N 3.21Å; K219-H222 WeakPolarHBondContact O-CB 3.33Å; K219-H222 PolarHBondContact O-N 2.79Å; K219-E223 WeakPolarHBondContact O-CB 3.27Å; K219-E223 PolarHBondContact O-N 3.22Å
220	R	94.5	Very high	94	Very high	142 Å²	142	102.6 Å²	102.6	54%	0.536	48%	0.479	S	S	.	.	H	α-helix	trans	-55	-45.8	176.7	178.8	178.7	174.6	77.5	-1.4	111.9	R216 E217 H222 E223 T224	R216-R220 VanDerWaalsContact O-CB 3.29Å; R216-R220 WeakPolarHBondContact O-CB 3.43Å; R216-R220 PolarHBondContact O-N 3.02Å; E217-R220 PolarHBondContact O-N 2.95Å; R220-H222 VanDerWaalsContact C-N 3.3Å; R220-H222 PolarHBondContact O-N 3.31Å; R220-E223 PolarHBondContact O-N 3.22Å; R220-T224 WeakPolarHBondContact O-CG2 3.29Å; R220-T224 PolarHBondContact O-N 3.38Å; R220-T224 PolarHBondContact O-OG1 3.23Å
221	R	93.1	Very high	93.7	Very high	152 Å²	152	102.4 Å²	102.4	57%	0.574	48%	0.479	S	S	*	.	H	α-helix	trans	-68.3	-25	177.5	-69.3	169.5	-171.3	-169.2	2.6	113.9	E217 T218 K219 T224	E217-R221 WeakPolarHBondContact O-CB 3.4Å; E217-R221 VanDerWaalsContact O-CG 3.25Å; E217-R221 WeakPolarHBondContact O-CG 3.31Å; E217-R221 PolarHBondContact O-N 2.84Å; E217-R221 IonicContact OE1-CZ 2.67Å; E217-R221 IonicContact OE1-NE 3.33Å; E217-R221 PolarHBondContact OE1-NE 2.81Å; E217-R221 VanDerWaalsContact OE1-NE 3.1Å; E217-R221 IonicContact OE1-NH2 3.87Å; T218-R221 PolarHBondContact O-N 3.28Å; K219-R221 VanDerWaalsContact C-N 3.33Å; K219-R221 PolarHBondContact O-N 3.21Å; R221-T224 PolarHBondContact O-OG1 2.79Å
222	H	92.1	Very high	93.4	Very high	106 Å²	106	96.4 Å²	96.4	49%	0.491	46%	0.462	S	S	.	.	H	α-helix	trans	-79.2	-43.9	172.2	-173.2	64.5	0	0	0	111	T218 K219 R220 R225 L226	T218-H222 PolarHBondContact O-N 3.09Å; K219-H222 WeakPolarHBondContact O-CB 3.33Å; K219-H222 PolarHBondContact O-N 2.79Å; R220-H222 VanDerWaalsContact C-N 3.3Å; R220-H222 PolarHBondContact O-N 3.31Å; H222-R225 WeakPolarHBondContact O-CB 3.18Å; H222-R225 PolarHBondContact O-N 2.91Å; H222-L226 WeakPolarHBondContact O-CG 3.45Å; H222-L226 PolarHBondContact O-N 3.49Å
223	E	93.8	Very high	93.1	Very high	127 Å²	127	98 Å²	98	59%	0.593	46%	0.461	S	S	*	.	H	α-helix	trans	-60.8	-45.7	176.6	-175.8	173.1	-141.3	0	0	112	K219 R220 R225 L226 V227	K219-E223 WeakPolarHBondContact O-CB 3.27Å; K219-E223 PolarHBondContact O-N 3.22Å; R220-E223 PolarHBondContact O-N 3.22Å; E223-R225 VanDerWaalsContact C-N 3.3Å; E223-R225 PolarHBondContact O-N 3.39Å; E223-L226 PolarHBondContact O-N 3.14Å; E223-V227 WeakPolarHBondContact O-CB 3.12Å; E223-V227 WeakPolarHBondContact O-CG2 3.45Å; E223-V227 PolarHBondContact O-N 2.76Å
224	T	92.7	Very high	92.9	Very high	61 Å²	61	97.8 Å²	97.8	37%	0.374	46%	0.46	S	S	.	.	H	α-helix	trans	-60.8	-39.5	173.6	56.4	0	0	0	0	111.8	R220 R221 V227 E228	R220-T224 WeakPolarHBondContact O-CG2 3.29Å; R220-T224 PolarHBondContact O-N 3.38Å; R220-T224 PolarHBondContact O-OG1 3.23Å; R221-T224 PolarHBondContact O-OG1 2.79Å; T224-V227 PolarHBondContact O-N 3.17Å; T224-E228 WeakPolarHBondContact O-CB 3.39Å; T224-E228 VanDerWaalsContact O-CG 3.24Å; T224-E228 WeakPolarHBondContact O-CG 3.47Å; T224-E228 PolarHBondContact O-N 2.85Å
225	R	92.8	Very high	92.7	Very high	149 Å²	149	99.4 Å²	99.4	56%	0.562	46%	0.461	S	S	*	.	H	α-helix	trans	-67.1	-38.4	176.9	-168.6	-172.3	-58.2	174.8	1.8	112.4	H222 E223 E228 I229	H222-R225 WeakPolarHBondContact O-CB 3.18Å; H222-R225 PolarHBondContact O-N 2.91Å; E223-R225 VanDerWaalsContact C-N 3.3Å; E223-R225 PolarHBondContact O-N 3.39Å; R225-E228 PolarHBondContact O-N 3.49Å; R225-I229 HydrophobicContact CG-CD1 4.14Å; R225-I229 WeakPolarHBondContact O-CB 3.34Å; R225-I229 WeakPolarHBondContact O-CD1 3.27Å; R225-I229 VanDerWaalsContact O-CG1 3.23Å; R225-I229 WeakPolarHBondContact O-CG1 3.44Å; R225-I229 PolarHBondContact O-N 2.82Å
226	L	90.1	Very high	92.6	Very high	78 Å²	78	99.5 Å²	99.5	41%	0.408	46%	0.459	S	S	.	.	H	α-helix	trans	-63.7	-46.4	173.4	-71	175.1	0	0	0	110.5	H222 E223 E228 I229 D230	H222-L226 WeakPolarHBondContact O-CG 3.45Å; H222-L226 PolarHBondContact O-N 3.49Å; E223-L226 PolarHBondContact O-N 3.14Å; L226-E228 PolarHBondContact O-N 3.18Å; L226-I229 PolarHBondContact O-N 3.45Å; L226-D230 WeakPolarHBondContact O-CB 3.42Å; L226-D230 PolarHBondContact O-N 2.73Å
227	V	92.7	Very high	92.4	Very high	75 Å²	75	100.5 Å²	100.5	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-63.9	-37.2	176.6	171.1	0	0	0	0	112	E223 T224 N231	E223-V227 WeakPolarHBondContact O-CB 3.12Å; E223-V227 WeakPolarHBondContact O-CG2 3.45Å; E223-V227 PolarHBondContact O-N 2.76Å; T224-V227 PolarHBondContact O-N 3.17Å; V227-N231 VanDerWaalsContact CG1-ND2 3.35Å; V227-N231 WeakPolarHBondContact CG1-ND2 3.39Å; V227-N231 WeakPolarHBondContact O-CB 3.45Å; V227-N231 PolarHBondContact O-N 3.49Å; V227-N231 PolarHBondContact O-ND2 3.4Å; V227-N231 VanDerWaalsContact O-ND2 3.16Å
228	E	90.6	Very high	92.3	Very high	123 Å²	123	102.6 Å²	102.6	58%	0.575	48%	0.477	S	S	*	.	H	α-helix	trans	-62	-44.4	172.2	-77.9	161.9	-167.8	0	0	112.1	T224 R225 L226 G232	T224-E228 WeakPolarHBondContact O-CB 3.39Å; T224-E228 VanDerWaalsContact O-CG 3.24Å; T224-E228 WeakPolarHBondContact O-CG 3.47Å; T224-E228 PolarHBondContact O-N 2.85Å; R225-E228 PolarHBondContact O-N 3.49Å; L226-E228 PolarHBondContact O-N 3.18Å; E228-G232 PolarHBondContact O-N 3.35Å
229	I	91.5	Very high	92.3	Very high	81 Å²	81	102.2 Å²	102.2	42%	0.415	48%	0.477	S	S	.	.	H	α-helix	trans	-65.8	-45.9	177.4	-72.6	165.7	0	0	0	110.9	R225 L226 G232 K233	R225-I229 HydrophobicContact CG-CD1 4.14Å; R225-I229 WeakPolarHBondContact O-CB 3.34Å; R225-I229 WeakPolarHBondContact O-CD1 3.27Å; R225-I229 VanDerWaalsContact O-CG1 3.23Å; R225-I229 WeakPolarHBondContact O-CG1 3.44Å; R225-I229 PolarHBondContact O-N 2.82Å; L226-I229 PolarHBondContact O-N 3.45Å; I229-G232 WeakPolarHBondContact O-CA 3.46Å; I229-G232 PolarHBondContact O-N 3.1Å; I229-G232 VanDerWaalsContact O-N 3.14Å; I229-K233 HydrophobicContact CG2-CD 4.47Å; I229-K233 WeakPolarHBondContact O-CG 3.3Å; I229-K233 PolarHBondContact O-N 3.03Å
230	D	91.6	Very high	92.2	Very high	77 Å²	77	103.1 Å²	103.1	41%	0.412	48%	0.477	S	S	.	.	H	α-helix	trans	-75.1	-37.4	-176.8	-70.9	-20.1	0	0	0	111.9	L226 G232 K233 Q234	L226-D230 WeakPolarHBondContact O-CB 3.42Å; L226-D230 PolarHBondContact O-N 2.73Å; D230-G232 PolarHBondContact O-N 2.7Å; D230-K233 PolarHBondContact O-N 2.87Å; D230-K233 WeakPolarHBondContact OD1-CE 3.35Å; D230-K233 IonicContact OD1-NZ 2.65Å; D230-K233 PolarHBondContact OD1-NZ 3.13Å; D230-Q234 VanDerWaalsContact O-CB 3.3Å; D230-Q234 WeakPolarHBondContact O-CB 3.1Å; D230-Q234 PolarHBondContact O-N 2.8Å
231	N	91	Very high	92.1	Very high	73 Å²	73	101.7 Å²	101.7	39%	0.39	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-31.7	165.7	-72.5	-23.8	0	0	0	111.6	V227 R235	V227-N231 VanDerWaalsContact CG1-ND2 3.35Å; V227-N231 WeakPolarHBondContact CG1-ND2 3.39Å; V227-N231 WeakPolarHBondContact O-CB 3.45Å; V227-N231 PolarHBondContact O-N 3.49Å; V227-N231 PolarHBondContact O-ND2 3.4Å; V227-N231 VanDerWaalsContact O-ND2 3.16Å; N231-R235 WeakPolarHBondContact O-CB 3.44Å; N231-R235 WeakPolarHBondContact O-CG 3.46Å; N231-R235 VanDerWaalsContact O-CZ 3.27Å; N231-R235 PolarHBondContact O-N 2.96Å; N231-R235 PolarHBondContact O-NE 2.69Å; N231-R235 PolarHBondContact O-NH2 2.71Å
232	G	91.1	Very high	92.2	Very high	22 Å²	22	97 Å²	97	23%	0.227	47%	0.473	C	S	.	.	H	α-helix	trans	-64	-55.1	174	0	0	0	0	0	111.6	E228 I229 D230 Q234 R235 E236	E228-G232 PolarHBondContact O-N 3.35Å; I229-G232 WeakPolarHBondContact O-CA 3.46Å; I229-G232 PolarHBondContact O-N 3.1Å; I229-G232 VanDerWaalsContact O-N 3.14Å; D230-G232 PolarHBondContact O-N 2.7Å; G232-Q234 VanDerWaalsContact C-N 3.33Å; G232-Q234 PolarHBondContact O-N 3.03Å; G232-R235 PolarHBondContact O-N 2.83Å; G232-E236 WeakPolarHBondContact O-CB 3.44Å; G232-E236 PolarHBondContact O-N 3.4Å
233	K	90.8	Very high	92.2	Very high	98 Å²	98	96.1 Å²	96.1	43%	0.426	47%	0.472	S	S	.	.	H	α-helix	trans	-56.5	-45.3	173.9	-64.7	167.7	-167.6	158.6	0	111.6	I229 D230 E236 F237	I229-K233 HydrophobicContact CG2-CD 4.47Å; I229-K233 WeakPolarHBondContact O-CG 3.3Å; I229-K233 PolarHBondContact O-N 3.03Å; D230-K233 PolarHBondContact O-N 2.87Å; D230-K233 WeakPolarHBondContact OD1-CE 3.35Å; D230-K233 IonicContact OD1-NZ 2.65Å; D230-K233 PolarHBondContact OD1-NZ 3.13Å; K233-E236 WeakPolarHBondContact O-CB 3.48Å; K233-E236 PolarHBondContact O-N 2.97Å; K233-F237 HydrophobicContact CB-CD2 4.32Å; K233-F237 HydrophobicContact CB-CE2 4.31Å; K233-F237 WeakPolarHBondContact O-CD2 3.23Å; K233-F237 PolarHBondContact O-N 2.88Å
234	Q	91.3	Very high	92.2	Very high	101 Å²	101	92.6 Å²	92.6	47%	0.472	46%	0.464	S	S	.	.	H	α-helix	trans	-60.4	-48.5	-179.1	178.8	170	-11.4	0	0	110.9	D230 G232 E236 F237 E238	D230-Q234 VanDerWaalsContact O-CB 3.3Å; D230-Q234 WeakPolarHBondContact O-CB 3.1Å; D230-Q234 PolarHBondContact O-N 2.8Å; G232-Q234 VanDerWaalsContact C-N 3.33Å; G232-Q234 PolarHBondContact O-N 3.03Å; Q234-E236 VanDerWaalsContact C-N 3.3Å; Q234-E236 PolarHBondContact O-N 3.07Å; Q234-F237 PolarHBondContact O-N 3.35Å; Q234-E238 HydrophobicContact CG-CG 4.23Å; Q234-E238 VanDerWaalsContact CG-OE1 3.27Å; Q234-E238 WeakPolarHBondContact CG-OE1 3.43Å; Q234-E238 PolarHBondContact NE2-OE1 2.91Å; Q234-E238 WeakPolarHBondContact O-CB 3.36Å; Q234-E238 VanDerWaalsContact O-CG 3.29Å; Q234-E238 WeakPolarHBondContact O-CG 3.44Å; Q234-E238 PolarHBondContact O-N 3.35Å
235	R	90.7	Very high	92.2	Very high	150 Å²	150	93.5 Å²	93.5	57%	0.566	47%	0.467	S	S	*	.	H	α-helix	trans	-62.8	-34.8	174.9	-76.6	175.1	-77.7	111.9	-3.8	113	N231 G232 S239	N231-R235 WeakPolarHBondContact O-CB 3.44Å; N231-R235 WeakPolarHBondContact O-CG 3.46Å; N231-R235 VanDerWaalsContact O-CZ 3.27Å; N231-R235 PolarHBondContact O-N 2.96Å; N231-R235 PolarHBondContact O-NE 2.69Å; N231-R235 PolarHBondContact O-NH2 2.71Å; G232-R235 PolarHBondContact O-N 2.83Å; R235-S239 VanDerWaalsContact O-CB 3.27Å; R235-S239 WeakPolarHBondContact O-CB 3.41Å; R235-S239 PolarHBondContact O-N 2.98Å
236	E	93.4	Very high	92.3	Very high	95 Å²	95	93 Å²	93	44%	0.444	47%	0.471	S	S	.	.	H	α-helix	trans	-67.6	-40.4	174.8	-171.3	-176.6	165.2	0	0	112.2	G232 K233 Q234 R240	G232-E236 WeakPolarHBondContact O-CB 3.44Å; G232-E236 PolarHBondContact O-N 3.4Å; K233-E236 WeakPolarHBondContact O-CB 3.48Å; K233-E236 PolarHBondContact O-N 2.97Å; Q234-E236 VanDerWaalsContact C-N 3.3Å; Q234-E236 PolarHBondContact O-N 3.07Å; E236-R240 WeakPolarHBondContact O-CB 3.49Å; E236-R240 WeakPolarHBondContact O-CG 3.42Å; E236-R240 PolarHBondContact O-N 3.43Å; E236-R240 VanDerWaalsContact O-N 3.1Å; E236-R240 IonicContact OE1-CZ 3.58Å; E236-R240 IonicContact OE1-NH1 3.8Å; E236-R240 PolarHBondContact OE1-NH1 2.66Å; E236-R240 IonicContact OE1-NH2 3.38Å; E236-R240 PolarHBondContact OE1-NH2 2.64Å
237	F	91.6	Very high	92.5	Very high	144 Å²	144	95.2 Å²	95.2	63%	0.632	48%	0.479	S	S	*	.	H	α-helix	trans	-69.5	-44.8	173.7	-78.9	-61.9	0	0	0	112.2	K233 Q234 R240 L241	K233-F237 HydrophobicContact CB-CD2 4.32Å; K233-F237 HydrophobicContact CB-CE2 4.31Å; K233-F237 WeakPolarHBondContact O-CD2 3.23Å; K233-F237 PolarHBondContact O-N 2.88Å; Q234-F237 PolarHBondContact O-N 3.35Å; F237-R240 PolarHBondContact O-N 2.81Å; F237-L241 WeakPolarHBondContact O-CB 3.46Å; F237-L241 PolarHBondContact O-N 3.16Å
238	E	93.5	Very high	92.6	Very high	102 Å²	102	95.3 Å²	95.3	48%	0.477	48%	0.477	S	S	.	.	H	α-helix	trans	-63.2	-43.3	177.8	-74.9	170.4	174	0	0	111.4	Q234 L241 A242	Q234-E238 HydrophobicContact CG-CG 4.23Å; Q234-E238 VanDerWaalsContact CG-OE1 3.27Å; Q234-E238 WeakPolarHBondContact CG-OE1 3.43Å; Q234-E238 PolarHBondContact NE2-OE1 2.91Å; Q234-E238 WeakPolarHBondContact O-CB 3.36Å; Q234-E238 VanDerWaalsContact O-CG 3.29Å; Q234-E238 WeakPolarHBondContact O-CG 3.44Å; Q234-E238 PolarHBondContact O-N 3.35Å; E238-L241 PolarHBondContact O-N 3.35Å; E238-A242 VanDerWaalsContact O-CB 3.24Å; E238-A242 WeakPolarHBondContact O-CB 3.25Å; E238-A242 PolarHBondContact O-N 3.24Å
239	S	93.8	Very high	92.7	Very high	61 Å²	61	97.6 Å²	97.6	43%	0.427	48%	0.48	S	S	.	.	H	α-helix	trans	-59.4	-57.8	172.7	-170.1	0	0	0	0	110.6	R235 L241 A242 D243	R235-S239 VanDerWaalsContact O-CB 3.27Å; R235-S239 WeakPolarHBondContact O-CB 3.41Å; R235-S239 PolarHBondContact O-N 2.98Å; S239-L241 PolarHBondContact O-N 3.34Å; S239-A242 CarbonylContact O-C 3.58Å; S239-A242 WeakPolarHBondContact O-CB 3.24Å; S239-A242 PolarHBondContact O-N 2.88Å; S239-D243 VanDerWaalsContact C-OD2 3.27Å; S239-D243 WeakPolarHBondContact O-CB 3.37Å; S239-D243 PolarHBondContact O-N 2.9Å; S239-D243 PolarHBondContact OG-OD2 3.14Å; S239-D243 VanDerWaalsContact OG-OD2 3.14Å
240	R	93.6	Very high	92.8	Very high	148 Å²	148	96.2 Å²	96.2	56%	0.558	48%	0.481	S	S	*	.	H	α-helix	trans	-58.7	-34.7	-178.2	-75.6	-174.2	-177.4	125.2	12.8	113.3	E236 F237 A244	E236-R240 WeakPolarHBondContact O-CB 3.49Å; E236-R240 WeakPolarHBondContact O-CG 3.42Å; E236-R240 PolarHBondContact O-N 3.43Å; E236-R240 VanDerWaalsContact O-N 3.1Å; E236-R240 IonicContact OE1-CZ 3.58Å; E236-R240 IonicContact OE1-NH1 3.8Å; E236-R240 PolarHBondContact OE1-NH1 2.66Å; E236-R240 IonicContact OE1-NH2 3.38Å; E236-R240 PolarHBondContact OE1-NH2 2.64Å; F237-R240 PolarHBondContact O-N 2.81Å; R240-A244 VanDerWaalsContact O-CB 3.27Å; R240-A244 WeakPolarHBondContact O-CB 3.44Å; R240-A244 PolarHBondContact O-N 2.82Å
241	L	93.2	Very high	93	Very high	112 Å²	112	96.9 Å²	96.9	59%	0.586	48%	0.481	S	S	*	.	H	α-helix	trans	-72.3	-40.5	176.2	-176.3	61	0	0	0	111.5	F237 E238 S239 L245	F237-L241 WeakPolarHBondContact O-CB 3.46Å; F237-L241 PolarHBondContact O-N 3.16Å; E238-L241 PolarHBondContact O-N 3.35Å; S239-L241 PolarHBondContact O-N 3.34Å; L241-L245 HydrophobicContact CD1-CD1 4.22Å; L241-L245 HydrophobicContact CD1-CG 4.35Å; L241-L245 HydrophobicContact CG-CD1 4.01Å; L241-L245 VanDerWaalsContact O-CB 3.27Å; L241-L245 WeakPolarHBondContact O-CB 3.46Å; L241-L245 WeakPolarHBondContact O-CD1 3.45Å; L241-L245 WeakPolarHBondContact O-CG 3.32Å; L241-L245 PolarHBondContact O-N 3.02Å
242	A	93.8	Very high	93.1	Very high	53 Å²	53	98 Å²	98	44%	0.438	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-44.9	174.1	0	0	0	0	0	111.7	E238 S239 L245 Q246	E238-A242 VanDerWaalsContact O-CB 3.24Å; E238-A242 WeakPolarHBondContact O-CB 3.25Å; E238-A242 PolarHBondContact O-N 3.24Å; S239-A242 CarbonylContact O-C 3.58Å; S239-A242 WeakPolarHBondContact O-CB 3.24Å; S239-A242 PolarHBondContact O-N 2.88Å; A242-L245 PolarHBondContact O-N 3.46Å; A242-Q246 VanDerWaalsContact O-CB 3.32Å; A242-Q246 WeakPolarHBondContact O-CB 3.41Å; A242-Q246 PolarHBondContact O-N 3.38Å
243	D	93.9	Very high	93.2	Very high	88 Å²	88	103.4 Å²	103.4	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-58	-49.9	176.1	-63.8	-41.7	0	0	0	110.4	S239 L245 Q246 E247	S239-D243 VanDerWaalsContact C-OD2 3.27Å; S239-D243 WeakPolarHBondContact O-CB 3.37Å; S239-D243 PolarHBondContact O-N 2.9Å; S239-D243 PolarHBondContact OG-OD2 3.14Å; S239-D243 VanDerWaalsContact OG-OD2 3.14Å; D243-L245 PolarHBondContact O-N 3.48Å; D243-Q246 PolarHBondContact O-N 3.35Å; D243-E247 PolarHBondContact O-N 2.95Å
244	A	93.3	Very high	93.4	Very high	53 Å²	53	102.5 Å²	102.5	44%	0.438	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-35.5	177.8	0	0	0	0	0	113.4	R240 L248	R240-A244 VanDerWaalsContact O-CB 3.27Å; R240-A244 WeakPolarHBondContact O-CB 3.44Å; R240-A244 PolarHBondContact O-N 2.82Å; A244-L248 VanDerWaalsContact O-CB 3.32Å; A244-L248 WeakPolarHBondContact O-CB 3.17Å; A244-L248 PolarHBondContact O-N 3.21Å
245	L	92.8	Very high	93.5	Very high	81 Å²	81	102.1 Å²	102.1	42%	0.424	50%	0.501	S	S	.	.	H	α-helix	trans	-71.2	-32.5	174.1	-75.1	170.3	0	0	0	112.2	L241 A242 D243 R249	L241-L245 HydrophobicContact CD1-CD1 4.22Å; L241-L245 HydrophobicContact CD1-CG 4.35Å; L241-L245 HydrophobicContact CG-CD1 4.01Å; L241-L245 VanDerWaalsContact O-CB 3.27Å; L241-L245 WeakPolarHBondContact O-CB 3.46Å; L241-L245 WeakPolarHBondContact O-CD1 3.45Å; L241-L245 WeakPolarHBondContact O-CG 3.32Å; L241-L245 PolarHBondContact O-N 3.02Å; A242-L245 PolarHBondContact O-N 3.46Å; D243-L245 PolarHBondContact O-N 3.48Å; L245-R249 WeakPolarHBondContact O-CB 3.29Å; L245-R249 VanDerWaalsContact O-CG 3.26Å; L245-R249 WeakPolarHBondContact O-CG 3.2Å; L245-R249 PolarHBondContact O-N 2.8Å
246	Q	94.6	Very high	93.7	Very high	137 Å²	137	99.6 Å²	99.6	64%	0.64	50%	0.503	S	S	*	.	H	α-helix	trans	-72.1	-41.3	173.8	-179.8	169.9	-23.1	0	0	111.1	A242 D243 R249 A250	A242-Q246 VanDerWaalsContact O-CB 3.32Å; A242-Q246 WeakPolarHBondContact O-CB 3.41Å; A242-Q246 PolarHBondContact O-N 3.38Å; D243-Q246 PolarHBondContact O-N 3.35Å; Q246-R249 PolarHBondContact O-N 3.18Å; Q246-A250 WeakPolarHBondContact O-CB 3.36Å; Q246-A250 PolarHBondContact O-N 3.42Å
247	E	94.7	Very high	93.7	Very high	125 Å²	125	98.2 Å²	98.2	58%	0.584	50%	0.496	S	S	*	.	H	α-helix	trans	-63	-44.3	173.5	-166.1	-177.4	-178.7	0	0	111.1	D243 R249 A250 Q251	D243-E247 PolarHBondContact O-N 2.95Å; E247-R249 VanDerWaalsContact C-N 3.33Å; E247-R249 PolarHBondContact O-N 3.27Å; E247-A250 PolarHBondContact O-N 3.05Å; E247-Q251 WeakPolarHBondContact O-CB 3.42Å; E247-Q251 VanDerWaalsContact O-CG 3.3Å; E247-Q251 WeakPolarHBondContact O-CG 3.46Å; E247-Q251 PolarHBondContact O-N 3.36Å; E247-Q251 PolarHBondContact OE1-NE2 2.86Å
248	L	93.3	Very high	93.8	Very high	78 Å²	78	96.4 Å²	96.4	41%	0.408	49%	0.49	S	S	.	.	H	α-helix	trans	-61.4	-39.2	175	-175.8	65.8	0	0	0	112.4	A244 Q251 H252	A244-L248 VanDerWaalsContact O-CB 3.32Å; A244-L248 WeakPolarHBondContact O-CB 3.17Å; A244-L248 PolarHBondContact O-N 3.21Å; L248-Q251 PolarHBondContact O-N 3.05Å; L248-H252 VanDerWaalsContact O-CG 3.31Å; L248-H252 PolarHBondContact O-N 2.82Å
249	R	93.7	Very high	93.7	Very high	170 Å²	170	99.5 Å²	99.5	64%	0.642	50%	0.498	S	S	*	.	H	α-helix	trans	-63.2	-47.9	172.7	-77.6	170.4	-178.5	170.6	1.2	111.6	L245 Q246 E247 Q251 H252 E253	L245-R249 WeakPolarHBondContact O-CB 3.29Å; L245-R249 VanDerWaalsContact O-CG 3.26Å; L245-R249 WeakPolarHBondContact O-CG 3.2Å; L245-R249 PolarHBondContact O-N 2.8Å; Q246-R249 PolarHBondContact O-N 3.18Å; E247-R249 VanDerWaalsContact C-N 3.33Å; E247-R249 PolarHBondContact O-N 3.27Å; R249-Q251 VanDerWaalsContact C-N 3.3Å; R249-Q251 PolarHBondContact O-N 3.33Å; R249-H252 PolarHBondContact O-N 2.88Å; R249-H252 VanDerWaalsContact O-N 3.11Å; R249-E253 WeakPolarHBondContact O-CB 3.25Å; R249-E253 WeakPolarHBondContact O-CG 3.49Å; R249-E253 PolarHBondContact O-N 3.35Å
250	A	93.5	Very high	93.7	Very high	52 Å²	52	100.7 Å²	100.7	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-37.7	177.5	0	0	0	0	0	112.2	Q246 E247 E253 D254	Q246-A250 WeakPolarHBondContact O-CB 3.36Å; Q246-A250 PolarHBondContact O-N 3.42Å; E247-A250 PolarHBondContact O-N 3.05Å; A250-E253 PolarHBondContact O-N 3.32Å; A250-D254 WeakPolarHBondContact O-CB 3.38Å; A250-D254 PolarHBondContact O-N 3.25Å
251	Q	95.3	Very high	93.7	Very high	91 Å²	91	97.9 Å²	97.9	43%	0.425	49%	0.487	S	S	.	.	H	α-helix	trans	-65.3	-40	173.1	-72.1	175.6	17.5	0	0	112.1	E247 L248 R249 Q255	E247-Q251 WeakPolarHBondContact O-CB 3.42Å; E247-Q251 VanDerWaalsContact O-CG 3.3Å; E247-Q251 WeakPolarHBondContact O-CG 3.46Å; E247-Q251 PolarHBondContact O-N 3.36Å; E247-Q251 PolarHBondContact OE1-NE2 2.86Å; L248-Q251 PolarHBondContact O-N 3.05Å; R249-Q251 VanDerWaalsContact C-N 3.3Å; R249-Q251 PolarHBondContact O-N 3.33Å; Q251-Q255 WeakPolarHBondContact O-CB 3.29Å; Q251-Q255 WeakPolarHBondContact O-CG 3.1Å; Q251-Q255 PolarHBondContact O-N 3.39Å; Q251-Q255 PolarHBondContact O-NE2 2.88Å
252	H	92.7	Very high	93.7	Very high	98 Å²	98	97.2 Å²	97.2	45%	0.454	48%	0.481	S	S	.	.	H	α-helix	trans	-69.2	-39.2	174.2	-69.5	173.9	0	0	0	112.5	L248 R249 Q255 V256	L248-H252 VanDerWaalsContact O-CG 3.31Å; L248-H252 PolarHBondContact O-N 2.82Å; R249-H252 PolarHBondContact O-N 2.88Å; R249-H252 VanDerWaalsContact O-N 3.11Å; H252-Q255 PolarHBondContact O-N 2.82Å; H252-V256 WeakPolarHBondContact O-CB 3.37Å; H252-V256 VanDerWaalsContact O-CG2 3.32Å; H252-V256 WeakPolarHBondContact O-CG2 3.46Å; H252-V256 PolarHBondContact O-N 2.85Å
253	E	94.3	Very high	93.5	Very high	135 Å²	135	99.2 Å²	99.2	63%	0.631	48%	0.484	S	S	*	.	H	α-helix	trans	-65	-44.1	176.2	-74.6	171.4	-171.9	0	0	111.5	R249 A250 V256 E257	R249-E253 WeakPolarHBondContact O-CB 3.25Å; R249-E253 WeakPolarHBondContact O-CG 3.49Å; R249-E253 PolarHBondContact O-N 3.35Å; A250-E253 PolarHBondContact O-N 3.32Å; E253-V256 PolarHBondContact O-N 2.94Å; E253-E257 WeakPolarHBondContact O-CB 3.47Å; E253-E257 PolarHBondContact O-N 3.07Å
254	D	94.5	Very high	93.4	Very high	79 Å²	79	99.8 Å²	99.8	42%	0.422	48%	0.484	S	S	.	.	H	α-helix	trans	-68.2	-36.9	174.5	-171.9	61.4	0	0	0	112.1	A250 V256 E257 Q258	A250-D254 WeakPolarHBondContact O-CB 3.38Å; A250-D254 PolarHBondContact O-N 3.25Å; D254-V256 PolarHBondContact O-N 3.42Å; D254-E257 PolarHBondContact O-N 3.21Å; D254-Q258 VanDerWaalsContact O-CB 3.29Å; D254-Q258 WeakPolarHBondContact O-CB 3.49Å; D254-Q258 VanDerWaalsContact O-CG 3.24Å; D254-Q258 WeakPolarHBondContact O-CG 3.24Å; D254-Q258 PolarHBondContact O-N 3.28Å; D254-Q258 PolarHBondContact OD2-NE2 3.11Å
255	Q	94.2	Very high	93.4	Very high	92 Å²	92	102.8 Å²	102.8	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-59.3	-45.5	170.5	-77.3	168.6	36.5	0	0	112	Q251 H252 Q258 Y259	Q251-Q255 WeakPolarHBondContact O-CB 3.29Å; Q251-Q255 WeakPolarHBondContact O-CG 3.1Å; Q251-Q255 PolarHBondContact O-N 3.39Å; Q251-Q255 PolarHBondContact O-NE2 2.88Å; H252-Q255 PolarHBondContact O-N 2.82Å; Q255-Q258 PolarHBondContact O-N 2.63Å; Q255-Y259 WeakPolarHBondContact O-CD2 3.47Å; Q255-Y259 PolarHBondContact O-N 3.05Å
256	V	93.6	Very high	93.4	Very high	98 Å²	98	102 Å²	102	59%	0.594	49%	0.485	S	S	*	.	H	α-helix	trans	-63.9	-42.5	176.9	167.6	0	0	0	0	111.2	H252 E253 D254 Y259 K260	H252-V256 WeakPolarHBondContact O-CB 3.37Å; H252-V256 VanDerWaalsContact O-CG2 3.32Å; H252-V256 WeakPolarHBondContact O-CG2 3.46Å; H252-V256 PolarHBondContact O-N 2.85Å; E253-V256 PolarHBondContact O-N 2.94Å; D254-V256 PolarHBondContact O-N 3.42Å; V256-Y259 PolarHBondContact O-N 3.41Å; V256-K260 VanDerWaalsContact O-CB 3.31Å; V256-K260 WeakPolarHBondContact O-CB 3.23Å; V256-K260 PolarHBondContact O-N 2.69Å
257	E	94.2	Very high	93.1	Very high	65 Å²	65	102.5 Å²	102.5	30%	0.304	48%	0.483	S	S	.	.	H	α-helix	trans	-72.6	-31.1	178.9	-178.8	60.7	-165.4	0	0	112.2	E253 D254 K260 K261	E253-E257 WeakPolarHBondContact O-CB 3.47Å; E253-E257 PolarHBondContact O-N 3.07Å; D254-E257 PolarHBondContact O-N 3.21Å; E257-K260 VanDerWaalsContact CD-NZ 3.29Å; E257-K260 PolarHBondContact O-N 3.33Å; E257-K260 IonicContact OE1-NZ 2.7Å; E257-K260 PolarHBondContact OE1-NZ 3.45Å; E257-K260 VanDerWaalsContact OE2-CD 3.3Å; E257-K260 WeakPolarHBondContact OE2-CD 3.37Å; E257-K260 WeakPolarHBondContact OE2-CE 3.4Å; E257-K260 IonicContact OE2-NZ 2.72Å; E257-K260 PolarHBondContact OE2-NZ 3.44Å; E257-K261 HydrophobicContact CG-CD 4.26Å; E257-K261 VanDerWaalsContact CG-NZ 3.33Å; E257-K261 WeakPolarHBondContact O-CB 3.3Å; E257-K261 WeakPolarHBondContact O-CD 3.32Å; E257-K261 WeakPolarHBondContact O-CG 3.48Å; E257-K261 PolarHBondContact O-N 2.77Å; E257-K261 VanDerWaalsContact OE1-CE 3.22Å; E257-K261 WeakPolarHBondContact OE1-CE 3.45Å; E257-K261 IonicContact OE1-NZ 2.67Å
258	Q	93.7	Very high	92.9	Very high	107 Å²	107	99.3 Å²	99.3	50%	0.5	47%	0.474	S	S	.	.	H	α-helix	trans	-64.4	-49.1	167.7	-76.6	-175.4	39.7	0	0	111	D254 Q255 K260 K261 E262	D254-Q258 VanDerWaalsContact O-CB 3.29Å; D254-Q258 WeakPolarHBondContact O-CB 3.49Å; D254-Q258 VanDerWaalsContact O-CG 3.24Å; D254-Q258 WeakPolarHBondContact O-CG 3.24Å; D254-Q258 PolarHBondContact O-N 3.28Å; D254-Q258 PolarHBondContact OD2-NE2 3.11Å; Q255-Q258 PolarHBondContact O-N 2.63Å; Q258-K260 VanDerWaalsContact C-N 3.27Å; Q258-K260 PolarHBondContact O-N 3.06Å; Q258-K261 PolarHBondContact O-N 3.1Å; Q258-K261 VanDerWaalsContact O-N 3.17Å; Q258-E262 PolarHBondContact O-N 2.91Å
259	Y	90.9	Very high	92.8	Very high	167 Å²	167	97.8 Å²	97.8	66%	0.655	47%	0.473	S	S	*	.	H	α-helix	trans	-58.9	-40	174.8	-77.3	-53.6	0	0	0	111.8	Q255 V256 E262 L263	Q255-Y259 WeakPolarHBondContact O-CD2 3.47Å; Q255-Y259 PolarHBondContact O-N 3.05Å; V256-Y259 PolarHBondContact O-N 3.41Å; Y259-E262 PolarHBondContact O-N 3.17Å; Y259-L263 WeakPolarHBondContact O-CB 3.39Å; Y259-L263 VanDerWaalsContact O-CG 3.29Å; Y259-L263 WeakPolarHBondContact O-CG 3.27Å; Y259-L263 PolarHBondContact O-N 2.93Å
260	K	94.1	Very high	92.6	Very high	86 Å²	86	95.8 Å²	95.8	37%	0.374	47%	0.469	S	S	.	.	H	α-helix	trans	-63.5	-44.9	174.2	175.8	172	146.8	-61	0	111.8	V256 E257 Q258 E262 L263 E264	V256-K260 VanDerWaalsContact O-CB 3.31Å; V256-K260 WeakPolarHBondContact O-CB 3.23Å; V256-K260 PolarHBondContact O-N 2.69Å; E257-K260 VanDerWaalsContact CD-NZ 3.29Å; E257-K260 PolarHBondContact O-N 3.33Å; E257-K260 IonicContact OE1-NZ 2.7Å; E257-K260 PolarHBondContact OE1-NZ 3.45Å; E257-K260 VanDerWaalsContact OE2-CD 3.3Å; E257-K260 WeakPolarHBondContact OE2-CD 3.37Å; E257-K260 WeakPolarHBondContact OE2-CE 3.4Å; E257-K260 IonicContact OE2-NZ 2.72Å; E257-K260 PolarHBondContact OE2-NZ 3.44Å; Q258-K260 VanDerWaalsContact C-N 3.27Å; Q258-K260 PolarHBondContact O-N 3.06Å; K260-E262 PolarHBondContact O-N 2.87Å; K260-L263 WeakPolarHBondContact O-CB 3.44Å; K260-L263 PolarHBondContact O-N 2.88Å; K260-E264 WeakPolarHBondContact CE-OE1 3.36Å; K260-E264 HydrophobicContact CG-CG 4.49Å; K260-E264 VanDerWaalsContact CG-OE1 3.28Å; K260-E264 WeakPolarHBondContact CG-OE1 3.47Å; K260-E264 IonicContact NZ-OE1 3.73Å; K260-E264 PolarHBondContact NZ-OE1 3.49Å; K260-E264 WeakPolarHBondContact O-CB 3.46Å; K260-E264 VanDerWaalsContact O-CG 3.29Å; K260-E264 WeakPolarHBondContact O-CG 3.31Å; K260-E264 PolarHBondContact O-N 3.44Å
261	K	92.6	Very high	92.4	Very high	88 Å²	88	99.2 Å²	99.2	38%	0.383	48%	0.479	S	S	.	.	H	α-helix	trans	-62.5	-39.4	174.7	-74	159.9	-177.6	157.5	0	112.7	E257 Q258 E264 K265	E257-K261 HydrophobicContact CG-CD 4.26Å; E257-K261 VanDerWaalsContact CG-NZ 3.33Å; E257-K261 WeakPolarHBondContact O-CB 3.3Å; E257-K261 WeakPolarHBondContact O-CD 3.32Å; E257-K261 WeakPolarHBondContact O-CG 3.48Å; E257-K261 PolarHBondContact O-N 2.77Å; E257-K261 VanDerWaalsContact OE1-CE 3.22Å; E257-K261 WeakPolarHBondContact OE1-CE 3.45Å; E257-K261 IonicContact OE1-NZ 2.67Å; Q258-K261 PolarHBondContact O-N 3.1Å; Q258-K261 VanDerWaalsContact O-N 3.17Å; K261-E264 PolarHBondContact O-N 2.89Å; K261-K265 WeakPolarHBondContact O-CB 3.33Å; K261-K265 VanDerWaalsContact O-CG 3.29Å; K261-K265 WeakPolarHBondContact O-CG 3.39Å; K261-K265 PolarHBondContact O-N 2.92Å
262	E	93.6	Very high	92.2	Very high	98 Å²	98	98.8 Å²	98.8	46%	0.458	48%	0.48	S	S	.	.	H	α-helix	trans	-70.5	-34.6	174.3	-67.5	-51.3	137.1	0	0	112.7	Q258 Y259 K260 K265 T266	Q258-E262 PolarHBondContact O-N 2.91Å; Y259-E262 PolarHBondContact O-N 3.17Å; K260-E262 PolarHBondContact O-N 2.87Å; E262-K265 IonicContact OE1-NZ 3.47Å; E262-K265 PolarHBondContact OE1-NZ 3.47Å; E262-K265 WeakPolarHBondContact OE2-CD 3.32Å; E262-K265 IonicContact OE2-NZ 2.71Å; E262-T266 VanDerWaalsContact O-CB 3.31Å; E262-T266 WeakPolarHBondContact O-CB 3.48Å; E262-T266 PolarHBondContact O-N 2.81Å; E262-T266 PolarHBondContact O-OG1 3.43Å
263	L	90	Very high	92	Very high	96 Å²	96	98.9 Å²	98.9	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-64.4	-45.9	169.4	-76	168.5	0	0	0	111.2	Y259 K260 T266 Y267	Y259-L263 WeakPolarHBondContact O-CB 3.39Å; Y259-L263 VanDerWaalsContact O-CG 3.29Å; Y259-L263 WeakPolarHBondContact O-CG 3.27Å; Y259-L263 PolarHBondContact O-N 2.93Å; K260-L263 WeakPolarHBondContact O-CB 3.44Å; K260-L263 PolarHBondContact O-N 2.88Å; L263-T266 CarbonylContact O-C 3.59Å; L263-T266 WeakPolarHBondContact O-CA 3.4Å; L263-T266 WeakPolarHBondContact O-CB 3.28Å; L263-T266 PolarHBondContact O-N 2.87Å; L263-T266 VanDerWaalsContact O-N 3.08Å; L263-Y267 HydrophobicContact CB-CD2 4.43Å; L263-Y267 HydrophobicContact CB-CE2 4.39Å; L263-Y267 WeakPolarHBondContact O-CD2 3.46Å; L263-Y267 PolarHBondContact O-N 2.96Å
264	E	92.8	Very high	91.6	Very high	99 Å²	99	95 Å²	95	46%	0.463	48%	0.475	S	S	.	.	H	α-helix	trans	-59.3	-45.8	176.5	-75.3	167.9	-167.5	0	0	111.5	K260 K261 T266 Y267 S268	K260-E264 WeakPolarHBondContact CE-OE1 3.36Å; K260-E264 HydrophobicContact CG-CG 4.49Å; K260-E264 VanDerWaalsContact CG-OE1 3.28Å; K260-E264 WeakPolarHBondContact CG-OE1 3.47Å; K260-E264 IonicContact NZ-OE1 3.73Å; K260-E264 PolarHBondContact NZ-OE1 3.49Å; K260-E264 WeakPolarHBondContact O-CB 3.46Å; K260-E264 VanDerWaalsContact O-CG 3.29Å; K260-E264 WeakPolarHBondContact O-CG 3.31Å; K260-E264 PolarHBondContact O-N 3.44Å; K261-E264 PolarHBondContact O-N 2.89Å; E264-T266 VanDerWaalsContact C-N 3.32Å; E264-T266 PolarHBondContact O-N 3.29Å; E264-Y267 PolarHBondContact O-N 3.27Å; E264-S268 PolarHBondContact O-N 2.96Å; E264-S268 PolarHBondContact O-OG 2.96Å
265	K	93.2	Very high	91.3	Very high	116 Å²	116	99.7 Å²	99.7	50%	0.504	49%	0.487	S	S	.	.	H	α-helix	trans	-58.6	-40.7	170.4	-73	168.9	-176.8	176	0	112.5	K261 E262 S268 A269	K261-K265 WeakPolarHBondContact O-CB 3.33Å; K261-K265 VanDerWaalsContact O-CG 3.29Å; K261-K265 WeakPolarHBondContact O-CG 3.39Å; K261-K265 PolarHBondContact O-N 2.92Å; E262-K265 IonicContact OE1-NZ 3.47Å; E262-K265 PolarHBondContact OE1-NZ 3.47Å; E262-K265 WeakPolarHBondContact OE2-CD 3.32Å; E262-K265 IonicContact OE2-NZ 2.71Å; K265-S268 PolarHBondContact O-OG 2.72Å; K265-S268 VanDerWaalsContact O-OG 3.05Å; K265-A269 WeakPolarHBondContact O-CB 3.34Å; K265-A269 PolarHBondContact O-N 2.71Å
266	T	91.9	Very high	91	Very high	64 Å²	64	99.2 Å²	99.2	39%	0.393	48%	0.484	S	S	.	.	H	α-helix	trans	-69.2	-34.7	178.1	-60	0	0	0	0	111.5	E262 L263 E264 K270	E262-T266 VanDerWaalsContact O-CB 3.31Å; E262-T266 WeakPolarHBondContact O-CB 3.48Å; E262-T266 PolarHBondContact O-N 2.81Å; E262-T266 PolarHBondContact O-OG1 3.43Å; L263-T266 CarbonylContact O-C 3.59Å; L263-T266 WeakPolarHBondContact O-CA 3.4Å; L263-T266 WeakPolarHBondContact O-CB 3.28Å; L263-T266 PolarHBondContact O-N 2.87Å; L263-T266 VanDerWaalsContact O-N 3.08Å; E264-T266 VanDerWaalsContact C-N 3.32Å; E264-T266 PolarHBondContact O-N 3.29Å; T266-K270 HydrophobicContact CG2-CD 4.34Å; T266-K270 WeakPolarHBondContact O-CB 3.46Å; T266-K270 WeakPolarHBondContact O-CD 3.43Å; T266-K270 VanDerWaalsContact O-CG 3.23Å; T266-K270 WeakPolarHBondContact O-CG 3.36Å; T266-K270 PolarHBondContact O-N 3.36Å
267	Y	87.9	Confident	90.5	Very high	148 Å²	148	97.2 Å²	97.2	58%	0.58	48%	0.475	S	S	*	.	H	α-helix	trans	-72.7	-42.7	175.1	-80.4	-63.9	0	0	0	112.2	L263 E264 K270 L271	L263-Y267 HydrophobicContact CB-CD2 4.43Å; L263-Y267 HydrophobicContact CB-CE2 4.39Å; L263-Y267 WeakPolarHBondContact O-CD2 3.46Å; L263-Y267 PolarHBondContact O-N 2.96Å; E264-Y267 PolarHBondContact O-N 3.27Å; Y267-K270 PolarHBondContact O-N 2.99Å; Y267-L271 WeakPolarHBondContact O-CB 3.24Å; Y267-L271 PolarHBondContact O-N 3.32Å
268	S	91.7	Very high	90	Very high	58 Å²	58	96.9 Å²	96.9	41%	0.406	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-44	174.4	63.2	0	0	0	0	111.3	E264 K265 K270 L271 D272	E264-S268 PolarHBondContact O-N 2.96Å; E264-S268 PolarHBondContact O-OG 2.96Å; K265-S268 PolarHBondContact O-OG 2.72Å; K265-S268 VanDerWaalsContact O-OG 3.05Å; S268-K270 VanDerWaalsContact C-N 3.3Å; S268-K270 PolarHBondContact O-N 2.95Å; S268-L271 WeakPolarHBondContact O-CB 3.23Å; S268-L271 PolarHBondContact O-N 3.3Å; S268-L271 VanDerWaalsContact O-N 3.09Å; S268-D272 PolarHBondContact O-N 2.9Å
269	A	90.1	Very high	89.6	Confident	46 Å²	46	97 Å²	97	38%	0.38	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-37.5	173.2	0	0	0	0	0	112.6	K265 N273	K265-A269 WeakPolarHBondContact O-CB 3.34Å; K265-A269 PolarHBondContact O-N 2.71Å; A269-N273 WeakPolarHBondContact O-CB 3.42Å; A269-N273 PolarHBondContact O-N 3.19Å; A269-N273 PolarHBondContact O-ND2 3.47Å
270	K	90.6	Very high	89.2	Confident	128 Å²	128	95.8 Å²	95.8	56%	0.557	48%	0.478	S	S	*	.	H	α-helix	trans	-67.6	-40.9	172.8	-77.8	169.2	-177.9	174.1	0	112.2	T266 Y267 S268 A274	T266-K270 HydrophobicContact CG2-CD 4.34Å; T266-K270 WeakPolarHBondContact O-CB 3.46Å; T266-K270 WeakPolarHBondContact O-CD 3.43Å; T266-K270 VanDerWaalsContact O-CG 3.23Å; T266-K270 WeakPolarHBondContact O-CG 3.36Å; T266-K270 PolarHBondContact O-N 3.36Å; Y267-K270 PolarHBondContact O-N 2.99Å; S268-K270 VanDerWaalsContact C-N 3.3Å; S268-K270 PolarHBondContact O-N 2.95Å; K270-A274 WeakPolarHBondContact O-CB 3.49Å; K270-A274 PolarHBondContact O-N 3.47Å
271	L	88.8	Confident	88.6	Confident	124 Å²	124	96.4 Å²	96.4	65%	0.649	49%	0.485	S	S	*	.	H	α-helix	trans	-63.5	-45.3	175.9	-85.1	163.2	0	0	0	112	Y267 S268 A274 R275	Y267-L271 WeakPolarHBondContact O-CB 3.24Å; Y267-L271 PolarHBondContact O-N 3.32Å; S268-L271 WeakPolarHBondContact O-CB 3.23Å; S268-L271 PolarHBondContact O-N 3.3Å; S268-L271 VanDerWaalsContact O-N 3.09Å; L271-A274 PolarHBondContact O-N 3.21Å; L271-R275 WeakPolarHBondContact O-CB 3.37Å; L271-R275 PolarHBondContact O-N 3.25Å
272	D	89.8	Confident	88.1	Confident	83 Å²	83	95.8 Å²	95.8	44%	0.444	49%	0.492	S	S	.	.	H	α-helix	trans	-69.7	-35.9	178	-77.4	-38	0	0	0	112.2	S268 R275 Q276	S268-D272 PolarHBondContact O-N 2.9Å; D272-R275 PolarHBondContact O-N 3.32Å; D272-Q276 WeakPolarHBondContact O-CB 3.42Å; D272-Q276 VanDerWaalsContact O-CG 3.28Å; D272-Q276 WeakPolarHBondContact O-CG 3.43Å; D272-Q276 PolarHBondContact O-N 2.98Å
273	N	89.3	Confident	87.6	Confident	99 Å²	99	96.2 Å²	96.2	53%	0.529	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-39.6	170.8	-82.8	-64.6	0	0	0	112.1	A269 S277	A269-N273 WeakPolarHBondContact O-CB 3.42Å; A269-N273 PolarHBondContact O-N 3.19Å; A269-N273 PolarHBondContact O-ND2 3.47Å; N273-S277 WeakPolarHBondContact O-CB 3.27Å; N273-S277 PolarHBondContact O-N 2.88Å
274	A	86.5	Confident	87.1	Confident	54 Å²	54	97.3 Å²	97.3	45%	0.446	50%	0.503	S	S	.	.	H	α-helix	trans	-67.6	-38.8	174.3	0	0	0	0	0	112.1	K270 L271 S277 A278	K270-A274 WeakPolarHBondContact O-CB 3.49Å; K270-A274 PolarHBondContact O-N 3.47Å; L271-A274 PolarHBondContact O-N 3.21Å; A274-S277 PolarHBondContact O-N 2.88Å; A274-S277 PolarHBondContact O-OG 3.2Å; A274-A278 WeakPolarHBondContact O-CB 3.41Å; A274-A278 PolarHBondContact O-N 2.89Å
275	R	87.8	Confident	86.5	Confident	177 Å²	177	97.4 Å²	97.4	67%	0.668	51%	0.51	S	S	*	.	H	α-helix	trans	-63	-47.9	174.2	-176.5	179.7	-179.5	169.2	2.7	111.2	L271 D272 S277 A278 E279	L271-R275 WeakPolarHBondContact O-CB 3.37Å; L271-R275 PolarHBondContact O-N 3.25Å; D272-R275 PolarHBondContact O-N 3.32Å; R275-S277 VanDerWaalsContact C-N 3.3Å; R275-S277 PolarHBondContact O-N 2.75Å; R275-A278 PolarHBondContact O-N 3.44Å; R275-E279 WeakPolarHBondContact O-CB 3.39Å; R275-E279 PolarHBondContact O-N 3.36Å
276	Q	87.6	Confident	85.8	Confident	82 Å²	82	93.3 Å²	93.3	38%	0.383	50%	0.501	S	S	.	.	H	α-helix	trans	-63	-33.7	175.3	-74	178.7	44.2	0	0	112.6	D272 R280	D272-Q276 WeakPolarHBondContact O-CB 3.42Å; D272-Q276 VanDerWaalsContact O-CG 3.28Å; D272-Q276 WeakPolarHBondContact O-CG 3.43Å; D272-Q276 PolarHBondContact O-N 2.98Å; Q276-R280 WeakPolarHBondContact O-CB 3.42Å; Q276-R280 WeakPolarHBondContact O-CD 3.36Å; Q276-R280 WeakPolarHBondContact O-CG 3.48Å; Q276-R280 PolarHBondContact O-N 3.44Å
277	S	83.6	Confident	85.2	Confident	56 Å²	56	92.4 Å²	92.4	39%	0.392	50%	0.5	S	S	.	.	H	α-helix	trans	-72.1	-38.6	175.3	75.4	0	0	0	0	111.9	N273 A274 R275 R280 N281	N273-S277 WeakPolarHBondContact O-CB 3.27Å; N273-S277 PolarHBondContact O-N 2.88Å; A274-S277 PolarHBondContact O-N 2.88Å; A274-S277 PolarHBondContact O-OG 3.2Å; R275-S277 VanDerWaalsContact C-N 3.3Å; R275-S277 PolarHBondContact O-N 2.75Å; S277-R280 PolarHBondContact O-N 2.92Å; S277-N281 WeakPolarHBondContact O-CB 3.44Å; S277-N281 VanDerWaalsContact O-CG 3.25Å; S277-N281 PolarHBondContact O-N 2.84Å
278	A	82.9	Confident	84.6	Confident	58 Å²	58	88 Å²	88	48%	0.479	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-39.6	171.6	0	0	0	0	0	112.2	A274 R275 N281 S282	A274-A278 WeakPolarHBondContact O-CB 3.41Å; A274-A278 PolarHBondContact O-N 2.89Å; R275-A278 PolarHBondContact O-N 3.44Å; A278-N281 PolarHBondContact O-N 3.09Å; A278-S282 WeakPolarHBondContact O-CB 3.25Å; A278-S282 PolarHBondContact O-N 3.44Å
279	E	85	Confident	84	Confident	109 Å²	109	91.1 Å²	91.1	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-67.1	-43	175.9	-173.9	170.1	-158.4	0	0	111.9	R275 N281 S282 N283	R275-E279 WeakPolarHBondContact O-CB 3.39Å; R275-E279 PolarHBondContact O-N 3.36Å; E279-N281 VanDerWaalsContact C-N 3.34Å; E279-N281 PolarHBondContact O-N 2.85Å; E279-S282 WeakPolarHBondContact O-CB 3.25Å; E279-S282 PolarHBondContact O-N 3.5Å; E279-N283 PolarHBondContact O-N 2.86Å; E279-N283 PolarHBondContact O-ND2 3.2Å
280	R	82.6	Confident	83.3	Confident	143 Å²	143	94.8 Å²	94.8	54%	0.54	51%	0.511	S	S	.	.	H	α-helix	trans	-59.8	-43.1	170.8	-71.9	167.3	-158.2	167.6	10	111.7	Q276 S277 N283 L284	Q276-R280 WeakPolarHBondContact O-CB 3.42Å; Q276-R280 WeakPolarHBondContact O-CD 3.36Å; Q276-R280 WeakPolarHBondContact O-CG 3.48Å; Q276-R280 PolarHBondContact O-N 3.44Å; S277-R280 PolarHBondContact O-N 2.92Å; R280-N283 PolarHBondContact O-N 3.26Å; R280-L284 WeakPolarHBondContact O-CG 3.15Å; R280-L284 PolarHBondContact O-N 3.45Å
281	N	81.8	Confident	82.7	Confident	99 Å²	99	95.2 Å²	95.2	53%	0.529	52%	0.515	S	S	.	.	H	α-helix	trans	-64.9	-38.7	175.1	-72	-9.1	0	0	0	111.9	S277 A278 E279 N283 L284 V285	S277-N281 WeakPolarHBondContact O-CB 3.44Å; S277-N281 VanDerWaalsContact O-CG 3.25Å; S277-N281 PolarHBondContact O-N 2.84Å; A278-N281 PolarHBondContact O-N 3.09Å; E279-N281 VanDerWaalsContact C-N 3.34Å; E279-N281 PolarHBondContact O-N 2.85Å; N281-N283 VanDerWaalsContact C-N 3.34Å; N281-L284 PolarHBondContact O-N 3.24Å; N281-V285 WeakPolarHBondContact O-CG2 3.31Å; N281-V285 PolarHBondContact O-N 2.95Å
282	S	83.5	Confident	82.1	Confident	75 Å²	75	94.2 Å²	94.2	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-40.6	174.2	-168.5	0	0	0	0	111.8	A278 E279 V285 G286	A278-S282 WeakPolarHBondContact O-CB 3.25Å; A278-S282 PolarHBondContact O-N 3.44Å; E279-S282 WeakPolarHBondContact O-CB 3.25Å; E279-S282 PolarHBondContact O-N 3.5Å; S282-V285 PolarHBondContact O-N 2.99Å; S282-G286 PolarHBondContact O-N 3.01Å
283	N	82.6	Confident	81.7	Confident	106 Å²	106	96 Å²	96	57%	0.567	52%	0.516	S	S	*	.	H	α-helix	trans	-69.4	-36.4	177.2	-66	-15.8	0	0	0	111.9	E279 R280 N281 G286 A287	E279-N283 PolarHBondContact O-N 2.86Å; E279-N283 PolarHBondContact O-ND2 3.2Å; R280-N283 PolarHBondContact O-N 3.26Å; N281-N283 VanDerWaalsContact C-N 3.34Å; N283-G286 PolarHBondContact O-N 3.05Å; N283-A287 PolarHBondContact O-N 2.93Å
284	L	79.3	Confident	81.3	Confident	119 Å²	119	97.5 Å²	97.5	62%	0.623	52%	0.52	S	S	*	.	H	α-helix	trans	-65.4	-39.9	171.4	-71.6	169.6	0	0	0	112.1	R280 N281 A288	R280-L284 WeakPolarHBondContact O-CG 3.15Å; R280-L284 PolarHBondContact O-N 3.45Å; N281-L284 PolarHBondContact O-N 3.24Å; L284-A288 WeakPolarHBondContact O-CB 3.34Å; L284-A288 PolarHBondContact O-N 3.01Å
285	V	79.3	Confident	80.7	Confident	101 Å²	101	97.5 Å²	97.5	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-65.2	-39.1	172.9	168.9	0	0	0	0	111.2	N281 S282 A288 H289	N281-V285 WeakPolarHBondContact O-CG2 3.31Å; N281-V285 PolarHBondContact O-N 2.95Å; S282-V285 PolarHBondContact O-N 2.99Å; V285-A288 PolarHBondContact O-N 3.41Å; V285-H289 WeakPolarHBondContact O-CB 3.45Å; V285-H289 PolarHBondContact O-N 3.36Å
286	G	79.6	Confident	80.4	Confident	30 Å²	30	97.2 Å²	97.2	31%	0.309	52%	0.515	S	S	.	.	H	α-helix	trans	-59.5	-53.9	173.2	0	0	0	0	0	112.3	S282 N283 A288 H289 E290	S282-G286 PolarHBondContact O-N 3.01Å; N283-G286 PolarHBondContact O-N 3.05Å; G286-A288 VanDerWaalsContact C-N 3.34Å; G286-A288 PolarHBondContact O-N 3.43Å; G286-H289 WeakPolarHBondContact O-CA 3.38Å; G286-H289 WeakPolarHBondContact O-CB 3.44Å; G286-H289 PolarHBondContact O-N 3.28Å; G286-E290 PolarHBondContact O-N 2.95Å
287	A	78.4	Confident	80.1	Confident	46 Å²	46	98.7 Å²	98.7	38%	0.38	53%	0.525	S	S	.	.	H	α-helix	trans	-57.3	-44.9	177	0	0	0	0	0	112.2	N283 H289 E290 E291	N283-A287 PolarHBondContact O-N 2.93Å; A287-H289 VanDerWaalsContact C-N 3.26Å; A287-H289 PolarHBondContact O-N 3.31Å; A287-E290 PolarHBondContact O-N 3.45Å; A287-E291 WeakPolarHBondContact O-CG 3.47Å; A287-E291 PolarHBondContact O-N 3.01Å
288	A	75.6	Confident	80	Confident	54 Å²	54	104.9 Å²	104.9	45%	0.446	54%	0.539	S	S	.	.	H	α-helix	trans	-62.3	-31.9	175	0	0	0	0	0	112.8	L284 V285 G286 L292	L284-A288 WeakPolarHBondContact O-CB 3.34Å; L284-A288 PolarHBondContact O-N 3.01Å; V285-A288 PolarHBondContact O-N 3.41Å; G286-A288 VanDerWaalsContact C-N 3.34Å; G286-A288 PolarHBondContact O-N 3.43Å; A288-L292 WeakPolarHBondContact O-CB 3.41Å; A288-L292 PolarHBondContact O-N 2.96Å; A288-L292 VanDerWaalsContact O-N 3.08Å
289	H	78.8	Confident	79.9	Confident	124 Å²	124	106.8 Å²	106.8	57%	0.574	54%	0.54	S	S	*	.	H	α-helix	trans	-74.3	-35.9	175.8	-151.6	78.4	0	0	0	112.4	V285 G286 A287 L292 Q293	V285-H289 WeakPolarHBondContact O-CB 3.45Å; V285-H289 PolarHBondContact O-N 3.36Å; G286-H289 WeakPolarHBondContact O-CA 3.38Å; G286-H289 WeakPolarHBondContact O-CB 3.44Å; G286-H289 PolarHBondContact O-N 3.28Å; A287-H289 VanDerWaalsContact C-N 3.26Å; A287-H289 PolarHBondContact O-N 3.31Å; H289-L292 PolarHBondContact O-N 2.67Å; H289-Q293 PolarHBondContact O-N 2.67Å
290	E	76.7	Confident	79.6	Confident	124 Å²	124	106.2 Å²	106.2	58%	0.579	54%	0.541	S	S	*	.	H	α-helix	trans	-66.7	-44.8	173	-70.5	178.8	-170.1	0	0	111.8	G286 A287 L292 Q293 Q294	G286-E290 PolarHBondContact O-N 2.95Å; A287-E290 PolarHBondContact O-N 3.45Å; E290-L292 VanDerWaalsContact C-N 3.27Å; E290-L292 PolarHBondContact O-N 3.02Å; E290-Q293 PolarHBondContact O-N 3.06Å; E290-Q294 WeakPolarHBondContact O-CG 3.44Å; E290-Q294 PolarHBondContact O-N 3.35Å
291	E	77.7	Confident	79.7	Confident	136 Å²	136	102 Å²	102	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-57.8	-41.4	171.7	-73.7	-177.1	178	0	0	111.5	A287 Q294 S295	A287-E291 WeakPolarHBondContact O-CG 3.47Å; A287-E291 PolarHBondContact O-N 3.01Å; E291-Q294 PolarHBondContact O-N 2.97Å; E291-S295 WeakPolarHBondContact O-CB 3.3Å; E291-S295 PolarHBondContact O-N 3.46Å
292	L	76.6	Confident	79.4	Confident	104 Å²	104	101.5 Å²	101.5	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-66.9	-40.9	178	-150.4	162.2	0	0	0	111.2	A288 H289 E290 S295 R296	A288-L292 WeakPolarHBondContact O-CB 3.41Å; A288-L292 PolarHBondContact O-N 2.96Å; A288-L292 VanDerWaalsContact O-N 3.08Å; H289-L292 PolarHBondContact O-N 2.67Å; E290-L292 VanDerWaalsContact C-N 3.27Å; E290-L292 PolarHBondContact O-N 3.02Å; L292-S295 PolarHBondContact O-N 2.77Å; L292-S295 PolarHBondContact O-OG 3.04Å; L292-R296 WeakPolarHBondContact O-CB 3.27Å; L292-R296 PolarHBondContact O-N 3.07Å
293	Q	80	Confident	79.3	Confident	120 Å²	120	100.9 Å²	100.9	56%	0.561	53%	0.526	S	S	*	.	H	α-helix	trans	-60	-47	170.9	-82.1	-160	-8.2	0	0	112.3	H289 E290 S295 R296 I297	H289-Q293 PolarHBondContact O-N 2.67Å; E290-Q293 PolarHBondContact O-N 3.06Å; Q293-S295 VanDerWaalsContact C-N 3.3Å; Q293-S295 PolarHBondContact O-N 3.4Å; Q293-R296 WeakPolarHBondContact O-CB 3.44Å; Q293-R296 PolarHBondContact O-N 3.4Å; Q293-R296 VanDerWaalsContact O-N 3.09Å; Q293-I297 WeakPolarHBondContact O-CG1 3.48Å; Q293-I297 PolarHBondContact O-N 2.85Å
294	Q	81.8	Confident	79.2	Confident	131 Å²	131	98.8 Å²	98.8	61%	0.612	52%	0.523	S	S	*	.	H	α-helix	trans	-60.2	-40.9	177.5	-69.5	176.3	37.4	0	0	111.5	E290 E291 R296 R298	E290-Q294 WeakPolarHBondContact O-CG 3.44Å; E290-Q294 PolarHBondContact O-N 3.35Å; E291-Q294 PolarHBondContact O-N 2.97Å; Q294-R296 VanDerWaalsContact C-N 3.29Å; Q294-R296 PolarHBondContact O-N 3.43Å; Q294-R298 WeakPolarHBondContact O-CB 3.42Å; Q294-R298 PolarHBondContact O-N 3.26Å; Q294-R298 VanDerWaalsContact O-N 3.09Å
295	S	74.3	Confident	79.2	Confident	54 Å²	54	98.9 Å²	98.9	38%	0.378	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-37	175	83.7	0	0	0	0	112.3	E291 L292 Q293 R298 I299	E291-S295 WeakPolarHBondContact O-CB 3.3Å; E291-S295 PolarHBondContact O-N 3.46Å; L292-S295 PolarHBondContact O-N 2.77Å; L292-S295 PolarHBondContact O-OG 3.04Å; Q293-S295 VanDerWaalsContact C-N 3.3Å; Q293-S295 PolarHBondContact O-N 3.4Å; S295-R298 WeakPolarHBondContact O-CB 3.33Å; S295-R298 PolarHBondContact O-N 2.87Å; S295-I299 WeakPolarHBondContact O-CG1 3.41Å; S295-I299 PolarHBondContact O-N 2.85Å
296	R	80.8	Confident	79	Confident	170 Å²	170	99.1 Å²	99.1	64%	0.642	52%	0.518	S	S	*	.	H	α-helix	trans	-71.7	-46.5	-178.7	-163.8	170	-174.2	168.2	1.7	112.3	L292 Q293 Q294 R298 I299 D300	L292-R296 WeakPolarHBondContact O-CB 3.27Å; L292-R296 PolarHBondContact O-N 3.07Å; Q293-R296 WeakPolarHBondContact O-CB 3.44Å; Q293-R296 PolarHBondContact O-N 3.4Å; Q293-R296 VanDerWaalsContact O-N 3.09Å; Q294-R296 VanDerWaalsContact C-N 3.29Å; Q294-R296 PolarHBondContact O-N 3.43Å; R296-R298 PolarHBondContact O-N 2.88Å; R296-I299 WeakPolarHBondContact O-CB 3.47Å; R296-I299 PolarHBondContact O-N 2.91Å; R296-I299 VanDerWaalsContact O-N 3.1Å; R296-D300 PolarHBondContact O-N 3.07Å
297	I	80.5	Confident	78.9	Confident	113 Å²	113	100.4 Å²	100.4	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-57	-38.5	172.2	-64.9	165.6	0	0	0	110.6	Q293 D300 S301	Q293-I297 WeakPolarHBondContact O-CG1 3.48Å; Q293-I297 PolarHBondContact O-N 2.85Å; I297-D300 PolarHBondContact O-N 3.43Å; I297-S301 WeakPolarHBondContact O-CB 3.34Å; I297-S301 PolarHBondContact O-N 2.93Å
298	R	82.6	Confident	79	Confident	186 Å²	186	103.8 Å²	103.8	70%	0.702	53%	0.53	S	S	*	.	H	α-helix	trans	-65.8	-43.1	176.5	-166.3	174.9	-172.4	161.4	1.8	112.1	Q294 S295 R296 S301 L302	Q294-R298 WeakPolarHBondContact O-CB 3.42Å; Q294-R298 PolarHBondContact O-N 3.26Å; Q294-R298 VanDerWaalsContact O-N 3.09Å; S295-R298 WeakPolarHBondContact O-CB 3.33Å; S295-R298 PolarHBondContact O-N 2.87Å; R296-R298 PolarHBondContact O-N 2.88Å; R298-S301 PolarHBondContact O-N 3.05Å; R298-S301 PolarHBondContact O-OG 2.92Å; R298-L302 HydrophobicContact CG-CD1 4.43Å; R298-L302 WeakPolarHBondContact O-CG 3.4Å; R298-L302 PolarHBondContact O-N 3.39Å; R298-L302 VanDerWaalsContact O-N 3.14Å
299	I	80.3	Confident	78.9	Confident	98 Å²	98	106.1 Å²	106.1	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-59.4	-50.4	173.7	-71	162.7	0	0	0	110.6	S295 R296 S301 L302 S303	S295-I299 WeakPolarHBondContact O-CG1 3.41Å; S295-I299 PolarHBondContact O-N 2.85Å; R296-I299 WeakPolarHBondContact O-CB 3.47Å; R296-I299 PolarHBondContact O-N 2.91Å; R296-I299 VanDerWaalsContact O-N 3.1Å; I299-S301 VanDerWaalsContact C-N 3.27Å; I299-S301 PolarHBondContact O-N 3.11Å; I299-L302 PolarHBondContact O-N 3.47Å; I299-L302 VanDerWaalsContact O-N 3.08Å; I299-S303 PolarHBondContact O-N 2.93Å; I299-S303 PolarHBondContact O-OG 3.2Å; I299-S303 VanDerWaalsContact O-OG 3.1Å
300	D	79.9	Confident	78.9	Confident	97 Å²	97	106.4 Å²	106.4	52%	0.519	54%	0.536	S	S	.	.	H	α-helix	trans	-59.2	-39.1	-179.4	-64.6	-32.4	0	0	0	111.6	R296 I297 S303 A304	R296-D300 PolarHBondContact O-N 3.07Å; I297-D300 PolarHBondContact O-N 3.43Å; D300-S303 PolarHBondContact O-N 3.32Å; D300-A304 PolarHBondContact O-N 3.47Å; D300-A304 VanDerWaalsContact O-N 3.07Å
301	S	82.9	Confident	79	Confident	55 Å²	55	107.6 Å²	107.6	39%	0.385	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-37.8	176.3	79.9	0	0	0	0	113.4	I297 R298 I299 Q305	I297-S301 WeakPolarHBondContact O-CB 3.34Å; I297-S301 PolarHBondContact O-N 2.93Å; R298-S301 PolarHBondContact O-N 3.05Å; R298-S301 PolarHBondContact O-OG 2.92Å; I299-S301 VanDerWaalsContact C-N 3.27Å; I299-S301 PolarHBondContact O-N 3.11Å; S301-Q305 WeakPolarHBondContact O-CG 2.79Å; S301-Q305 PolarHBondContact O-N 3.22Å
302	L	77.1	Confident	78.9	Confident	88 Å²	88	106.5 Å²	106.5	46%	0.461	53%	0.534	S	S	.	.	H	α-helix	trans	-75.1	-35	177	-70.6	168.1	0	0	0	111.5	R298 I299 A304 Q305 L306	R298-L302 HydrophobicContact CG-CD1 4.43Å; R298-L302 WeakPolarHBondContact O-CG 3.4Å; R298-L302 PolarHBondContact O-N 3.39Å; R298-L302 VanDerWaalsContact O-N 3.14Å; I299-L302 PolarHBondContact O-N 3.47Å; I299-L302 VanDerWaalsContact O-N 3.08Å; L302-A304 VanDerWaalsContact C-N 3.32Å; L302-A304 PolarHBondContact O-N 3.01Å; L302-Q305 PolarHBondContact O-N 3.47Å; L302-L306 PolarHBondContact O-N 2.94Å
303	S	81.3	Confident	78.7	Confident	62 Å²	62	106.6 Å²	106.6	43%	0.434	54%	0.535	S	S	.	.	H	α-helix	trans	-62.3	-38.1	172.7	-60.8	0	0	0	0	112.1	I299 D300 L306 S307	I299-S303 PolarHBondContact O-N 2.93Å; I299-S303 PolarHBondContact O-OG 3.2Å; I299-S303 VanDerWaalsContact O-OG 3.1Å; D300-S303 PolarHBondContact O-N 3.32Å; S303-L306 PolarHBondContact O-N 3.34Å; S303-S307 PolarHBondContact O-N 3.23Å
304	A	80.4	Confident	78.7	Confident	62 Å²	62	103.6 Å²	103.6	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-63.8	-40.3	172.7	0	0	0	0	0	112.5	D300 L302 S307 Q308	D300-A304 PolarHBondContact O-N 3.47Å; D300-A304 VanDerWaalsContact O-N 3.07Å; L302-A304 VanDerWaalsContact C-N 3.32Å; L302-A304 PolarHBondContact O-N 3.01Å; A304-S307 PolarHBondContact O-N 3.2Å; A304-Q308 PolarHBondContact O-N 2.89Å; A304-Q308 VanDerWaalsContact O-N 3.09Å
305	Q	79.4	Confident	78.6	Confident	121 Å²	121	100.3 Å²	100.3	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-66.4	-39.6	176.1	-68	176.9	10.9	0	0	112.5	S301 L302 Q308 L309	S301-Q305 WeakPolarHBondContact O-CG 2.79Å; S301-Q305 PolarHBondContact O-N 3.22Å; L302-Q305 PolarHBondContact O-N 3.47Å; Q305-Q308 WeakPolarHBondContact O-CB 3.45Å; Q305-Q308 PolarHBondContact O-N 3.48Å; Q305-L309 WeakPolarHBondContact O-CG 3.36Å; Q305-L309 PolarHBondContact O-N 2.99Å; Q305-L309 VanDerWaalsContact O-N 3.08Å
306	L	74.9	Confident	78.6	Confident	106 Å²	106	105.1 Å²	105.1	56%	0.555	54%	0.54	S	S	*	.	H	α-helix	trans	-61.4	-44.8	173.4	-81.7	166.1	0	0	0	112.1	L302 S303 Q308 L309 Q310	L302-L306 PolarHBondContact O-N 2.94Å; S303-L306 PolarHBondContact O-N 3.34Å; L306-Q308 VanDerWaalsContact C-N 3.32Å; L306-Q308 PolarHBondContact O-N 3.49Å; L306-L309 PolarHBondContact O-N 3.46Å; L306-Q310 WeakPolarHBondContact O-CG 3.4Å; L306-Q310 PolarHBondContact O-N 3.34Å
307	S	78.3	Confident	78.5	Confident	57 Å²	57	100.6 Å²	100.6	40%	0.399	53%	0.526	S	S	.	.	H	α-helix	trans	-59.5	-40.8	176.2	-178.8	0	0	0	0	112.5	S303 A304 K311	S303-S307 PolarHBondContact O-N 3.23Å; A304-S307 PolarHBondContact O-N 3.2Å; S307-K311 PolarHBondContact O-N 2.94Å
308	Q	80.1	Confident	78.3	Confident	117 Å²	117	97.3 Å²	97.3	55%	0.547	52%	0.516	S	S	.	.	H	α-helix	trans	-62.6	-43.9	175.5	-170.8	74.4	-15.1	0	0	112	A304 Q305 L306 Q312	A304-Q308 PolarHBondContact O-N 2.89Å; A304-Q308 VanDerWaalsContact O-N 3.09Å; Q305-Q308 WeakPolarHBondContact O-CB 3.45Å; Q305-Q308 PolarHBondContact O-N 3.48Å; L306-Q308 VanDerWaalsContact C-N 3.32Å; L306-Q308 PolarHBondContact O-N 3.49Å; Q308-Q312 PolarHBondContact O-N 3.46Å
309	L	73.5	Confident	77.9	Confident	103 Å²	103	95.7 Å²	95.7	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-70.1	-38.6	178.8	-72.2	169.3	0	0	0	112.7	Q305 L306 K311 Q312 L313	Q305-L309 WeakPolarHBondContact O-CG 3.36Å; Q305-L309 PolarHBondContact O-N 2.99Å; Q305-L309 VanDerWaalsContact O-N 3.08Å; L306-L309 PolarHBondContact O-N 3.46Å; L309-K311 VanDerWaalsContact C-N 3.31Å; L309-K311 PolarHBondContact O-N 2.95Å; L309-Q312 PolarHBondContact O-N 3Å; L309-Q312 VanDerWaalsContact O-N 3.09Å; L309-L313 PolarHBondContact O-N 3.44Å
310	Q	79	Confident	77.6	Confident	131 Å²	131	95.8 Å²	95.8	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-59.1	-40.7	175.9	-77.2	175.6	-31.1	0	0	112.2	L306 Q312 L313 A314	L306-Q310 WeakPolarHBondContact O-CG 3.4Å; L306-Q310 PolarHBondContact O-N 3.34Å; Q310-Q312 VanDerWaalsContact C-N 3.34Å; Q310-Q312 PolarHBondContact O-N 3.1Å; Q310-L313 PolarHBondContact O-N 2.89Å; Q310-A314 PolarHBondContact O-N 2.88Å; Q310-A314 VanDerWaalsContact O-N 3.15Å
311	K	78.6	Confident	77.6	Confident	149 Å²	149	97.7 Å²	97.7	65%	0.648	52%	0.515	S	S	*	.	H	α-helix	trans	-63.3	-37.6	173.7	-75.7	-178.6	177.1	176.4	0	112.9	S307 L309 A315	S307-K311 PolarHBondContact O-N 2.94Å; L309-K311 VanDerWaalsContact C-N 3.31Å; L309-K311 PolarHBondContact O-N 2.95Å; K311-A315 PolarHBondContact O-N 3.46Å
312	Q	75.1	Confident	77.2	Confident	113 Å²	113	100.7 Å²	100.7	53%	0.528	53%	0.526	S	S	.	.	H	α-helix	trans	-69.8	-36.2	176.9	-68.5	-176.6	-4.3	0	0	112.2	Q308 L309 Q310 K316	Q308-Q312 PolarHBondContact O-N 3.46Å; L309-Q312 PolarHBondContact O-N 3Å; L309-Q312 VanDerWaalsContact O-N 3.09Å; Q310-Q312 VanDerWaalsContact C-N 3.34Å; Q310-Q312 PolarHBondContact O-N 3.1Å; Q312-K316 WeakPolarHBondContact O-CG 3.48Å; Q312-K316 PolarHBondContact O-N 2.95Å
313	L	72.6	Confident	77	Confident	106 Å²	106	101.9 Å²	101.9	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-62.2	-53.1	176.2	-165.3	77.9	0	0	0	111.2	L309 Q310 A315 K316 E317	L309-L313 PolarHBondContact O-N 3.44Å; Q310-L313 PolarHBondContact O-N 2.89Å; L313-A315 VanDerWaalsContact C-N 3.28Å; L313-A315 PolarHBondContact O-N 3.21Å; L313-K316 WeakPolarHBondContact O-CA 3.35Å; L313-K316 WeakPolarHBondContact O-CB 3.34Å; L313-K316 PolarHBondContact O-N 2.97Å; L313-E317 PolarHBondContact O-N 3.4Å
314	A	79.6	Confident	76.7	Confident	57 Å²	57	104.6 Å²	104.6	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-57.3	-39	179.6	0	0	0	0	0	112.9	Q310 K316 E317 A318	Q310-A314 PolarHBondContact O-N 2.88Å; Q310-A314 VanDerWaalsContact O-N 3.15Å; A314-K316 VanDerWaalsContact C-N 3.28Å; A314-K316 PolarHBondContact O-N 2.95Å; A314-E317 PolarHBondContact O-N 3.46Å; A314-A318 PolarHBondContact O-N 3.46Å; A314-A318 VanDerWaalsContact O-N 3.13Å
315	A	80.4	Confident	76.6	Confident	62 Å²	62	105.8 Å²	105.8	51%	0.512	54%	0.537	S	S	.	.	H	α-helix	trans	-69.4	-22	176.6	0	0	0	0	0	113.9	K311 L313	K311-A315 PolarHBondContact O-N 3.46Å; L313-A315 VanDerWaalsContact C-N 3.28Å; L313-A315 PolarHBondContact O-N 3.21Å
316	K	73.4	Confident	76.3	Confident	155 Å²	155	102.9 Å²	102.9	67%	0.674	53%	0.53	S	S	*	.	H	α-helix	trans	-85.6	-40.9	173.5	-71.3	-75.5	-175.9	167.8	0	111.7	Q312 L313 A314 A318 K319 L320	Q312-K316 WeakPolarHBondContact O-CG 3.48Å; Q312-K316 PolarHBondContact O-N 2.95Å; L313-K316 WeakPolarHBondContact O-CA 3.35Å; L313-K316 WeakPolarHBondContact O-CB 3.34Å; L313-K316 PolarHBondContact O-N 2.97Å; A314-K316 VanDerWaalsContact C-N 3.28Å; A314-K316 PolarHBondContact O-N 2.95Å; K316-A318 VanDerWaalsContact C-N 3.33Å; K316-A318 PolarHBondContact O-N 3.02Å; K316-K319 PolarHBondContact O-N 3.04Å; K316-L320 PolarHBondContact O-N 3.49Å
317	E	78.6	Confident	76.3	Confident	74 Å²	74	101.3 Å²	101.3	35%	0.346	52%	0.521	S	S	.	.	H	α-helix	trans	-60.2	-40.1	175.5	-70.2	-179.7	-160.3	0	0	112.9	L313 A314 K319 L320 R321	L313-E317 PolarHBondContact O-N 3.4Å; A314-E317 PolarHBondContact O-N 3.46Å; E317-K319 VanDerWaalsContact C-N 3.31Å; E317-K319 PolarHBondContact O-N 3.4Å; E317-L320 PolarHBondContact O-N 2.89Å; E317-L320 VanDerWaalsContact O-N 3.13Å; E317-R321 PolarHBondContact O-N 3.1Å; E317-R321 VanDerWaalsContact O-N 3.16Å; E317-R321 IonicContact OE2-CZ 3.24Å; E317-R321 IonicContact OE2-NH1 2.85Å; E317-R321 IonicContact OE2-NH2 2.75Å; E317-R321 PolarHBondContact OE2-NH2 3.26Å
318	A	76.4	Confident	76.3	Confident	45 Å²	45	100.8 Å²	100.8	37%	0.372	52%	0.521	S	S	.	.	H	α-helix	trans	-54.9	-47.9	175.8	0	0	0	0	0	111.6	A314 K316 L320 R321 D322	A314-A318 PolarHBondContact O-N 3.46Å; A314-A318 VanDerWaalsContact O-N 3.13Å; K316-A318 VanDerWaalsContact C-N 3.33Å; K316-A318 PolarHBondContact O-N 3.02Å; A318-L320 VanDerWaalsContact C-N 3.29Å; A318-L320 PolarHBondContact O-N 2.92Å; A318-R321 PolarHBondContact O-N 3.09Å; A318-D322 PolarHBondContact O-N 3.37Å
319	K	74.5	Confident	75.9	Confident	151 Å²	151	102.4 Å²	102.4	66%	0.657	52%	0.522	S	S	*	.	H	α-helix	trans	-69.6	-20.4	178.3	-70.4	-166.2	172.3	-166.5	0	114.6	K316 E317 L323	K316-K319 PolarHBondContact O-N 3.04Å; E317-K319 VanDerWaalsContact C-N 3.31Å; E317-K319 PolarHBondContact O-N 3.4Å; K319-L323 WeakPolarHBondContact O-CD1 3.48Å; K319-L323 WeakPolarHBondContact O-CG 3.5Å
320	L	72.7	Confident	75.8	Confident	100 Å²	100	103.8 Å²	103.8	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-73.9	-45.1	172.3	-78.1	168.2	0	0	0	110.6	K316 E317 A318 D322 L323 E324	K316-L320 PolarHBondContact O-N 3.49Å; E317-L320 PolarHBondContact O-N 2.89Å; E317-L320 VanDerWaalsContact O-N 3.13Å; A318-L320 VanDerWaalsContact C-N 3.29Å; A318-L320 PolarHBondContact O-N 2.92Å; L320-D322 VanDerWaalsContact C-N 3.34Å; L320-D322 PolarHBondContact O-N 3.34Å; L320-L323 PolarHBondContact O-N 2.96Å; L320-E324 WeakPolarHBondContact O-CG 3.3Å; L320-E324 PolarHBondContact O-N 2.67Å
321	R	80.4	Confident	75.8	Confident	138 Å²	138	104.7 Å²	104.7	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-56.8	-46.5	178.6	-64.8	179.6	-170.4	97.4	7.9	111.7	E317 A318 L323 E324 D325	E317-R321 PolarHBondContact O-N 3.1Å; E317-R321 VanDerWaalsContact O-N 3.16Å; E317-R321 IonicContact OE2-CZ 3.24Å; E317-R321 IonicContact OE2-NH1 2.85Å; E317-R321 IonicContact OE2-NH2 2.75Å; E317-R321 PolarHBondContact OE2-NH2 3.26Å; A318-R321 PolarHBondContact O-N 3.09Å; R321-L323 PolarHBondContact O-N 3.44Å; R321-E324 PolarHBondContact O-N 3.48Å; R321-D325 WeakPolarHBondContact O-CB 3.31Å; R321-D325 PolarHBondContact O-N 3.13Å
322	D	75.8	Confident	75.7	Confident	117 Å²	117	101.1 Å²	101.1	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-57.8	-33.5	177.9	-62.2	-29	0	0	0	113.4	A318 L320 S326	A318-D322 PolarHBondContact O-N 3.37Å; L320-D322 VanDerWaalsContact C-N 3.34Å; L320-D322 PolarHBondContact O-N 3.34Å; D322-S326 PolarHBondContact O-N 3.19Å
323	L	71	Confident	75.4	Confident	113 Å²	113	99.7 Å²	99.7	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-83.8	-35.7	178.9	-69.2	172.2	0	0	0	112.7	K319 L320 R321 D325 S326 L327	K319-L323 WeakPolarHBondContact O-CD1 3.48Å; K319-L323 WeakPolarHBondContact O-CG 3.5Å; L320-L323 PolarHBondContact O-N 2.96Å; R321-L323 PolarHBondContact O-N 3.44Å; L323-D325 VanDerWaalsContact C-N 3.3Å; L323-S326 PolarHBondContact O-N 3.01Å; L323-S326 PolarHBondContact O-OG 3.44Å; L323-L327 WeakPolarHBondContact O-CB 3.42Å; L323-L327 PolarHBondContact O-N 3.47Å; L323-L327 VanDerWaalsContact O-N 3.16Å
324	E	76.6	Confident	75.5	Confident	120 Å²	120	98 Å²	98	56%	0.561	51%	0.508	S	S	*	.	H	α-helix	trans	-64.2	-39.6	174	-71.3	173	149.5	0	0	110.9	L320 R321 L327 A328	L320-E324 WeakPolarHBondContact O-CG 3.3Å; L320-E324 PolarHBondContact O-N 2.67Å; R321-E324 PolarHBondContact O-N 3.48Å; E324-L327 PolarHBondContact O-N 2.88Å; E324-A328 WeakPolarHBondContact O-CB 3.35Å; E324-A328 PolarHBondContact O-N 3.02Å
325	D	77.3	Confident	75.5	Confident	87 Å²	87	103.8 Å²	103.8	47%	0.465	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-34.2	-179.4	-146.6	55.6	0	0	0	112	R321 L323 R329	R321-D325 WeakPolarHBondContact O-CB 3.31Å; R321-D325 PolarHBondContact O-N 3.13Å; L323-D325 VanDerWaalsContact C-N 3.3Å; D325-R329 VanDerWaalsContact CG-NH1 3.31Å; D325-R329 WeakPolarHBondContact O-CG 3.39Å; D325-R329 PolarHBondContact O-NH1 2.95Å; D325-R329 IonicContact OD2-CZ 2.63Å; D325-R329 IonicContact OD2-NH1 3.92Å; D325-R329 PolarHBondContact OD2-NH1 3.33Å; D325-R329 IonicContact OD2-NH2 2.66Å; D325-R329 PolarHBondContact OD2-NH2 2.98Å
326	S	72.8	Confident	75.3	Confident	60 Å²	60	108.9 Å²	108.9	42%	0.42	52%	0.523	S	S	.	.	H	α-helix	trans	-71	-45.4	173	66.9	0	0	0	0	111.6	D322 L323 A328 R329	D322-S326 PolarHBondContact O-N 3.19Å; L323-S326 PolarHBondContact O-N 3.01Å; L323-S326 PolarHBondContact O-OG 3.44Å; S326-A328 VanDerWaalsContact C-N 3.29Å; S326-A328 PolarHBondContact O-N 3Å; S326-R329 WeakPolarHBondContact O-CB 3.38Å; S326-R329 PolarHBondContact O-N 3.47Å; S326-R329 VanDerWaalsContact O-N 3.13Å
327	L	75.1	Confident	75.4	Confident	72 Å²	72	107.3 Å²	107.3	38%	0.377	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-27.4	179.9	-169.8	63.9	0	0	0	113.2	L323 E324 R331	L323-L327 WeakPolarHBondContact O-CB 3.42Å; L323-L327 PolarHBondContact O-N 3.47Å; L323-L327 VanDerWaalsContact O-N 3.16Å; E324-L327 PolarHBondContact O-N 2.88Å; L327-R331 WeakPolarHBondContact O-CD 3.36Å; L327-R331 VanDerWaalsContact O-CG 3.3Å; L327-R331 WeakPolarHBondContact O-CG 3.35Å; L327-R331 PolarHBondContact O-N 3.3Å
328	A	78.4	Confident	75.2	Confident	47 Å²	47	108.9 Å²	108.9	39%	0.388	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-42.4	171.8	0	0	0	0	0	112.2	E324 S326 E330 R331 D332	E324-A328 WeakPolarHBondContact O-CB 3.35Å; E324-A328 PolarHBondContact O-N 3.02Å; S326-A328 VanDerWaalsContact C-N 3.29Å; S326-A328 PolarHBondContact O-N 3Å; A328-E330 PolarHBondContact O-N 3.22Å; A328-R331 PolarHBondContact O-N 2.84Å; A328-D332 PolarHBondContact O-N 3.37Å; A328-D332 VanDerWaalsContact O-N 3.15Å
329	R	72.4	Confident	75.2	Confident	150 Å²	150	109.4 Å²	109.4	57%	0.566	54%	0.536	S	S	*	.	H	α-helix	trans	-64.2	-37.8	-177.8	-67	171.8	178.2	97.6	2	112.1	D325 S326 T333	D325-R329 VanDerWaalsContact CG-NH1 3.31Å; D325-R329 WeakPolarHBondContact O-CG 3.39Å; D325-R329 PolarHBondContact O-NH1 2.95Å; D325-R329 IonicContact OD2-CZ 2.63Å; D325-R329 IonicContact OD2-NH1 3.92Å; D325-R329 PolarHBondContact OD2-NH1 3.33Å; D325-R329 IonicContact OD2-NH2 2.66Å; D325-R329 PolarHBondContact OD2-NH2 2.98Å; S326-R329 WeakPolarHBondContact O-CB 3.38Å; S326-R329 PolarHBondContact O-N 3.47Å; S326-R329 VanDerWaalsContact O-N 3.13Å; R329-T333 PolarHBondContact O-N 3.34Å; R329-T333 PolarHBondContact O-OG1 3.38Å
330	E	71.3	Confident	75.1	Confident	132 Å²	132	108.2 Å²	108.2	62%	0.617	53%	0.533	S	S	*	.	H	α-helix	trans	-72.9	-30.1	175.7	-62.9	-172.4	147.2	0	0	113.7	A328 T333 S334	A328-E330 PolarHBondContact O-N 3.22Å; E330-T333 PolarHBondContact O-OG1 2.86Å; E330-S334 WeakPolarHBondContact O-CB 3.46Å; E330-S334 PolarHBondContact O-N 3.39Å; E330-S334 PolarHBondContact O-OG 3.45Å
331	R	78.7	Confident	75	Confident	150 Å²	150	108.3 Å²	108.3	57%	0.566	53%	0.529	S	S	*	.	H	α-helix	trans	-71.9	-37.4	177.1	-76.3	169.5	172.8	158.7	-2.2	112.2	L327 A328 S334 R335	L327-R331 WeakPolarHBondContact O-CD 3.36Å; L327-R331 VanDerWaalsContact O-CG 3.3Å; L327-R331 WeakPolarHBondContact O-CG 3.35Å; L327-R331 PolarHBondContact O-N 3.3Å; A328-R331 PolarHBondContact O-N 2.84Å; R331-S334 PolarHBondContact O-N 2.92Å; R331-R335 WeakPolarHBondContact O-CB 3.29Å; R331-R335 PolarHBondContact O-N 3.07Å
332	D	77.3	Confident	74.8	Confident	74 Å²	74	108.2 Å²	108.2	40%	0.396	53%	0.534	S	S	.	.	H	α-helix	trans	-75.4	-30.3	-179.4	-89.6	2.1	0	0	0	113.8	A328 R336	A328-D332 PolarHBondContact O-N 3.37Å; A328-D332 VanDerWaalsContact O-N 3.15Å; D332-R336 WeakPolarHBondContact O-CD 3.44Å; D332-R336 WeakPolarHBondContact O-CG 3.47Å; D332-R336 PolarHBondContact O-N 2.95Å; D332-R336 PolarHBondContact O-NE 3.03Å
333	T	68.6	Low	75	Confident	84 Å²	84	110.7 Å²	110.7	52%	0.515	54%	0.535	S	S	.	.	H	α-helix	trans	-67	-46.1	168.5	51.6	0	0	0	0	110.7	R329 E330 R335 R336	R329-T333 PolarHBondContact O-N 3.34Å; R329-T333 PolarHBondContact O-OG1 3.38Å; E330-T333 PolarHBondContact O-OG1 2.86Å; T333-R335 PolarHBondContact O-N 2.9Å; T333-R336 PolarHBondContact O-N 2.8Å
334	S	74.9	Confident	75	Confident	71 Å²	71	110.2 Å²	110.2	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-60.7	-40.7	178.2	-57.4	0	0	0	0	113	E330 R331 R336 L337 L338	E330-S334 WeakPolarHBondContact O-CB 3.46Å; E330-S334 PolarHBondContact O-N 3.39Å; E330-S334 PolarHBondContact O-OG 3.45Å; R331-S334 PolarHBondContact O-N 2.92Å; S334-R336 PolarHBondContact O-N 3.26Å; S334-L337 PolarHBondContact O-N 2.93Å; S334-L338 PolarHBondContact O-N 3Å
335	R	78.9	Confident	74.7	Confident	178 Å²	178	109.5 Å²	109.5	67%	0.672	53%	0.528	S	S	*	.	H	α-helix	trans	-62.1	-40.7	178.3	-92.8	179.5	163.1	169.2	-5.7	113.7	R331 T333 L337 L338 A339	R331-R335 WeakPolarHBondContact O-CB 3.29Å; R331-R335 PolarHBondContact O-N 3.07Å; T333-R335 PolarHBondContact O-N 2.9Å; R335-L337 VanDerWaalsContact C-N 3.35Å; R335-L338 PolarHBondContact O-N 3.16Å; R335-A339 PolarHBondContact O-N 2.98Å
336	R	75.3	Confident	74.6	Confident	168 Å²	168	108 Å²	108	63%	0.634	53%	0.527	S	S	*	.	H	α-helix	trans	-63.8	-43.2	-178.6	-68.1	167.6	-157.5	166.8	8.5	111	D332 T333 S334 L338 A339 E340	D332-R336 WeakPolarHBondContact O-CD 3.44Å; D332-R336 WeakPolarHBondContact O-CG 3.47Å; D332-R336 PolarHBondContact O-N 2.95Å; D332-R336 PolarHBondContact O-NE 3.03Å; T333-R336 PolarHBondContact O-N 2.8Å; S334-R336 PolarHBondContact O-N 3.26Å; R336-L338 VanDerWaalsContact C-N 3.34Å; R336-L338 PolarHBondContact O-N 3.34Å; R336-A339 PolarHBondContact O-N 3Å; R336-E340 PolarHBondContact O-N 2.87Å
337	L	75.5	Confident	74.8	Confident	122 Å²	122	108.8 Å²	108.8	64%	0.639	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-37.9	178.4	-151.9	78.3	0	0	0	112.4	S334 R335 K341	S334-L337 PolarHBondContact O-N 2.93Å; R335-L337 VanDerWaalsContact C-N 3.35Å; L337-K341 PolarHBondContact O-N 3.42Å
338	L	75.2	Confident	74.5	Confident	108 Å²	108	111.5 Å²	111.5	57%	0.565	54%	0.537	S	S	*	.	H	α-helix	trans	-67.6	-48.1	175.2	-84.6	165.3	0	0	0	112.5	S334 R335 R336 E340 K341 E342	S334-L338 PolarHBondContact O-N 3Å; R335-L338 PolarHBondContact O-N 3.16Å; R336-L338 VanDerWaalsContact C-N 3.34Å; R336-L338 PolarHBondContact O-N 3.34Å; L338-E340 PolarHBondContact O-N 2.92Å; L338-K341 PolarHBondContact O-N 3.37Å; L338-K341 VanDerWaalsContact O-N 3.09Å; L338-E342 WeakPolarHBondContact O-CG 3.25Å; L338-E342 PolarHBondContact O-N 2.99Å
339	A	77.4	Confident	74.4	Confident	56 Å²	56	117.4 Å²	117.4	46%	0.463	55%	0.549	S	S	.	.	H	α-helix	trans	-59.4	-33.8	-178.9	0	0	0	0	0	112.7	R335 R336 R343	R335-A339 PolarHBondContact O-N 2.98Å; R336-A339 PolarHBondContact O-N 3Å; A339-R343 PolarHBondContact O-N 3.22Å; A339-R343 VanDerWaalsContact O-N 3.09Å
340	E	71.2	Confident	74.5	Confident	125 Å²	125	113.2 Å²	113.2	58%	0.584	55%	0.547	S	S	*	.	H	α-helix	trans	-67	-41.6	176.1	-163.9	165.1	-121.5	0	0	112.1	R336 L338 E344	R336-E340 PolarHBondContact O-N 2.87Å; L338-E340 PolarHBondContact O-N 2.92Å; E340-E344 PolarHBondContact O-N 2.98Å
341	K	72.1	Confident	74.6	Confident	102 Å²	102	113.9 Å²	113.9	44%	0.443	54%	0.543	S	S	.	.	H	α-helix	trans	-72.1	-36.4	173.7	-63.6	-61.8	96	-172.9	0	113.1	L337 L338 R343 E344 M345	L337-K341 PolarHBondContact O-N 3.42Å; L338-K341 PolarHBondContact O-N 3.37Å; L338-K341 VanDerWaalsContact O-N 3.09Å; K341-R343 VanDerWaalsContact C-N 3.29Å; K341-R343 PolarHBondContact O-N 3.46Å; K341-E344 VanDerWaalsContact CE-OE2 3.3Å; K341-E344 WeakPolarHBondContact CE-OE2 3.43Å; K341-E344 IonicContact NZ-OE1 3.16Å; K341-E344 PolarHBondContact NZ-OE1 3.3Å; K341-E344 IonicContact NZ-OE2 3.1Å; K341-E344 PolarHBondContact NZ-OE2 3.23Å; K341-E344 PolarHBondContact O-N 3.39Å; K341-M345 WeakPolarHBondContact O-CG 3.49Å; K341-M345 PolarHBondContact O-N 3.09Å
342	E	76.1	Confident	74.1	Confident	136 Å²	136	112.8 Å²	112.8	64%	0.636	55%	0.546	S	S	*	.	H	α-helix	trans	-63.8	-35.6	175.9	-74.3	-175.9	152.2	0	0	111.8	L338 M345 A346	L338-E342 WeakPolarHBondContact O-CG 3.25Å; L338-E342 PolarHBondContact O-N 2.99Å; E342-M345 PolarHBondContact O-N 3.28Å; E342-A346 PolarHBondContact O-N 3.29Å
343	R	79.8	Confident	73.8	Confident	170 Å²	170	114.1 Å²	114.1	64%	0.642	55%	0.55	S	S	*	.	H	α-helix	trans	-61.7	-48.1	174.8	-174	-172.3	165.4	120.3	12.1	112.3	A339 K341 M345 A346 E347	A339-R343 PolarHBondContact O-N 3.22Å; A339-R343 VanDerWaalsContact O-N 3.09Å; K341-R343 VanDerWaalsContact C-N 3.29Å; K341-R343 PolarHBondContact O-N 3.46Å; R343-M345 VanDerWaalsContact C-N 3.27Å; R343-M345 PolarHBondContact O-N 3.47Å; R343-A346 PolarHBondContact O-N 2.86Å; R343-A346 VanDerWaalsContact O-N 3.13Å; R343-E347 IonicContact CZ-OE1 2.63Å; R343-E347 VanDerWaalsContact CZ-OE1 3.24Å; R343-E347 IonicContact NE-OE1 3.57Å; R343-E347 PolarHBondContact NE-OE1 2.66Å; R343-E347 IonicContact NH2-OE1 3.78Å; R343-E347 PolarHBondContact NH2-OE1 2.64Å; R343-E347 PolarHBondContact O-N 2.96Å
344	E	70	Confident	74.2	Confident	102 Å²	102	115.7 Å²	115.7	48%	0.477	55%	0.551	S	S	.	*	H	α-helix	trans	-56.7	-42.9	176.7	-67.9	172.2	174.1	0	0	111.5	E340 K341 A346 E347 M348	E340-E344 PolarHBondContact O-N 2.98Å; K341-E344 VanDerWaalsContact CE-OE2 3.3Å; K341-E344 WeakPolarHBondContact CE-OE2 3.43Å; K341-E344 IonicContact NZ-OE1 3.16Å; K341-E344 PolarHBondContact NZ-OE1 3.3Å; K341-E344 IonicContact NZ-OE2 3.1Å; K341-E344 PolarHBondContact NZ-OE2 3.23Å; K341-E344 PolarHBondContact O-N 3.39Å; E344-A346 VanDerWaalsContact C-N 3.35Å; E344-A346 PolarHBondContact O-N 2.94Å; E344-E347 PolarHBondContact O-N 3.45Å; E344-M348 PolarHBondContact O-N 2.75Å
345	M	70.9	Confident	74	Confident	105 Å²	105	118 Å²	118	52%	0.517	56%	0.555	S	S	.	*	H	α-helix	trans	-67.6	-31.6	178	-69	-68.4	-73.5	0	0	113.1	K341 E342 R343 R349	K341-M345 WeakPolarHBondContact O-CG 3.49Å; K341-M345 PolarHBondContact O-N 3.09Å; E342-M345 PolarHBondContact O-N 3.28Å; R343-M345 VanDerWaalsContact C-N 3.27Å; R343-M345 PolarHBondContact O-N 3.47Å; M345-R349 WeakPolarHBondContact O-CG 3.44Å; M345-R349 PolarHBondContact O-N 3.3Å
346	A	75.8	Confident	73.6	Confident	56 Å²	56	113.9 Å²	113.9	46%	0.463	55%	0.545	S	S	.	.	H	α-helix	trans	-71.1	-44.4	175.2	0	0	0	0	0	112.1	E342 R343 E344 M348 R349 A350	E342-A346 PolarHBondContact O-N 3.29Å; R343-A346 PolarHBondContact O-N 2.86Å; R343-A346 VanDerWaalsContact O-N 3.13Å; E344-A346 VanDerWaalsContact C-N 3.35Å; E344-A346 PolarHBondContact O-N 2.94Å; A346-M348 VanDerWaalsContact C-N 3.28Å; A346-M348 PolarHBondContact O-N 2.83Å; A346-R349 PolarHBondContact O-N 3.19Å; A346-R349 VanDerWaalsContact O-N 3.17Å; A346-A350 PolarHBondContact O-N 2.82Å
347	E	76.1	Confident	73.5	Confident	77 Å²	77	109.9 Å²	109.9	36%	0.36	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-30.9	178	-69.1	-174.6	-161	0	0	112.6	R343 E344 R351	R343-E347 IonicContact CZ-OE1 2.63Å; R343-E347 VanDerWaalsContact CZ-OE1 3.24Å; R343-E347 IonicContact NE-OE1 3.57Å; R343-E347 PolarHBondContact NE-OE1 2.66Å; R343-E347 IonicContact NH2-OE1 3.78Å; R343-E347 PolarHBondContact NH2-OE1 2.64Å; R343-E347 PolarHBondContact O-N 2.96Å; E344-E347 PolarHBondContact O-N 3.45Å; E347-R351 WeakPolarHBondContact O-CG 3.42Å; E347-R351 PolarHBondContact O-NH1 3.41Å
348	M	69.6	Low	73.4	Confident	129 Å²	129	109.4 Å²	109.4	64%	0.635	53%	0.531	S	S	*	.	H	α-helix	trans	-69.5	-42.7	171.1	-75.4	-68.1	-74.5	0	0	112.7	E344 A346 M352	E344-M348 PolarHBondContact O-N 2.75Å; A346-M348 VanDerWaalsContact C-N 3.28Å; A346-M348 PolarHBondContact O-N 2.83Å; M348-M352 PolarHBondContact O-N 3.2Å
349	R	75.1	Confident	72.9	Confident	171 Å²	171	112.4 Å²	112.4	65%	0.645	54%	0.536	S	S	*	.	H	α-helix	trans	-67.9	-39.2	-179.9	-76.1	172	175.9	152	-0.9	113	M345 A346 R351 M352 Q353	M345-R349 WeakPolarHBondContact O-CG 3.44Å; M345-R349 PolarHBondContact O-N 3.3Å; A346-R349 PolarHBondContact O-N 3.19Å; A346-R349 VanDerWaalsContact O-N 3.17Å; R349-R351 VanDerWaalsContact C-N 3.34Å; R349-R351 PolarHBondContact O-N 3.43Å; R349-M352 PolarHBondContact O-N 2.93Å; R349-M352 VanDerWaalsContact O-N 3.17Å; R349-Q353 PolarHBondContact O-N 3.08Å
350	A	74.7	Confident	72.3	Confident	62 Å²	62	114.7 Å²	114.7	51%	0.512	54%	0.537	S	S	.	.	H	α-helix	trans	-58.9	-44.3	179	0	0	0	0	0	112.2	A346 M352 Q353 Q354	A346-A350 PolarHBondContact O-N 2.82Å; A350-M352 VanDerWaalsContact C-N 3.3Å; A350-M352 PolarHBondContact O-N 3.3Å; A350-Q353 PolarHBondContact O-N 2.92Å; A350-Q354 PolarHBondContact O-N 2.94Å; A350-Q354 VanDerWaalsContact O-N 3.17Å
351	R	74	Confident	72	Confident	146 Å²	146	115.5 Å²	115.5	55%	0.551	54%	0.541	S	S	*	.	H	α-helix	trans	-61.7	-36.3	176.6	-66.5	178.8	-174.7	107.2	2.6	112.7	E347 R349	E347-R351 WeakPolarHBondContact O-CG 3.42Å; E347-R351 PolarHBondContact O-NH1 3.41Å; R349-R351 VanDerWaalsContact C-N 3.34Å; R349-R351 PolarHBondContact O-N 3.43Å
352	M	67.4	Low	72	Confident	126 Å²	126	116.4 Å²	116.4	62%	0.621	55%	0.55	S	S	*	.	H	α-helix	trans	-72.9	-39.9	178.6	-177.3	178.9	173.2	0	0	112.6	M348 R349 A350 L356	M348-M352 PolarHBondContact O-N 3.2Å; R349-M352 PolarHBondContact O-N 2.93Å; R349-M352 VanDerWaalsContact O-N 3.17Å; A350-M352 VanDerWaalsContact C-N 3.3Å; A350-M352 PolarHBondContact O-N 3.3Å; M352-L356 PolarHBondContact O-N 3.36Å
353	Q	71.3	Confident	71.6	Confident	102 Å²	102	114.1 Å²	114.1	48%	0.477	54%	0.541	S	S	.	.	H	α-helix	trans	-66.4	-43.9	179.3	-173.3	61.4	46.5	0	0	111.6	R349 A350 Q355 L356 D357	R349-Q353 PolarHBondContact O-N 3.08Å; A350-Q353 PolarHBondContact O-N 2.92Å; Q353-Q355 VanDerWaalsContact C-N 3.26Å; Q353-Q355 PolarHBondContact O-N 3.27Å; Q353-L356 WeakPolarHBondContact O-CA 3.3Å; Q353-L356 WeakPolarHBondContact O-CB 3.47Å; Q353-L356 PolarHBondContact O-N 3.42Å; Q353-D357 PolarHBondContact NE2-OD1 3.04Å; Q353-D357 PolarHBondContact O-N 2.93Å
354	Q	76.6	Confident	71	Confident	117 Å²	117	110.3 Å²	110.3	55%	0.547	53%	0.534	S	S	.	.	H	α-helix	trans	-56	-40.4	-179.7	-174.4	178.1	-13.2	0	0	112.5	A350 L356 D357 E358	A350-Q354 PolarHBondContact O-N 2.94Å; A350-Q354 VanDerWaalsContact O-N 3.17Å; Q354-L356 VanDerWaalsContact C-N 3.34Å; Q354-L356 PolarHBondContact O-N 3.29Å; Q354-D357 PolarHBondContact O-N 3.33Å; Q354-E358 PolarHBondContact NE2-OE1 2.95Å; Q354-E358 WeakPolarHBondContact O-CG 3.36Å; Q354-E358 PolarHBondContact O-N 2.81Å; Q354-E358 VanDerWaalsContact O-N 3.14Å
355	Q	70.3	Confident	70.9	Confident	121 Å²	121	110.5 Å²	110.5	57%	0.565	54%	0.537	S	S	*	.	H	α-helix	trans	-67.4	-31.5	176	-64.8	-168.7	-64.7	0	0	113.3	Q353 Y359	Q353-Q355 VanDerWaalsContact C-N 3.26Å; Q353-Q355 PolarHBondContact O-N 3.27Å; Q355-Y359 WeakPolarHBondContact O-CD2 3.42Å; Q355-Y359 PolarHBondContact O-N 3.14Å
356	L	70.4	Confident	70.9	Confident	91 Å²	91	110.4 Å²	110.4	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-71.6	-39.5	176.4	-71	169.5	0	0	0	111.5	M352 Q353 Q354 Y359 Q360	M352-L356 PolarHBondContact O-N 3.36Å; Q353-L356 WeakPolarHBondContact O-CA 3.3Å; Q353-L356 WeakPolarHBondContact O-CB 3.47Å; Q353-L356 PolarHBondContact O-N 3.42Å; Q354-L356 VanDerWaalsContact C-N 3.34Å; Q354-L356 PolarHBondContact O-N 3.29Å; L356-Y359 PolarHBondContact O-N 3.06Å; L356-Q360 PolarHBondContact O-N 3.1Å
357	D	73.9	Confident	70.3	Confident	84 Å²	84	110.6 Å²	110.6	45%	0.449	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-41.2	178.4	-57.7	-23.8	0	0	0	110.7	Q353 Q354 Y359 Q360 E361	Q353-D357 PolarHBondContact NE2-OD1 3.04Å; Q353-D357 PolarHBondContact O-N 2.93Å; Q354-D357 PolarHBondContact O-N 3.33Å; D357-Y359 VanDerWaalsContact C-N 3.34Å; D357-Y359 PolarHBondContact O-N 2.82Å; D357-Q360 WeakPolarHBondContact O-CB 3.47Å; D357-Q360 PolarHBondContact O-N 2.84Å; D357-E361 PolarHBondContact O-N 2.89Å; D357-E361 VanDerWaalsContact O-N 3.14Å
358	E	74.3	Confident	69.9	Low	112 Å²	112	109.6 Å²	109.6	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-61	-35.4	174.2	-73.3	169.2	-168.7	0	0	113.1	Q354	Q354-E358 PolarHBondContact NE2-OE1 2.95Å; Q354-E358 WeakPolarHBondContact O-CG 3.36Å; Q354-E358 PolarHBondContact O-N 2.81Å; Q354-E358 VanDerWaalsContact O-N 3.14Å
359	Y	62.9	Low	69.6	Low	170 Å²	170	108.2 Å²	108.2	67%	0.667	53%	0.526	S	S	*	.	H	α-helix	trans	-75.9	-23.6	172.5	-76.1	-60.8	0	0	0	113.4	Q355 L356 D357 L363	Q355-Y359 WeakPolarHBondContact O-CD2 3.42Å; Q355-Y359 PolarHBondContact O-N 3.14Å; L356-Y359 PolarHBondContact O-N 3.06Å; D357-Y359 VanDerWaalsContact C-N 3.34Å; D357-Y359 PolarHBondContact O-N 2.82Å; Y359-L363 PolarHBondContact O-N 3.43Å
360	Q	64.9	Low	69	Low	104 Å²	104	101.6 Å²	101.6	49%	0.486	50%	0.504	S	S	.	.	H	α-helix	trans	-75.2	-43.3	179.6	-166.9	67.3	44.8	0	0	111.4	L356 D357 L362 L363 D364	L356-Q360 PolarHBondContact O-N 3.1Å; D357-Q360 WeakPolarHBondContact O-CB 3.47Å; D357-Q360 PolarHBondContact O-N 2.84Å; Q360-L362 VanDerWaalsContact C-N 3.27Å; Q360-L362 PolarHBondContact O-N 3.38Å; Q360-L363 WeakPolarHBondContact O-CB 3.48Å; Q360-L363 PolarHBondContact O-N 2.83Å; Q360-L363 VanDerWaalsContact O-N 3.1Å; Q360-D364 PolarHBondContact O-N 2.8Å
361	E	66.8	Low	68.3	Low	142 Å²	142	104.3 Å²	104.3	66%	0.664	51%	0.507	S	S	*	.	H	α-helix	trans	-59.3	-38.5	174.9	-69.6	-166.3	142.6	0	0	112.1	D357 L363 D364 I365	D357-E361 PolarHBondContact O-N 2.89Å; D357-E361 VanDerWaalsContact O-N 3.14Å; E361-L363 PolarHBondContact O-N 3.2Å; E361-D364 PolarHBondContact O-N 2.73Å; E361-I365 WeakPolarHBondContact O-CG1 3.36Å; E361-I365 PolarHBondContact O-N 3.12Å; E361-I365 VanDerWaalsContact O-N 3.09Å
362	L	71.5	Confident	68	Low	121 Å²	121	103.2 Å²	103.2	63%	0.634	51%	0.509	S	S	*	.	H	α-helix	trans	-65.6	-27.5	178.5	-148.9	76.5	0	0	0	112.8	Q360 K366	Q360-L362 VanDerWaalsContact C-N 3.27Å; Q360-L362 PolarHBondContact O-N 3.38Å; L362-K366 PolarHBondContact O-N 2.89Å
363	L	67.6	Low	67.5	Low	88 Å²	88	101.1 Å²	101.1	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-77.7	-37.6	175.9	-177.8	61.2	0	0	0	112.1	Y359 Q360 E361 K366 L367	Y359-L363 PolarHBondContact O-N 3.43Å; Q360-L363 WeakPolarHBondContact O-CB 3.48Å; Q360-L363 PolarHBondContact O-N 2.83Å; Q360-L363 VanDerWaalsContact O-N 3.1Å; E361-L363 PolarHBondContact O-N 3.2Å; L363-K366 WeakPolarHBondContact O-CB 3.33Å; L363-K366 PolarHBondContact O-N 3.25Å; L363-L367 PolarHBondContact O-N 2.87Å
364	D	66.1	Low	66.9	Low	91 Å²	91	101.6 Å²	101.6	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-71.8	-36	179	-72.8	-16.4	0	0	0	111.9	Q360 E361 K366 L367 A368	Q360-D364 PolarHBondContact O-N 2.8Å; E361-D364 PolarHBondContact O-N 2.73Å; D364-K366 VanDerWaalsContact C-N 3.25Å; D364-K366 PolarHBondContact O-N 3.11Å; D364-L367 PolarHBondContact O-N 3.46Å; D364-A368 PolarHBondContact O-N 3.38Å; D364-A368 VanDerWaalsContact O-N 3.13Å
365	I	69.4	Low	65.9	Low	106 Å²	106	99.8 Å²	99.8	54%	0.544	51%	0.506	S	S	.	.	H	α-helix	trans	-59.1	-38.8	169.7	-67.5	166.2	0	0	0	111	E361 A368	E361-I365 WeakPolarHBondContact O-CG1 3.36Å; E361-I365 PolarHBondContact O-N 3.12Å; E361-I365 VanDerWaalsContact O-N 3.09Å; I365-A368 PolarHBondContact O-N 2.92Å
366	K	69.2	Low	65.1	Low	102 Å²	102	103.2 Å²	103.2	44%	0.443	52%	0.515	S	S	.	.	H	α-helix	trans	-68.1	-38.4	177.4	-171.3	-86.2	-174.9	-122.8	0	111.9	L362 L363 D364 L369 D370	L362-K366 PolarHBondContact O-N 2.89Å; L363-K366 WeakPolarHBondContact O-CB 3.33Å; L363-K366 PolarHBondContact O-N 3.25Å; D364-K366 VanDerWaalsContact C-N 3.25Å; D364-K366 PolarHBondContact O-N 3.11Å; K366-L369 PolarHBondContact O-N 3.09Å; K366-D370 IonicContact NZ-OD1 2.66Å; K366-D370 PolarHBondContact NZ-OD1 2.88Å; K366-D370 IonicContact NZ-OD2 2.71Å; K366-D370 PolarHBondContact NZ-OD2 3.36Å; K366-D370 PolarHBondContact O-N 2.84Å
367	L	65.3	Low	64.3	Low	61 Å²	61	103.5 Å²	103.5	32%	0.319	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-37.1	176.1	-84.6	163.4	0	0	0	112.9	L363 D364 D370 M371 P391	L363-L367 PolarHBondContact O-N 2.87Å; D364-L367 PolarHBondContact O-N 3.46Å; L367-D370 PolarHBondContact O-N 3.48Å; L367-M371 PolarHBondContact O-N 3.32Å; L367-P391 HydrophobicContact CD2-CG 4.02Å
368	A	66.1	Low	63.2	Low	56 Å²	56	108 Å²	108	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-45.9	177	0	0	0	0	0	112.2	D364 I365 D370 M371 E372	D364-A368 PolarHBondContact O-N 3.38Å; D364-A368 VanDerWaalsContact O-N 3.13Å; I365-A368 PolarHBondContact O-N 2.92Å; A368-D370 PolarHBondContact O-N 3.47Å; A368-M371 WeakPolarHBondContact O-CB 3.4Å; A368-M371 PolarHBondContact O-N 3.38Å; A368-E372 PolarHBondContact O-N 2.99Å
369	L	64.2	Low	62.1	Low	99 Å²	99	109.8 Å²	109.8	52%	0.518	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-33.9	-179.3	-66.7	168.5	0	0	0	113	K366 M371 E372 I373	K366-L369 PolarHBondContact O-N 3.09Å; L369-M371 VanDerWaalsContact C-N 3.27Å; L369-M371 PolarHBondContact O-N 2.95Å; L369-E372 PolarHBondContact O-N 2.86Å; L369-I373 PolarHBondContact O-N 2.92Å
370	D	61.5	Low	61.1	Low	33 Å²	33	107.5 Å²	107.5	18%	0.176	54%	0.536	C	S	.	.	H	α-helix	trans	-62.4	-33.8	173.5	-75.4	-9.1	0	0	0	112.3	K366 L367 A368 H374 L389	K366-D370 IonicContact NZ-OD1 2.66Å; K366-D370 PolarHBondContact NZ-OD1 2.88Å; K366-D370 IonicContact NZ-OD2 2.71Å; K366-D370 PolarHBondContact NZ-OD2 3.36Å; K366-D370 PolarHBondContact O-N 2.84Å; L367-D370 PolarHBondContact O-N 3.48Å; A368-D370 PolarHBondContact O-N 3.47Å; D370-H374 PolarHBondContact O-N 2.87Å; D370-L389 WeakPolarHBondContact CB-O 3.24Å
371	M	61.6	Low	60.1	Low	119 Å²	119	108.6 Å²	108.6	59%	0.586	54%	0.541	S	S	*	.	H	α-helix	trans	-72.3	-39.8	-179.2	-74.3	180	53.2	0	0	112.3	L367 A368 L369 I373 H374 A375	L367-M371 PolarHBondContact O-N 3.32Å; A368-M371 WeakPolarHBondContact O-CB 3.4Å; A368-M371 PolarHBondContact O-N 3.38Å; L369-M371 VanDerWaalsContact C-N 3.27Å; L369-M371 PolarHBondContact O-N 2.95Å; M371-I373 VanDerWaalsContact C-N 3.34Å; M371-I373 PolarHBondContact O-N 2.93Å; M371-H374 WeakPolarHBondContact O-CB 3.43Å; M371-H374 PolarHBondContact O-N 3.37Å; M371-H374 VanDerWaalsContact O-N 3.09Å; M371-A375 PolarHBondContact O-N 2.89Å
372	E	66.9	Low	58.7	Low	123 Å²	123	104.3 Å²	104.3	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-60.9	-44.2	177.5	-64.4	-173	153.2	0	0	111.1	A368 L369 H374 A375 Y376	A368-E372 PolarHBondContact O-N 2.99Å; L369-E372 PolarHBondContact O-N 2.86Å; E372-H374 PolarHBondContact O-N 3.07Å; E372-H374 VanDerWaalsContact O-N 3.15Å; E372-A375 PolarHBondContact O-N 3.35Å; E372-A375 VanDerWaalsContact O-N 3.1Å; E372-Y376 WeakPolarHBondContact O-CD2 3.36Å
373	I	57.9	Low	57	Low	81 Å²	81	106.4 Å²	106.4	42%	0.415	54%	0.542	S	S	.	.	H	α-helix	trans	-62.1	-21.8	176.7	-65.3	170.2	0	0	0	112.5	L369 M371	L369-I373 PolarHBondContact O-N 2.92Å; M371-I373 VanDerWaalsContact C-N 3.34Å; M371-I373 PolarHBondContact O-N 2.93Å
374	H	58	Low	55.6	Low	113 Å²	113	109.2 Å²	109.2	52%	0.523	55%	0.553	S	S	.	*	H	α-helix	trans	-80.6	-26.9	176.9	-153.2	81.6	0	0	0	113.3	D370 M371 E372	D370-H374 PolarHBondContact O-N 2.87Å; M371-H374 WeakPolarHBondContact O-CB 3.43Å; M371-H374 PolarHBondContact O-N 3.37Å; M371-H374 VanDerWaalsContact O-N 3.09Å; E372-H374 PolarHBondContact O-N 3.07Å; E372-H374 VanDerWaalsContact O-N 3.15Å
375	A	55.8	Low	54.6	Low	78 Å²	78	110.2 Å²	110.2	65%	0.645	55%	0.554	S	S	*	*	H	α-helix	trans	-68.7	-40.9	174.7	0	0	0	0	0	111.5	M371 E372 R377	M371-A375 PolarHBondContact O-N 2.89Å; E372-A375 PolarHBondContact O-N 3.35Å; E372-A375 VanDerWaalsContact O-N 3.1Å; A375-R377 PolarHBondContact O-N 2.95Å
376	Y	52.4	Low	53.4	Low	194 Å²	194	113.2 Å²	113.2	76%	0.761	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	14.8	177.9	-67.3	-68.9	0	0	0	115.4	E372	E372-Y376 WeakPolarHBondContact O-CD2 3.36Å
377	R	54	Low	52.4	Low	97 Å²	97	115 Å²	115	37%	0.366	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.1	4.8	-177.2	-71.8	-140.9	180	81.9	8.9	117.2	A375 R386 L387	A375-R377 PolarHBondContact O-N 2.95Å; R377-R386 PolarHBondContact NH2-O 2.94Å; R377-L387 PolarHBondContact NH1-O 3.26Å; R377-L387 PolarHBondContact NH2-O 2.9Å
378	K	51.7	Low	51.7	Low	178 Å²	178	122.8 Å²	122.8	77%	0.774	60%	0.598	S	S	*	*	S	Bend	trans	-127.4	20.4	-172.6	-138.3	178.5	-176.4	178.8	0	115.8
379	L	50.3	Low	50.7	Low	149 Å²	149	126.6 Å²	126.6	78%	0.78	61%	0.61	S	S	*	*	S	Bend	trans	-134.3	-57.6	167.9	-162.6	72.6	0	0	0	111.7
380	L	41.6	Very low	49.9	Very low	122 Å²	122	124.7 Å²	124.7	64%	0.639	60%	0.604	S	S	*	*			trans	-148	127.2	-173.6	-63.1	168.6	0	0	0	108.1	G382	L380-G382 CarbonylContact C-O 3.35Å; L380-G382 WeakPolarHBondContact CB-O 3.43Å
381	E	44.9	Very low	49.3	Very low	127 Å²	127	127.2 Å²	127.2	59%	0.593	62%	0.623	S	S	*	*			cis	14.2	80.2	-13.3	-82.9	-171.8	175	0	0	118.8	E385	E381-E385 PolarHBondContact OE1-N 3.27Å
382	G	37.5	Very low	48.5	Very low	53 Å²	53	127.5 Å²	127.5	55%	0.546	64%	0.636	S	S	.	*	S	Bend	cis	26	66.6	-18.9	0	0	0	0	0	118.2	L380	L380-G382 CarbonylContact C-O 3.35Å; L380-G382 WeakPolarHBondContact CB-O 3.43Å
383	E	34.8	Very low	47.8	Very low	165 Å²	165	127.5 Å²	127.5	77%	0.771	65%	0.647	S	S	*	*	S	Bend	trans	17.6	121	-178.6	-66.5	166.7	164.9	0	0	117.2
384	E	39.4	Very low	47.2	Very low	146 Å²	146	130.7 Å²	130.7	68%	0.682	67%	0.671	S	S	*	*			cis	-172.7	154.9	27.5	-121.6	163.2	171.5	0	0	113.8
385	E	43.3	Very low	46.6	Very low	112 Å²	112	130.3 Å²	130.3	52%	0.523	68%	0.681	S	S	.	*			trans	79.9	106	147.6	-66.3	-150.2	119.7	0	0	123.3	E381	E381-E385 PolarHBondContact OE1-N 3.27Å
386	R	45.1	Very low	46.2	Very low	169 Å²	169	133.6 Å²	133.6	64%	0.638	68%	0.683	S	S	*	*				75.6	118.9	122.9	-66.1	158.6	75.8	-176	-0.3	123.5	R377	R377-R386 PolarHBondContact NH2-O 2.94Å
387	L	48.4	Very low	46	Very low	139 Å²	139	135 Å²	135	73%	0.728	69%	0.686	S	S	*	*			trans	95	137.7	148.4	-53.9	161	0	0	0	123.6	R377	R377-L387 PolarHBondContact NH1-O 3.26Å; R377-L387 PolarHBondContact NH2-O 2.9Å
388	R	49.8	Very low	45.7	Very low	226 Å²	226	136.2 Å²	136.2	85%	0.853	71%	0.71	S	S	*	*			trans	-100	165.1	-144.6	-54.3	170.2	164.8	-169.9	-4.8	123.6
389	L	45.4	Very low	45.7	Very low	135 Å²	135	140.6 Å²	140.6	71%	0.707	72%	0.722	S	S	*	*			trans	132.3	0	136.5	-65.4	159.8	0	0	0	121.9	D370	D370-L389 WeakPolarHBondContact CB-O 3.24Å
390	S	47.3	Very low	45.6	Very low	59 Å²	59	137.5 Å²	137.5	41%	0.413	73%	0.726	S	S	.	*				0	0	0	-154.1	0	0	0	0	123.4
391	P	49.6	Very low	46.1	Very low	87 Å²	87	144.1 Å²	144.1	57%	0.565	74%	0.742	S	S	*	*				0	0	0	44.3	-25.5	0	0	0	124.9	L367	L367-P391 HydrophobicContact CD2-CG 4.02Å
392	S	45	Very low	46.4	Very low	124 Å²	124	142.8 Å²	142.8	87%	0.867	75%	0.753	S	S	*	*				0	0	0	-78.5	0	0	0	0	125.3
393	P	51.8	Low	47	Very low	124 Å²	124	146.6 Å²	146.6	81%	0.805	77%	0.771	S	S	*	*				0	0	0	43.1	-22.7	0	0	0	125.2
394	T	44.5	Very low	47.7	Very low	148 Å²	148	144.5 Å²	144.5	91%	0.908	78%	0.775	S	S	*	*				0	0	0	-2.5	0	0	0	0	124.8
395	S	47	Very low	48.1	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	78%	0.784	S	S	*	*				0	0	0	-84.5	0	0	0	0	119
396	Q	47.2	Very low	48.1	Very low	148 Å²	148	146.5 Å²	146.5	69%	0.692	80%	0.797	S	S	*	*				0	0	0	-81.1	174.6	58.1	0	0	112.9
397	R	46.5	Very low	48	Very low	222 Å²	222	143.3 Å²	143.3	84%	0.838	80%	0.8	S	S	*	*				0	0	0	-139.1	143.2	56.2	-155.3	2.4	117.5
398	S	48.7	Very low	47.7	Very low	124 Å²	124	146 Å²	146	87%	0.867	81%	0.809	S	S	*	*				0	0	0	68.4	0	0	0	0	125.3
399	R	50.7	Low	47.2	Very low	269 Å²	269	142.1 Å²	142.1	100%	1.015	81%	0.81	S	S	*	*				0	0	0	-106.5	170.7	-176.3	-178.2	1.1	124.1
400	G	49.9	Very low	47.1	Very low	84 Å²	84	145.5 Å²	145.5	87%	0.866	82%	0.823	S	S	*	*				0	0	0	0	0	0	0	0	125.7
401	R	51.4	Low	46.9	Very low	261 Å²	261	147 Å²	147	99%	0.985	85%	0.847	S	S	*	*				0	0	0	-173.2	170.2	177.5	-156	-1.9	123.2
402	A	51.2	Low	46.7	Very low	100 Å²	100	147.4 Å²	147.4	83%	0.826	87%	0.867	S	S	*	*				0	0	0	0	0	0	0	0	123.5
403	S	50.8	Low	46.7	Very low	132 Å²	132	145.4 Å²	145.4	92%	0.923	87%	0.866	S	S	*	*				0	0	0	-159.8	0	0	0	0	123.7
404	S	49	Very low	46.5	Very low	122 Å²	122	145.7 Å²	145.7	85%	0.853	87%	0.871	S	S	*	*				0	0	0	66.1	0	0	0	0	124.5
405	H	47.4	Very low	46.6	Very low	189 Å²	189	145 Å²	145	88%	0.875	87%	0.866	S	S	*	*				0	0	0	178.6	78.4	0	0	0	123.3
406	S	42.9	Very low	46.3	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	87%	0.873	S	S	*	*				0	0	0	-164.9	0	0	0	0	123.8
407	S	43.1	Very low	45.8	Very low	101 Å²	101	149.9 Å²	149.9	71%	0.706	88%	0.884	S	S	*	*				0	0	0	68.9	0	0	0	0	124.4
408	Q	42	Very low	45.3	Very low	197 Å²	197	149.6 Å²	149.6	92%	0.921	89%	0.889	S	S	*	*				0	0	0	-99.8	154.8	101.7	0	0	123.7
409	T	40	Very low	44.8	Very low	144 Å²	144	153.4 Å²	153.4	88%	0.883	89%	0.885	S	S	*	*				0	0	0	-78.4	0	0	0	0	122.8
410	Q	43.4	Very low	44	Very low	206 Å²	206	147.6 Å²	147.6	96%	0.963	87%	0.867	S	S	*	*				0	0	0	-64.1	-165.1	-5.2	0	0	122.9
411	G	43.3	Very low	43.4	Very low	90 Å²	90	149.8 Å²	149.8	93%	0.928	86%	0.858	S	S	*	*				0	0	0	0	0	0	0	0	125.5
412	G	44.8	Very low	42.5	Very low	96 Å²	96	144.5 Å²	144.5	99%	0.99	84%	0.844	S	S	*	*				0	0	0	0	0	0	0	0	125.5
413	G	45.3	Very low	41.7	Very low	82 Å²	82	146 Å²	146	85%	0.845	85%	0.849	S	S	*	*				0	0	0	0	0	0	0	0	126.2
414	S	47.4	Very low	41	Very low	129 Å²	129	149 Å²	149	90%	0.902	85%	0.848	S	S	*	*				0	0	0	-80.4	0	0	0	0	119.5
415	V	46.5	Very low	40.6	Very low	134 Å²	134	149 Å²	149	81%	0.812	85%	0.848	S	S	*	*				0	0	0	152.4	0	0	0	0	116.9
416	T	41.3	Very low	40.3	Very low	142 Å²	142	151.9 Å²	151.9	87%	0.871	85%	0.851	S	S	*	*				0	0	0	-10.8	0	0	0	0	124.3
417	K	37.1	Very low	40.3	Very low	212 Å²	212	151.9 Å²	151.9	92%	0.922	85%	0.851	S	S	*	*				0	0	0	-68	-166.7	177.1	-179.1	0	123.5
418	K	35.4	Very low	40.9	Very low	217 Å²	217	150.8 Å²	150.8	94%	0.943	84%	0.843	S	S	*	*				0	0	0	-93.2	170	179.4	174.5	0	118.2
419	R	37.4	Very low	42.3	Very low	204 Å²	204	145.5 Å²	145.5	77%	0.77	82%	0.818	S	S	*	*				0	0	0	154.6	-83.6	159.5	155.4	1.1	117.3
420	K	34.3	Very low	44	Very low	147 Å²	147	141.2 Å²	141.2	64%	0.639	79%	0.794	S	S	*	*				0	0	0	-151.4	-121.1	174.4	-145.4	0	121.4	E422	K420-E422 VanDerWaalsContact CD-OE2 3.31Å; K420-E422 WeakPolarHBondContact CD-OE2 3.31Å; K420-E422 IonicContact NZ-OE1 2.65Å; K420-E422 PolarHBondContact NZ-OE1 2.76Å; K420-E422 IonicContact NZ-OE2 2.68Å; K420-E422 PolarHBondContact NZ-OE2 3.38Å; K420-E422 VanDerWaalsContact NZ-OE2 3.09Å
421	L	37.7	Very low	45.9	Very low	130 Å²	130	136.1 Å²	136.1	68%	0.681	77%	0.77	S	S	*	*				0	0	0	-143.6	69.7	0	0	0	121.6
422	E	32.2	Very low	47.8	Very low	150 Å²	150	137.6 Å²	137.6	70%	0.701	75%	0.752	S	S	*	*				0	0	0	-9.7	-70.6	-52.8	0	0	121.2	K420	K420-E422 VanDerWaalsContact CD-OE2 3.31Å; K420-E422 WeakPolarHBondContact CD-OE2 3.31Å; K420-E422 IonicContact NZ-OE1 2.65Å; K420-E422 PolarHBondContact NZ-OE1 2.76Å; K420-E422 IonicContact NZ-OE2 2.68Å; K420-E422 PolarHBondContact NZ-OE2 3.38Å; K420-E422 VanDerWaalsContact NZ-OE2 3.09Å
423	S	35.4	Very low	49.9	Very low	131 Å²	131	135.9 Å²	135.9	92%	0.916	73%	0.728	S	S	*	*				0	0	0	-157.6	0	0	0	0	122.9
424	E	36	Very low	51.9	Low	194 Å²	194	141 Å²	141	91%	0.907	72%	0.722	S	S	*	*				0	0	0	-127.2	-179.2	-176.5	0	0	120.8
425	S	39.1	Very low	53.7	Low	122 Å²	122	138 Å²	138	85%	0.853	70%	0.699	S	S	*	*				0	0	0	-56.7	0	0	0	0	125
426	R	41.7	Very low	55.3	Low	250 Å²	250	137 Å²	137	94%	0.943	70%	0.698	S	S	*	*				0	-177.7	0	-69.7	-177.1	68.9	-177.9	1.1	120.9
427	S	42.1	Very low	57.2	Low	112 Å²	112	131.9 Å²	131.9	78%	0.783	67%	0.673	S	S	*	*			trans	-145.7	175.7	-177	69.5	0	0	0	0	120
428	S	57.7	Low	59.7	Low	77 Å²	77	126.3 Å²	126.3	54%	0.538	65%	0.646	S	S	.	*			trans	-150	-171.8	-168.1	74.9	0	0	0	0	120.9
429	F	70.1	Confident	62.4	Low	87 Å²	87	116 Å²	116	38%	0.382	60%	0.602	S	S	.	*			trans	-152.7	166.6	-174.3	-111	-89.2	0	0	0	114.5	E446 L542 R544	F429-E446 WeakPolarHBondContact CZ-OE2 3.34Å; F429-L542 HydrophobicContact CE1-CD2 4.34Å; F429-R544 HydrophobicContact CD1-CB 4.02Å; F429-R544 HydrophobicContact CD1-CG 4.14Å; F429-R544 HydrophobicContact CD2-CG 4.24Å; F429-R544 HydrophobicContact CE1-CB 3.51Å; F429-R544 HydrophobicContact CE1-CG 3.72Å; F429-R544 HydrophobicContact CE2-CG 3.84Å; F429-R544 HydrophobicContact CG-CG 4.41Å; F429-R544 HydrophobicContact CZ-CB 3.84Å; F429-R544 HydrophobicContact CZ-CG 3.57Å
430	S	76.1	Confident	65.1	Low	54 Å²	54	106.5 Å²	106.5	38%	0.378	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.7	152.6	178.7	-172.9	0	0	0	0	116.5	V543	S430-V543 PolarHBondContact N-O 3.14Å; S430-V543 VanDerWaalsContact N-O 3.07Å; S430-V543 PolarHBondContact O-N 3.41Å; S430-V543 VanDerWaalsContact O-O 3.09Å
431	Q	83.6	Confident	67.9	Low	99 Å²	99	99.7 Å²	99.7	46%	0.463	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	142	-169.2	-173.8	172.1	99.9	0	0	115	L542	Q431-L542 HydrophobicContact CB-CD1 3.74Å; Q431-L542 HydrophobicContact CG-CD1 3.65Å
432	H	83.8	Confident	70.3	Confident	121 Å²	121	95.9 Å²	95.9	56%	0.56	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	145.1	171.3	-56.8	-53.8	0	0	0	112.2	R540 K541	H432-R540 CarbonylContact O-C 3.55Å; H432-R540 WeakPolarHBondContact O-CA 3.47Å; H432-R540 WeakPolarHBondContact O-CG 3.42Å; H432-K541 PolarHBondContact N-O 3.5Å; H432-K541 PolarHBondContact O-N 2.95Å; H432-K541 VanDerWaalsContact O-O 3.11Å
433	A	87.6	Confident	73.1	Confident	59 Å²	59	92.2 Å²	92.2	49%	0.488	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151	175.6	0	0	0	0	0	111.8	M539 R540	A433-M539 WeakPolarHBondContact CA-O 3.49Å; A433-R540 HydrophobicContact CB-CG 4.22Å
434	R	86.7	Confident	75.6	Confident	190 Å²	190	87 Å²	87	72%	0.717	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	149.8	171.7	-61.1	-177.6	175.6	178.5	-3	109.6	A538 M539	R434-A538 WeakPolarHBondContact O-CA 3.49Å; R434-M539 HydrophobicContact CB-CG 3.81Å; R434-M539 HydrophobicContact CB-SD 4.5Å; R434-M539 HydrophobicContact CG-CG 4.38Å; R434-M539 HydrophobicContact CG-SD 4.47Å; R434-M539 PolarHBondContact N-O 3.14Å; R434-M539 PolarHBondContact O-N 2.8Å; R434-M539 VanDerWaalsContact O-O 3.08Å
435	T	85.4	Confident	78.1	Confident	67 Å²	67	79.1 Å²	79.1	41%	0.411	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	125.8	177.2	-63.2	0	0	0	0	108.5	G437 A440 A538	T435-G437 WeakPolarHBondContact CG2-O 3.28Å; T435-A440 HydrophobicContact CG2-CB 4.04Å; T435-A440 WeakPolarHBondContact OG1-CB 3.49Å; T435-A538 HydrophobicContact CG2-CB 4.16Å
436	S	80.2	Confident	80.2	Confident	113 Å²	113	77.7 Å²	77.7	79%	0.79	41%	0.405	S	S	*	.	S	Bend	trans	-111.8	-7.4	-178.3	-158.3	0	0	0	0	112.5	V537	S436-V537 PolarHBondContact N-O 3.33Å
437	G	81.1	Confident	82.2	Confident	34 Å²	34	71.8 Å²	71.8	35%	0.351	39%	0.388	S	S	.	.	S	Bend	trans	-129.5	-170.8	179.3	0	0	0	0	0	113.6	T435 V439 V537	T435-G437 WeakPolarHBondContact CG2-O 3.28Å; G437-V439 VanDerWaalsContact C-N 3.27Å; G437-V439 PolarHBondContact O-N 3.4Å; G437-V537 PolarHBondContact N-O 3.39Å
438	R	90.6	Very high	84.4	Confident	95 Å²	95	66.5 Å²	66.5	36%	0.358	35%	0.351	S	S	.	.	S	Bend	trans	-68.2	-20.9	-175.5	-64.8	179.8	174.6	-164.6	-10	114.4	N455 K456 E459	R438-N455 PolarHBondContact O-OD1 3.47Å; R438-K456 PolarHBondContact O-N 2.7Å; R438-E459 IonicContact CZ-OE2 3.56Å; R438-E459 VanDerWaalsContact NH1-CB 3.27Å; R438-E459 IonicContact NH1-OE2 2.77Å; R438-E459 PolarHBondContact NH1-OE2 2.91Å; R438-E459 VanDerWaalsContact NH2-CD 3.31Å; R438-E459 IonicContact NH2-OE1 3.93Å; R438-E459 PolarHBondContact NH2-OE1 2.86Å; R438-E459 IonicContact NH2-OE2 3.3Å; R438-E459 PolarHBondContact NH2-OE2 3.31Å
439	V	92.6	Very high	86	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.9	-174.4	179.8	0	0	0	0	110.7	G437 L453 R454 N455 Q461 M463 L488 L529 A538	G437-V439 VanDerWaalsContact C-N 3.27Å; G437-V439 PolarHBondContact O-N 3.4Å; V439-L453 HydrophobicContact CG1-CB 3.91Å; V439-L453 HydrophobicContact CG1-CD1 4.3Å; V439-R454 WeakPolarHBondContact CA-O 3.38Å; V439-N455 HydrophobicContact CG2-CB 4.12Å; V439-Q461 HydrophobicContact CG2-CB 4.02Å; V439-Q461 HydrophobicContact CG2-CG 3.84Å; V439-M463 HydrophobicContact CB-SD 4.44Å; V439-M463 HydrophobicContact CG1-CE 4.31Å; V439-M463 HydrophobicContact CG2-SD 3.87Å; V439-L488 HydrophobicContact CG1-CD2 4.01Å; V439-L488 HydrophobicContact CG2-CD2 4.09Å; V439-L529 HydrophobicContact CB-CD2 3.97Å; V439-L529 HydrophobicContact CG1-CD2 3.68Å; V439-A538 WeakPolarHBondContact O-CB 3.4Å
440	A	93	Very high	87.1	Confident	3 Å²	3	63.9 Å²	63.9	3%	0.025	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	150.2	178.3	0	0	0	0	0	111.7	T435 E442 L453 R454 K456	T435-A440 HydrophobicContact CG2-CB 4.04Å; T435-A440 WeakPolarHBondContact OG1-CB 3.49Å; A440-E442 PolarHBondContact O-N 2.95Å; A440-E442 VanDerWaalsContact O-N 3.15Å; A440-L453 VanDerWaalsContact O-CA 3.31Å; A440-L453 WeakPolarHBondContact O-CA 3.43Å; A440-R454 PolarHBondContact N-O 3.46Å; A440-R454 PolarHBondContact O-N 2.87Å; A440-K456 HydrophobicContact CB-CD 3.98Å; A440-K456 HydrophobicContact CB-CG 4.32Å
441	V	93.1	Very high	88	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	95.3	164.1	-176.2	0	0	0	0	107.7	V444 V451 L453 T527 L529 A538 R540	V441-V444 HydrophobicContact CG1-CG2 3.61Å; V441-V451 HydrophobicContact CG1-CG1 4.47Å; V441-L453 HydrophobicContact CB-CD2 4.21Å; V441-L453 HydrophobicContact CG1-CD2 4.36Å; V441-L453 HydrophobicContact CG2-CD2 3.84Å; V441-T527 HydrophobicContact CG1-CG2 4.08Å; V441-T527 HydrophobicContact CG2-CG2 4.46Å; V441-L529 HydrophobicContact CG2-CB 4.25Å; V441-A538 HydrophobicContact CG2-CB 4.16Å; V441-R540 HydrophobicContact CB-CB 4.19Å; V441-R540 HydrophobicContact CG1-CB 3.94Å; V441-R540 PolarHBondContact O-NH1 2.74Å
442	E	88.9	Confident	88.6	Confident	51 Å²	51	59.2 Å²	59.2	24%	0.238	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	-42	-171.6	175.4	171.3	-163.5	0	0	112.6	A440 R452 R454 R540	A440-E442 PolarHBondContact O-N 2.95Å; A440-E442 VanDerWaalsContact O-N 3.15Å; E442-R452 HydrophobicContact CB-CG 4.46Å; E442-R452 PolarHBondContact N-O 3Å; E442-R454 HydrophobicContact CB-CB 4.1Å; E442-R454 IonicContact OE1-CZ 3.36Å; E442-R454 IonicContact OE1-NE 3.74Å; E442-R454 PolarHBondContact OE1-NE 2.9Å; E442-R454 VanDerWaalsContact OE1-NE 3.14Å; E442-R454 IonicContact OE1-NH2 2.62Å; E442-R454 PolarHBondContact OE1-NH2 3.04Å; E442-R454 WeakPolarHBondContact OE2-CB 3.43Å; E442-R454 IonicContact OE2-CZ 3.02Å; E442-R454 IonicContact OE2-NE 2.58Å; E442-R454 PolarHBondContact OE2-NE 3.17Å; E442-R454 IonicContact OE2-NH2 3.09Å; E442-R454 PolarHBondContact OE2-NH2 2.78Å; E442-R540 PolarHBondContact O-NH1 3.41Å; E442-R540 PolarHBondContact O-NH2 3.03Å
443	E	89.4	Confident	89.2	Confident	73 Å²	73	53.5 Å²	53.5	34%	0.341	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	149.1	-171.8	-172.2	-176.9	147.1	0	0	108.6	F450 R452	E443-F450 HydrophobicContact CG-CE2 4.25Å; E443-F450 WeakPolarHBondContact OE1-CZ 3.4Å; E443-R452 HydrophobicContact CB-CB 4.03Å; E443-R452 PolarHBondContact N-O 2.91Å; E443-R452 PolarHBondContact O-N 3.1Å; E443-R452 IonicContact OE1-CZ 2.75Å; E443-R452 IonicContact OE1-NH1 3.75Å; E443-R452 PolarHBondContact OE1-NH1 2.96Å; E443-R452 VanDerWaalsContact OE1-NH1 3.16Å; E443-R452 IonicContact OE2-CZ 3.77Å; E443-R452 IonicContact OE2-NH1 2.83Å; E443-R452 PolarHBondContact OE2-NH1 3.44Å
444	V	87.9	Confident	89.6	Confident	20 Å²	20	55.2 Å²	55.2	12%	0.121	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	130.5	171.4	-166.6	0	0	0	0	107.8	V441 V451 T527	V441-V444 HydrophobicContact CG1-CG2 3.61Å; V444-V451 HydrophobicContact CG1-CG2 3.68Å; V444-V451 HydrophobicContact CG2-CG1 4.44Å; V444-V451 HydrophobicContact CG2-CG2 4.47Å; V444-T527 HydrophobicContact CG2-CG2 4.32Å
445	D	88.6	Confident	90	Very high	29 Å²	29	46.2 Å²	46.2	16%	0.155	23%	0.233	C	C	.	.			trans	-66.1	137.5	-178.6	-173.9	85.4	0	0	0	111.4	E447 G448 K449 F450	D445-E447 VanDerWaalsContact OD2-C 3.24Å; D445-E447 WeakPolarHBondContact OD2-CA 3.27Å; D445-E447 WeakPolarHBondContact OD2-CB 3.38Å; D445-E447 PolarHBondContact OD2-N 3.33Å; D445-G448 PolarHBondContact O-N 2.99Å; D445-G448 PolarHBondContact OD2-N 3.19Å; D445-K449 HydrophobicContact CB-CB 4.23Å; D445-K449 WeakPolarHBondContact OD2-CB 3.2Å; D445-K449 PolarHBondContact OD2-N 2.87Å; D445-F450 HydrophobicContact CB-CD1 3.8Å; D445-F450 HydrophobicContact CB-CE1 3.77Å; D445-F450 HydrophobicContact CB-CE2 4.5Å; D445-F450 HydrophobicContact CB-CG 4.18Å; D445-F450 HydrophobicContact CB-CZ 4.13Å; D445-F450 WeakPolarHBondContact CB-O 2.78Å; D445-F450 PolarHBondContact N-O 3.49Å
446	E	83.9	Confident	90.3	Very high	93 Å²	93	50.5 Å²	50.5	44%	0.435	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-27.2	-177.8	-59.3	-170.2	175.9	0	0	112.2	F429 G448 C521 L542	F429-E446 WeakPolarHBondContact CZ-OE2 3.34Å; E446-G448 VanDerWaalsContact C-N 3.32Å; E446-C521 VanDerWaalsContact O-CB 3.25Å; E446-C521 WeakPolarHBondContact O-CB 3.45Å; E446-L542 HydrophobicContact CG-CD2 3.75Å
447	E	83.8	Confident	90.8	Very high	126 Å²	126	46.1 Å²	46.1	59%	0.589	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	0.7	175.9	-57.3	178.8	179.8	0	0	112.2	D445 K449	D445-E447 VanDerWaalsContact OD2-C 3.24Å; D445-E447 WeakPolarHBondContact OD2-CA 3.27Å; D445-E447 WeakPolarHBondContact OD2-CB 3.38Å; D445-E447 PolarHBondContact OD2-N 3.33Å; E447-K449 HydrophobicContact CB-CD 4.47Å; E447-K449 WeakPolarHBondContact OE2-CE 3.44Å; E447-K449 IonicContact OE2-NZ 3.14Å; E447-K449 PolarHBondContact OE2-NZ 2.92Å
448	G	88	Confident	91.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	80.1	15.9	176.8	0	0	0	0	0	115.4	D445 E446 T518 W519	D445-G448 PolarHBondContact O-N 2.99Å; D445-G448 PolarHBondContact OD2-N 3.19Å; E446-G448 VanDerWaalsContact C-N 3.32Å; G448-T518 PolarHBondContact O-OG1 3.07Å; G448-W519 WeakPolarHBondContact O-CB 3.41Å; G448-W519 PolarHBondContact O-N 3.38Å
449	K	91.4	Very high	91.3	Very high	93 Å²	93	51.1 Å²	51.1	40%	0.404	24%	0.238	S	C	.	.	S	Bend	trans	-68.5	-39.6	-178.1	-67.9	160	171.3	165.2	0	113.6	D445 E447 A498 A501	D445-K449 HydrophobicContact CB-CB 4.23Å; D445-K449 WeakPolarHBondContact OD2-CB 3.2Å; D445-K449 PolarHBondContact OD2-N 2.87Å; E447-K449 HydrophobicContact CB-CD 4.47Å; E447-K449 WeakPolarHBondContact OE2-CE 3.44Å; E447-K449 IonicContact OE2-NZ 3.14Å; E447-K449 PolarHBondContact OE2-NZ 2.92Å; K449-A498 PolarHBondContact O-N 3.28Å; K449-A501 HydrophobicContact CB-CB 4.02Å; K449-A501 HydrophobicContact CG-CB 4.38Å
450	F	94	Very high	91.5	Very high	16 Å²	16	55.1 Å²	55.1	7%	0.07	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	160.9	-177.5	65.5	-90.4	0	0	0	115	E443 D445 R452 T495 I496 W497	E443-F450 HydrophobicContact CG-CE2 4.25Å; E443-F450 WeakPolarHBondContact OE1-CZ 3.4Å; D445-F450 HydrophobicContact CB-CD1 3.8Å; D445-F450 HydrophobicContact CB-CE1 3.77Å; D445-F450 HydrophobicContact CB-CE2 4.5Å; D445-F450 HydrophobicContact CB-CG 4.18Å; D445-F450 HydrophobicContact CB-CZ 4.13Å; D445-F450 WeakPolarHBondContact CB-O 2.78Å; D445-F450 PolarHBondContact N-O 3.49Å; F450-R452 HydrophobicContact CD2-CB 4.22Å; F450-R452 HydrophobicContact CE2-CB 4.25Å; F450-T495 HydrophobicContact CB-CG2 3.61Å; F450-T495 HydrophobicContact CD2-CG2 3.64Å; F450-T495 HydrophobicContact CG-CG2 3.73Å; F450-I496 WeakPolarHBondContact CA-O 3.47Å; F450-W497 HydrophobicContact CB-CD2 4.05Å; F450-W497 HydrophobicContact CB-CE3 3.77Å; F450-W497 HydrophobicContact CB-CZ3 4.21Å; F450-W497 AromaticContact CD1-CE3 3.96Å; F450-W497 HydrophobicContact CD1-CE3 3.96Å; F450-W497 AromaticContact CD1-CH2 4Å; F450-W497 HydrophobicContact CD1-CH2 4Å; F450-W497 AromaticContact CD1-CZ3 3.51Å; F450-W497 HydrophobicContact CD1-CZ3 3.51Å; F450-W497 HydrophobicContact CE1-CH2 4.45Å; F450-W497 HydrophobicContact CE1-CZ3 4.26Å; F450-W497 HydrophobicContact CG-CE3 4.21Å; F450-W497 HydrophobicContact CG-CZ3 4.14Å
451	V	95.3	Very high	91.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133.3	163	171.5	0	0	0	0	108.3	V441 V444 L453 I468 I496 W519 T527	V441-V451 HydrophobicContact CG1-CG1 4.47Å; V444-V451 HydrophobicContact CG1-CG2 3.68Å; V444-V451 HydrophobicContact CG2-CG1 4.44Å; V444-V451 HydrophobicContact CG2-CG2 4.47Å; V451-L453 HydrophobicContact CG1-CD2 4.07Å; V451-I468 HydrophobicContact CG1-CD1 4.16Å; V451-I468 HydrophobicContact CG1-CG2 4.23Å; V451-I496 PolarHBondContact N-O 3.3Å; V451-I496 WeakPolarHBondContact O-CD1 3.46Å; V451-I496 PolarHBondContact O-N 3.33Å; V451-W519 HydrophobicContact CB-CH2 4.45Å; V451-W519 HydrophobicContact CB-CZ2 4.01Å; V451-W519 HydrophobicContact CG2-CD2 3.57Å; V451-W519 HydrophobicContact CG2-CE3 3.82Å; V451-W519 HydrophobicContact CG2-CG 4.04Å; V451-W519 HydrophobicContact CG2-CH2 4.07Å; V451-W519 HydrophobicContact CG2-CZ2 3.85Å; V451-W519 HydrophobicContact CG2-CZ3 4.07Å; V451-T527 HydrophobicContact CG1-CG2 4.01Å; V451-T527 HydrophobicContact CG2-CG2 4.21Å
452	R	95.7	Very high	91.6	Very high	56 Å²	56	59.8 Å²	59.8	21%	0.211	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.5	179.3	-172.3	173.7	-70.9	153.4	5.1	110.8	E442 E443 F450 V493 V494 T495	E442-R452 HydrophobicContact CB-CG 4.46Å; E442-R452 PolarHBondContact N-O 3Å; E443-R452 HydrophobicContact CB-CB 4.03Å; E443-R452 PolarHBondContact N-O 2.91Å; E443-R452 PolarHBondContact O-N 3.1Å; E443-R452 IonicContact OE1-CZ 2.75Å; E443-R452 IonicContact OE1-NH1 3.75Å; E443-R452 PolarHBondContact OE1-NH1 2.96Å; E443-R452 VanDerWaalsContact OE1-NH1 3.16Å; E443-R452 IonicContact OE2-CZ 3.77Å; E443-R452 IonicContact OE2-NH1 2.83Å; E443-R452 PolarHBondContact OE2-NH1 3.44Å; F450-R452 HydrophobicContact CD2-CB 4.22Å; F450-R452 HydrophobicContact CE2-CB 4.25Å; R452-V493 HydrophobicContact CG-CG1 3.47Å; R452-V493 VanDerWaalsContact CG-CG1 3.47Å; R452-V494 WeakPolarHBondContact CA-O 3.37Å; R452-T495 PolarHBondContact NE-OG1 2.64Å
453	L	96.4	Very high	91.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	145.9	176.2	-51.7	-176.1	0	0	0	110.6	V439 A440 V441 V451 M463 I468 F482 V493 V494 I496 L529	V439-L453 HydrophobicContact CG1-CB 3.91Å; V439-L453 HydrophobicContact CG1-CD1 4.3Å; A440-L453 VanDerWaalsContact O-CA 3.31Å; A440-L453 WeakPolarHBondContact O-CA 3.43Å; V441-L453 HydrophobicContact CB-CD2 4.21Å; V441-L453 HydrophobicContact CG1-CD2 4.36Å; V441-L453 HydrophobicContact CG2-CD2 3.84Å; V451-L453 HydrophobicContact CG1-CD2 4.07Å; L453-M463 HydrophobicContact CD1-CE 4.25Å; L453-I468 HydrophobicContact CD1-CD1 4.02Å; L453-I468 HydrophobicContact CD1-CG1 4.38Å; L453-I468 HydrophobicContact CG-CD1 4.4Å; L453-F482 HydrophobicContact CD1-CE2 3.96Å; L453-F482 HydrophobicContact CD1-CZ 3.64Å; L453-V493 CarbonylContact O-C 3.49Å; L453-V493 WeakPolarHBondContact O-CA 3.19Å; L453-V494 HydrophobicContact CB-CG1 3.93Å; L453-V494 PolarHBondContact N-O 3.06Å; L453-V494 PolarHBondContact O-N 3.13Å; L453-I496 HydrophobicContact CD1-CD1 4.3Å; L453-I496 HydrophobicContact CG-CD1 4.05Å; L453-L529 HydrophobicContact CD1-CD1 3.77Å; L453-L529 HydrophobicContact CD1-CD2 4.13Å
454	R	95.3	Very high	91.9	Very high	96 Å²	96	54.4 Å²	54.4	36%	0.362	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	129.4	174.6	-174.8	-177.6	-68.9	-136	6.2	111.1	V439 A440 E442 K456 Q492 V493	V439-R454 WeakPolarHBondContact CA-O 3.38Å; A440-R454 PolarHBondContact N-O 3.46Å; A440-R454 PolarHBondContact O-N 2.87Å; E442-R454 HydrophobicContact CB-CB 4.1Å; E442-R454 IonicContact OE1-CZ 3.36Å; E442-R454 IonicContact OE1-NE 3.74Å; E442-R454 PolarHBondContact OE1-NE 2.9Å; E442-R454 VanDerWaalsContact OE1-NE 3.14Å; E442-R454 IonicContact OE1-NH2 2.62Å; E442-R454 PolarHBondContact OE1-NH2 3.04Å; E442-R454 WeakPolarHBondContact OE2-CB 3.43Å; E442-R454 IonicContact OE2-CZ 3.02Å; E442-R454 IonicContact OE2-NE 2.58Å; E442-R454 PolarHBondContact OE2-NE 3.17Å; E442-R454 IonicContact OE2-NH2 3.09Å; E442-R454 PolarHBondContact OE2-NH2 2.78Å; R454-K456 HydrophobicContact CG-CG 4.5Å; R454-K456 PolarHBondContact O-N 3.48Å; R454-Q492 WeakPolarHBondContact CA-O 3.22Å; R454-V493 HydrophobicContact CB-CG2 4.12Å; R454-V493 HydrophobicContact CG-CG2 3.85Å
455	N	94.9	Very high	92.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	113.3	162.4	-175.2	-7.3	0	0	0	108.4	R438 V439 S457 E459 L488 K489 G491 Q492	R438-N455 PolarHBondContact O-OD1 3.47Å; V439-N455 HydrophobicContact CG2-CB 4.12Å; N455-S457 WeakPolarHBondContact OD1-CB 3.41Å; N455-S457 PolarHBondContact OD1-N 3.11Å; N455-S457 PolarHBondContact OD1-OG 2.85Å; N455-E459 PolarHBondContact ND2-O 3.4Å; N455-L488 HydrophobicContact CB-CD2 3.98Å; N455-L488 HydrophobicContact CB-CG 4.02Å; N455-L488 PolarHBondContact ND2-O 3.5Å; N455-L488 VanDerWaalsContact ND2-O 3.07Å; N455-K489 VanDerWaalsContact CB-O 3.28Å; N455-K489 WeakPolarHBondContact CB-O 3.47Å; N455-K489 PolarHBondContact ND2-O 2.86Å; N455-G491 CarbonylContact O-C 3.57Å; N455-G491 WeakPolarHBondContact O-CA 3.25Å; N455-G491 PolarHBondContact O-N 3.36Å; N455-Q492 PolarHBondContact N-O 3.12Å
456	K	91.2	Very high	92.4	Very high	157 Å²	157	56.2 Å²	56.2	68%	0.683	27%	0.273	S	S	*	.			trans	-91.3	-0.7	179	-71.4	-170	173.5	-174.1	0	112.9	R438 A440 R454	R438-K456 PolarHBondContact O-N 2.7Å; A440-K456 HydrophobicContact CB-CD 3.98Å; A440-K456 HydrophobicContact CB-CG 4.32Å; R454-K456 HydrophobicContact CG-CG 4.5Å; R454-K456 PolarHBondContact O-N 3.48Å
457	S	90.6	Very high	93	Very high	22 Å²	22	53.5 Å²	53.5	15%	0.154	26%	0.261	C	S	.	.	S	Bend	trans	-94.3	163.8	176.9	75.8	0	0	0	0	112.7	N455 E459 A490 G491	N455-S457 WeakPolarHBondContact OD1-CB 3.41Å; N455-S457 PolarHBondContact OD1-N 3.11Å; N455-S457 PolarHBondContact OD1-OG 2.85Å; S457-E459 PolarHBondContact O-N 3.43Å; S457-E459 PolarHBondContact OG-N 3.34Å; S457-E459 PolarHBondContact OG-O 2.96Å; S457-E459 VanDerWaalsContact OG-O 3.07Å; S457-A490 WeakPolarHBondContact O-CA 3.24Å; S457-G491 PolarHBondContact O-N 3.14Å; S457-G491 VanDerWaalsContact O-N 3.12Å
458	N	90.9	Very high	93.6	Very high	138 Å²	138	47.5 Å²	47.5	74%	0.738	23%	0.233	S	C	*	.	S	Bend	trans	-82.3	7.8	173.8	61.9	-48.3	0	0	0	113.7	A490	N458-A490 WeakPolarHBondContact O-CB 3.22Å
459	E	93.2	Very high	93.9	Very high	96 Å²	96	50.6 Å²	50.6	45%	0.449	25%	0.246	S	C	.	.	S	Bend	trans	-127.7	150.5	-178.3	-72.9	177.1	-138.9	0	0	111.3	R438 N455 S457	R438-E459 IonicContact CZ-OE2 3.56Å; R438-E459 VanDerWaalsContact NH1-CB 3.27Å; R438-E459 IonicContact NH1-OE2 2.77Å; R438-E459 PolarHBondContact NH1-OE2 2.91Å; R438-E459 VanDerWaalsContact NH2-CD 3.31Å; R438-E459 IonicContact NH2-OE1 3.93Å; R438-E459 PolarHBondContact NH2-OE1 2.86Å; R438-E459 IonicContact NH2-OE2 3.3Å; R438-E459 PolarHBondContact NH2-OE2 3.31Å; N455-E459 PolarHBondContact ND2-O 3.4Å; S457-E459 PolarHBondContact O-N 3.43Å; S457-E459 PolarHBondContact OG-N 3.34Å; S457-E459 PolarHBondContact OG-O 2.96Å; S457-E459 VanDerWaalsContact OG-O 3.07Å
460	D	95	Very high	94	Very high	84 Å²	84	46.4 Å²	46.4	45%	0.449	23%	0.228	S	C	.	.			trans	-68.4	133.3	177.2	-75.6	10.2	0	0	0	111.3	T487 K489 A490	D460-T487 HydrophobicContact CB-CG2 4.09Å; D460-K489 WeakPolarHBondContact OD1-CA 3.24Å; D460-K489 WeakPolarHBondContact OD1-CB 3.44Å; D460-A490 PolarHBondContact OD1-N 2.78Å
461	Q	94.3	Very high	93.9	Very high	36 Å²	36	49.6 Å²	49.6	17%	0.168	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118	176.6	179.3	64.8	68.9	0	0	110.2	V439 M463 W466 T487 L488	V439-Q461 HydrophobicContact CG2-CB 4.02Å; V439-Q461 HydrophobicContact CG2-CG 3.84Å; Q461-M463 HydrophobicContact CB-SD 4.5Å; Q461-M463 HydrophobicContact CG-CG 4.1Å; Q461-M463 HydrophobicContact CG-SD 3.59Å; Q461-M463 VanDerWaalsContact CG-SD 3.59Å; Q461-M463 PolarHBondContact O-N 3.2Å; Q461-W466 HydrophobicContact CG-CH2 3.98Å; Q461-W466 HydrophobicContact CG-CZ2 4.36Å; Q461-T487 CarbonylContact O-C 3.59Å; Q461-T487 WeakPolarHBondContact O-CA 3.28Å; Q461-T487 WeakPolarHBondContact O-CG2 3.1Å; Q461-L488 PolarHBondContact N-O 3.42Å; Q461-L488 PolarHBondContact O-N 2.9Å
462	S	94.4	Very high	93.6	Very high	70 Å²	70	50 Å²	50	49%	0.49	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.9	164.7	-177.4	0	0	0	0	109.7
463	M	93.8	Very high	93.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.249	C	C	.	.			trans	-119.2	12.6	-172	-65.5	-72.8	-66.7	0	0	111.5	V439 L453 Q461 N465 W466 F482 F486 L488 L529	V439-M463 HydrophobicContact CB-SD 4.44Å; V439-M463 HydrophobicContact CG1-CE 4.31Å; V439-M463 HydrophobicContact CG2-SD 3.87Å; L453-M463 HydrophobicContact CD1-CE 4.25Å; Q461-M463 HydrophobicContact CB-SD 4.5Å; Q461-M463 HydrophobicContact CG-CG 4.1Å; Q461-M463 HydrophobicContact CG-SD 3.59Å; Q461-M463 VanDerWaalsContact CG-SD 3.59Å; Q461-M463 PolarHBondContact O-N 3.2Å; M463-N465 PolarHBondContact O-N 2.94Å; M463-W466 HydrophobicContact CE-CB 4.46Å; M463-W466 HydrophobicContact CE-CD2 4.09Å; M463-W466 HydrophobicContact CE-CE3 3.45Å; M463-W466 VanDerWaalsContact CE-CE3 3.45Å; M463-W466 HydrophobicContact CE-CZ3 3.95Å; M463-W466 WeakPolarHBondContact O-CB 3.44Å; M463-W466 PolarHBondContact O-N 2.95Å; M463-W466 VanDerWaalsContact O-N 3.09Å; M463-W466 HydrophobicContact SD-CD2 3.82Å; M463-W466 HydrophobicContact SD-CE3 3.36Å; M463-W466 HydrophobicContact SD-CH2 3.98Å; M463-W466 HydrophobicContact SD-CZ2 4.4Å; M463-W466 HydrophobicContact SD-CZ3 3.43Å; M463-W466 WeakPolarHBondContact SD-CZ3 3.36Å; M463-F482 HydrophobicContact CE-CD2 4.3Å; M463-F482 HydrophobicContact CE-CE2 3.94Å; M463-F482 HydrophobicContact CE-CZ 4.29Å; M463-F482 WeakPolarHBondContact O-CB 3.34Å; M463-F486 CarbonylContact C-O 3.57Å; M463-F486 WeakPolarHBondContact CA-O 3.37Å; M463-F486 HydrophobicContact CB-CD1 3.73Å; M463-F486 HydrophobicContact CB-CE1 4.43Å; M463-F486 WeakPolarHBondContact CB-O 3.28Å; M463-F486 HydrophobicContact CG-CD1 4.29Å; M463-F486 PolarHBondContact N-O 3.15Å; M463-L488 HydrophobicContact CG-CB 4.03Å; M463-L529 HydrophobicContact CE-CD1 4.04Å; M463-L529 HydrophobicContact CE-CD2 4.25Å
464	G	91.1	Very high	92.2	Very high	10 Å²	10	56.8 Å²	56.8	10%	0.103	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	124.5	-173.7	0	0	0	0	0	112.9	W466 F486	G464-W466 PolarHBondContact O-N 2.89Å; G464-F486 PolarHBondContact N-O 3.46Å
465	N	91.4	Very high	91.7	Very high	66 Å²	66	56.4 Å²	56.4	35%	0.353	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	5.6	-177	-51.3	-72.5	0	0	0	116.6	M463 F482	M463-N465 PolarHBondContact O-N 2.94Å; N465-F482 WeakPolarHBondContact CA-O 3.41Å; N465-F482 PolarHBondContact N-O 3.37Å
466	W	96.3	Very high	91.3	Very high	22 Å²	22	61.7 Å²	61.7	8%	0.083	33%	0.332	C	S	.	.			trans	-61.9	156.9	172.4	-70.3	30.7	0	0	0	110.3	Q461 M463 G464 R481 F482 L529 I530 N531 V537	Q461-W466 HydrophobicContact CG-CH2 3.98Å; Q461-W466 HydrophobicContact CG-CZ2 4.36Å; M463-W466 HydrophobicContact CE-CB 4.46Å; M463-W466 HydrophobicContact CE-CD2 4.09Å; M463-W466 HydrophobicContact CE-CE3 3.45Å; M463-W466 VanDerWaalsContact CE-CE3 3.45Å; M463-W466 HydrophobicContact CE-CZ3 3.95Å; M463-W466 WeakPolarHBondContact O-CB 3.44Å; M463-W466 PolarHBondContact O-N 2.95Å; M463-W466 VanDerWaalsContact O-N 3.09Å; M463-W466 HydrophobicContact SD-CD2 3.82Å; M463-W466 HydrophobicContact SD-CE3 3.36Å; M463-W466 HydrophobicContact SD-CH2 3.98Å; M463-W466 HydrophobicContact SD-CZ2 4.4Å; M463-W466 HydrophobicContact SD-CZ3 3.43Å; M463-W466 WeakPolarHBondContact SD-CZ3 3.36Å; G464-W466 PolarHBondContact O-N 2.89Å; W466-R481 WeakPolarHBondContact O-CA 3.39Å; W466-F482 HydrophobicContact CB-CD2 4.02Å; W466-F482 WeakPolarHBondContact O-CD2 3.45Å; W466-F482 PolarHBondContact O-N 2.88Å; W466-L529 HydrophobicContact CE3-CD1 4.25Å; W466-L529 HydrophobicContact CE3-CD2 4.29Å; W466-L529 HydrophobicContact CE3-CG 4.18Å; W466-L529 HydrophobicContact CZ3-CD2 4.24Å; W466-I530 CarbonylContact C-O 3.56Å; W466-I530 WeakPolarHBondContact CA-O 3.37Å; W466-I530 WeakPolarHBondContact CB-O 3.42Å; W466-N531 HydrophobicContact CD2-CB 3.95Å; W466-N531 HydrophobicContact CE3-CB 4.3Å; W466-N531 HydrophobicContact CG-CB 4.47Å; W466-N531 HydrophobicContact CH2-CB 4.32Å; W466-N531 HydrophobicContact CZ2-CB 3.92Å; W466-N531 HydrophobicContact CZ3-CB 4.49Å; W466-V537 HydrophobicContact CE3-CG2 4.08Å; W466-V537 HydrophobicContact CH2-CG2 4.3Å; W466-V537 HydrophobicContact CZ3-CG2 3.62Å
467	Q	96	Very high	91.2	Very high	36 Å²	36	58.7 Å²	58.7	17%	0.168	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.6	-174.7	-69.5	168	44.6	0	0	111.6	K469 T479 Y480 R481 I530	Q467-K469 VanDerWaalsContact OE1-CE 3.22Å; Q467-T479 HydrophobicContact CB-CG2 4.35Å; Q467-T479 HydrophobicContact CG-CG2 4.33Å; Q467-Y480 CarbonylContact C-O 3.53Å; Q467-Y480 WeakPolarHBondContact CA-O 3.36Å; Q467-R481 HydrophobicContact CG-CB 4.27Å; Q467-R481 HydrophobicContact CG-CG 4.23Å; Q467-I530 HydrophobicContact CB-CB 4.45Å; Q467-I530 PolarHBondContact N-O 3.33Å; Q467-I530 PolarHBondContact O-N 3.45Å
468	I	96.2	Very high	91.3	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.2	163.9	-54.4	173.2	0	0	0	106.5	V451 L453 T479 Y480 F482 I496 W519 T527 A528 L529	V451-I468 HydrophobicContact CG1-CD1 4.16Å; V451-I468 HydrophobicContact CG1-CG2 4.23Å; L453-I468 HydrophobicContact CD1-CD1 4.02Å; L453-I468 HydrophobicContact CD1-CG1 4.38Å; L453-I468 HydrophobicContact CG-CD1 4.4Å; I468-T479 CarbonylContact O-C 3.59Å; I468-T479 WeakPolarHBondContact O-CA 3.35Å; I468-Y480 HydrophobicContact CD1-CD1 4.02Å; I468-Y480 HydrophobicContact CG1-CD1 4.29Å; I468-Y480 PolarHBondContact N-O 3.22Å; I468-Y480 PolarHBondContact O-N 3.33Å; I468-F482 HydrophobicContact CD1-CE2 3.97Å; I468-F482 HydrophobicContact CD1-CZ 3.97Å; I468-F482 HydrophobicContact CG1-CE2 3.86Å; I468-F482 HydrophobicContact CG1-CZ 4.38Å; I468-I496 HydrophobicContact CD1-CB 4.46Å; I468-I496 HydrophobicContact CD1-CD1 3.65Å; I468-I496 HydrophobicContact CD1-CG1 3.92Å; I468-W519 HydrophobicContact CB-CH2 3.91Å; I468-W519 HydrophobicContact CB-CZ3 4.32Å; I468-W519 HydrophobicContact CD1-CH2 4.17Å; I468-W519 HydrophobicContact CG2-CH2 3.72Å; I468-W519 HydrophobicContact CG2-CZ3 3.82Å; I468-T527 HydrophobicContact CG2-CG2 3.69Å; I468-A528 CarbonylContact C-O 3.58Å; I468-A528 WeakPolarHBondContact CA-O 3.12Å; I468-L529 HydrophobicContact CG1-CD1 4.09Å
469	K	94.9	Very high	91.6	Very high	64 Å²	64	55 Å²	55	28%	0.278	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.6	173.6	-61	-162.4	-176.4	173.6	0	110.1	Q467 L477 L478 T479 T527 A528 I530	Q467-K469 VanDerWaalsContact OE1-CE 3.22Å; K469-L477 HydrophobicContact CB-CD1 4.29Å; K469-L477 HydrophobicContact CB-CG 4.46Å; K469-L477 HydrophobicContact CD-CD2 3.96Å; K469-L478 CarbonylContact C-O 3.51Å; K469-L478 VanDerWaalsContact CA-O 3.32Å; K469-L478 WeakPolarHBondContact CA-O 3.31Å; K469-T479 HydrophobicContact CG-CG2 4.03Å; K469-T527 CarbonylContact O-C 3.57Å; K469-T527 WeakPolarHBondContact O-CA 3.27Å; K469-A528 PolarHBondContact N-O 2.98Å; K469-A528 PolarHBondContact O-N 2.9Å; K469-I530 HydrophobicContact CB-CD1 4.41Å; K469-I530 HydrophobicContact CD-CD1 3.64Å; K469-I530 HydrophobicContact CG-CD1 3.89Å
470	R	93.6	Very high	91.7	Very high	5 Å²	5	51.4 Å²	51.4	2%	0.019	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	125.8	-175.2	170.6	66.8	166.8	-147.9	-14.9	109.6	N472 L478 W519 G520 R526 T527	R470-N472 WeakPolarHBondContact CD-OD1 3.13Å; R470-N472 PolarHBondContact NE-OD1 3.48Å; R470-L478 HydrophobicContact CB-CB 4.18Å; R470-L478 PolarHBondContact N-O 2.87Å; R470-L478 PolarHBondContact O-N 2.84Å; R470-W519 HydrophobicContact CB-CE3 3.77Å; R470-W519 HydrophobicContact CB-CZ3 4.02Å; R470-W519 HydrophobicContact CG-CE3 4.08Å; R470-W519 WeakPolarHBondContact CG-O 3.32Å; R470-G520 PolarHBondContact NH2-O 3.09Å; R470-R526 WeakPolarHBondContact CA-O 3.37Å; R470-T527 WeakPolarHBondContact CD-OG1 3.31Å; R470-T527 PolarHBondContact NH1-OG1 3.09Å
471	Q	91.6	Very high	91.7	Very high	83 Å²	83	54.3 Å²	54.3	39%	0.388	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.8	176.8	-175.5	179.3	-0.8	0	0	109.1	G473 L477 R526	Q471-G473 WeakPolarHBondContact CG-O 3.36Å; Q471-G473 PolarHBondContact NE2-O 2.95Å; Q471-L477 HydrophobicContact CB-CD1 3.82Å; Q471-R526 PolarHBondContact N-O 3.49Å; Q471-R526 PolarHBondContact O-N 2.86Å
472	N	89.2	Confident	91.8	Very high	8 Å²	8	52.7 Å²	52.7	4%	0.043	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	96.6	-179.3	-49.6	-44.1	0	0	0	107.8	R470 D474 D475 W519 G520 L525	R470-N472 WeakPolarHBondContact CD-OD1 3.13Å; R470-N472 PolarHBondContact NE-OD1 3.48Å; N472-D474 PolarHBondContact O-N 3.34Å; N472-D474 VanDerWaalsContact O-N 3.08Å; N472-D475 HydrophobicContact CB-CB 4.16Å; N472-D475 VanDerWaalsContact O-CB 3.28Å; N472-D475 WeakPolarHBondContact O-CB 3.23Å; N472-D475 PolarHBondContact O-N 2.96Å; N472-W519 PolarHBondContact ND2-O 3.13Å; N472-G520 WeakPolarHBondContact ND2-CA 3.29Å; N472-L525 HydrophobicContact CB-CD2 3.92Å; N472-L525 WeakPolarHBondContact OD1-CD2 3.41Å
473	G	83.7	Confident	91.7	Very high	30 Å²	30	52.4 Å²	52.4	31%	0.309	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	-118.1	-167.3	0	0	0	0	0	111.8	Q471 S524	Q471-G473 WeakPolarHBondContact CG-O 3.36Å; Q471-G473 PolarHBondContact NE2-O 2.95Å; G473-S524 PolarHBondContact N-O 2.99Å
474	D	79	Confident	91.5	Very high	170 Å²	170	56.8 Å²	56.8	91%	0.909	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	6.5	-179	-55.1	-51.8	0	0	0	113.8	N472	N472-D474 PolarHBondContact O-N 3.34Å; N472-D474 VanDerWaalsContact O-N 3.08Å
475	D	83.9	Confident	91.5	Very high	87 Å²	87	65.7 Å²	65.7	47%	0.465	34%	0.344	S	S	.	.	S	Bend	trans	-62.6	151.4	177.1	-78.9	-24.2	0	0	0	113	N472 L477	N472-D475 HydrophobicContact CB-CB 4.16Å; N472-D475 VanDerWaalsContact O-CB 3.28Å; N472-D475 WeakPolarHBondContact O-CB 3.23Å; N472-D475 PolarHBondContact O-N 2.96Å; D475-L477 PolarHBondContact O-N 2.94Å
476	P	86.1	Confident	91.7	Very high	111 Å²	111	63.3 Å²	63.3	72%	0.721	33%	0.33	S	S	*	.			trans	-52.2	134.1	173.6	-27.4	35.5	0	0	0	114.2	L478	P476-L478 PolarHBondContact O-N 3.42Å
477	L	90.3	Very high	91.6	Very high	95 Å²	95	65 Å²	65	50%	0.497	34%	0.343	S	S	.	.			trans	-66.3	100.2	-172.3	-172.6	69.9	0	0	0	113.2	K469 Q471 D475 T479	K469-L477 HydrophobicContact CB-CD1 4.29Å; K469-L477 HydrophobicContact CB-CG 4.46Å; K469-L477 HydrophobicContact CD-CD2 3.96Å; Q471-L477 HydrophobicContact CB-CD1 3.82Å; D475-L477 PolarHBondContact O-N 2.94Å; L477-T479 PolarHBondContact O-N 3.3Å
478	L	93.3	Very high	91.6	Very high	27 Å²	27	63.3 Å²	63.3	14%	0.141	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	125.2	177.4	-67.9	177.9	0	0	0	110.7	K469 R470 P476 W513 Q516 W519	K469-L478 CarbonylContact C-O 3.51Å; K469-L478 VanDerWaalsContact CA-O 3.32Å; K469-L478 WeakPolarHBondContact CA-O 3.31Å; R470-L478 HydrophobicContact CB-CB 4.18Å; R470-L478 PolarHBondContact N-O 2.87Å; R470-L478 PolarHBondContact O-N 2.84Å; P476-L478 PolarHBondContact O-N 3.42Å; L478-W513 HydrophobicContact CB-CH2 3.92Å; L478-W513 HydrophobicContact CB-CZ3 4.21Å; L478-W513 HydrophobicContact CD2-CH2 4.36Å; L478-Q516 HydrophobicContact CD2-CG 4.3Å; L478-W519 VanDerWaalsContact CD1-O 3.29Å; L478-W519 WeakPolarHBondContact CD1-O 3.44Å
479	T	95.7	Very high	91.5	Very high	55 Å²	55	69.3 Å²	69.3	34%	0.337	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	110.9	-177.9	-59.9	0	0	0	0	112.4	Q467 I468 K469 L477 W513	Q467-T479 HydrophobicContact CB-CG2 4.35Å; Q467-T479 HydrophobicContact CG-CG2 4.33Å; I468-T479 CarbonylContact O-C 3.59Å; I468-T479 WeakPolarHBondContact O-CA 3.35Å; K469-T479 HydrophobicContact CG-CG2 4.03Å; L477-T479 PolarHBondContact O-N 3.3Å; T479-W513 WeakPolarHBondContact O-CZ2 3.42Å
480	Y	95.2	Very high	91.4	Very high	21 Å²	21	68.3 Å²	68.3	8%	0.082	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	150.7	167.9	176.4	-102.5	0	0	0	110.6	Q467 I468 F482 I496 L511 W513 W519	Q467-Y480 CarbonylContact C-O 3.53Å; Q467-Y480 WeakPolarHBondContact CA-O 3.36Å; I468-Y480 HydrophobicContact CD1-CD1 4.02Å; I468-Y480 HydrophobicContact CG1-CD1 4.29Å; I468-Y480 PolarHBondContact N-O 3.22Å; I468-Y480 PolarHBondContact O-N 3.33Å; Y480-F482 HydrophobicContact CD1-CE2 4.45Å; Y480-F482 AromaticContact CE1-CD1 3.93Å; Y480-F482 HydrophobicContact CE1-CD1 3.93Å; Y480-F482 HydrophobicContact CE1-CD2 4.28Å; Y480-F482 AromaticContact CE1-CE1 3.97Å; Y480-F482 HydrophobicContact CE1-CE1 3.97Å; Y480-F482 HydrophobicContact CE1-CE2 4.3Å; Y480-F482 HydrophobicContact CE1-CG 4.09Å; Y480-F482 HydrophobicContact CE1-CZ 4.14Å; Y480-I496 HydrophobicContact CD1-CG2 4.07Å; Y480-I496 HydrophobicContact CD2-CG2 4.13Å; Y480-I496 HydrophobicContact CE1-CG1 4.18Å; Y480-I496 HydrophobicContact CE1-CG2 3.92Å; Y480-I496 HydrophobicContact CE2-CG2 3.97Å; Y480-I496 HydrophobicContact CG-CG2 4.18Å; Y480-L511 WeakPolarHBondContact OH-CD1 3.48Å; Y480-W513 HydrophobicContact CD2-CB 3.91Å; Y480-W513 AromaticContact CD2-CD1 3.66Å; Y480-W513 AromaticContact CD2-CD2 3.91Å; Y480-W513 HydrophobicContact CD2-CD2 3.91Å; Y480-W513 AromaticContact CD2-CG 3.56Å; Y480-W513 HydrophobicContact CD2-CG 3.56Å; Y480-W513 HydrophobicContact CE2-CB 4.16Å; Y480-W513 HydrophobicContact CE2-CG 4.19Å; Y480-W519 HydrophobicContact CG-CH2 4.33Å
481	R	95.5	Very high	91.3	Very high	144 Å²	144	70.3 Å²	70.3	54%	0.543	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	132.5	174.9	-175	-175.4	-69.6	-135.2	1	111	W466 Q467	W466-R481 WeakPolarHBondContact O-CA 3.39Å; Q467-R481 HydrophobicContact CG-CB 4.27Å; Q467-R481 HydrophobicContact CG-CG 4.23Å
482	F	95.8	Very high	91.4	Very high	2 Å²	2	68 Å²	68	1%	0.009	38%	0.377	C	S	.	.			trans	-72.3	144.3	175.7	-76	-80	0	0	0	112.6	L453 M463 N465 W466 I468 Y480 F486 I496 L511 L529	L453-F482 HydrophobicContact CD1-CE2 3.96Å; L453-F482 HydrophobicContact CD1-CZ 3.64Å; M463-F482 HydrophobicContact CE-CD2 4.3Å; M463-F482 HydrophobicContact CE-CE2 3.94Å; M463-F482 HydrophobicContact CE-CZ 4.29Å; M463-F482 WeakPolarHBondContact O-CB 3.34Å; N465-F482 WeakPolarHBondContact CA-O 3.41Å; N465-F482 PolarHBondContact N-O 3.37Å; W466-F482 HydrophobicContact CB-CD2 4.02Å; W466-F482 WeakPolarHBondContact O-CD2 3.45Å; W466-F482 PolarHBondContact O-N 2.88Å; I468-F482 HydrophobicContact CD1-CE2 3.97Å; I468-F482 HydrophobicContact CD1-CZ 3.97Å; I468-F482 HydrophobicContact CG1-CE2 3.86Å; I468-F482 HydrophobicContact CG1-CZ 4.38Å; Y480-F482 HydrophobicContact CD1-CE2 4.45Å; Y480-F482 AromaticContact CE1-CD1 3.93Å; Y480-F482 HydrophobicContact CE1-CD1 3.93Å; Y480-F482 HydrophobicContact CE1-CD2 4.28Å; Y480-F482 AromaticContact CE1-CE1 3.97Å; Y480-F482 HydrophobicContact CE1-CE1 3.97Å; Y480-F482 HydrophobicContact CE1-CE2 4.3Å; Y480-F482 HydrophobicContact CE1-CG 4.09Å; Y480-F482 HydrophobicContact CE1-CZ 4.14Å; F482-F486 HydrophobicContact CB-CB 4.4Å; F482-F486 HydrophobicContact CB-CD1 4.41Å; F482-F486 HydrophobicContact CD1-CB 4.49Å; F482-F486 AromaticContact CD1-CD1 3.25Å; F482-F486 HydrophobicContact CD1-CD1 3.25Å; F482-F486 AromaticContact CD1-CE1 3.62Å; F482-F486 HydrophobicContact CD1-CE1 3.62Å; F482-F486 AromaticContact CD1-CG 3.97Å; F482-F486 HydrophobicContact CD1-CG 3.97Å; F482-F486 AromaticContact CE1-CD1 3.7Å; F482-F486 HydrophobicContact CE1-CD1 3.7Å; F482-F486 AromaticContact CE1-CE1 3.53Å; F482-F486 HydrophobicContact CE1-CE1 3.53Å; F482-F486 HydrophobicContact CE1-CZ 4.36Å; F482-F486 HydrophobicContact CG-CD1 4.04Å; F482-I496 HydrophobicContact CE1-CG1 4.35Å; F482-I496 HydrophobicContact CZ-CD1 4.08Å; F482-I496 HydrophobicContact CZ-CG1 4.23Å; F482-L511 HydrophobicContact CD1-CD1 3.85Å; F482-L511 HydrophobicContact CE1-CD1 3.63Å; F482-L529 HydrophobicContact CE2-CD1 4.19Å
483	P	93.2	Very high	91.7	Very high	65 Å²	65	69.5 Å²	69.5	42%	0.422	39%	0.386	S	S	.	.			trans	-54.8	146.3	173.7	-26.1	34.5	0	0	0	112.8	K485 F486	P483-K485 PolarHBondContact O-N 2.76Å; P483-F486 HydrophobicContact CB-CB 4.43Å; P483-F486 WeakPolarHBondContact O-CB 3.19Å; P483-F486 PolarHBondContact O-N 3.05Å
484	P	90.4	Very high	92.3	Very high	91 Å²	91	68.1 Å²	68.1	59%	0.591	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-17	-173.5	-26.7	34.3	0	0	0	116.5
485	K	90.6	Very high	93.1	Very high	197 Å²	197	60.5 Å²	60.5	86%	0.857	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	18.7	179.3	-60.8	-173.4	178.3	-176.6	0	113.3	P483	P483-K485 PolarHBondContact O-N 2.76Å
486	F	94.6	Very high	93.7	Very high	16 Å²	16	56.3 Å²	56.3	7%	0.07	31%	0.309	C	S	.	.			trans	-77.1	130.8	178.3	-171.9	-109.7	0	0	0	111.2	M463 G464 F482 P483 L488 V494 P508 L511	M463-F486 CarbonylContact C-O 3.57Å; M463-F486 WeakPolarHBondContact CA-O 3.37Å; M463-F486 HydrophobicContact CB-CD1 3.73Å; M463-F486 HydrophobicContact CB-CE1 4.43Å; M463-F486 WeakPolarHBondContact CB-O 3.28Å; M463-F486 HydrophobicContact CG-CD1 4.29Å; M463-F486 PolarHBondContact N-O 3.15Å; G464-F486 PolarHBondContact N-O 3.46Å; F482-F486 HydrophobicContact CB-CB 4.4Å; F482-F486 HydrophobicContact CB-CD1 4.41Å; F482-F486 HydrophobicContact CD1-CB 4.49Å; F482-F486 AromaticContact CD1-CD1 3.25Å; F482-F486 HydrophobicContact CD1-CD1 3.25Å; F482-F486 AromaticContact CD1-CE1 3.62Å; F482-F486 HydrophobicContact CD1-CE1 3.62Å; F482-F486 AromaticContact CD1-CG 3.97Å; F482-F486 HydrophobicContact CD1-CG 3.97Å; F482-F486 AromaticContact CE1-CD1 3.7Å; F482-F486 HydrophobicContact CE1-CD1 3.7Å; F482-F486 AromaticContact CE1-CE1 3.53Å; F482-F486 HydrophobicContact CE1-CE1 3.53Å; F482-F486 HydrophobicContact CE1-CZ 4.36Å; F482-F486 HydrophobicContact CG-CD1 4.04Å; P483-F486 HydrophobicContact CB-CB 4.43Å; P483-F486 WeakPolarHBondContact O-CB 3.19Å; P483-F486 PolarHBondContact O-N 3.05Å; F486-L488 HydrophobicContact CE1-CB 4.39Å; F486-V494 HydrophobicContact CE1-CG1 4.38Å; F486-V494 HydrophobicContact CZ-CB 4.24Å; F486-V494 HydrophobicContact CZ-CG1 4.4Å; F486-V494 HydrophobicContact CZ-CG2 3.93Å; F486-P508 HydrophobicContact CE2-CB 3.84Å; F486-P508 HydrophobicContact CZ-CB 4.47Å; F486-L511 HydrophobicContact CD2-CD1 4.49Å; F486-L511 HydrophobicContact CE1-CD1 4.36Å; F486-L511 HydrophobicContact CE2-CD1 4.07Å; F486-L511 HydrophobicContact CE2-CD2 4.36Å; F486-L511 HydrophobicContact CZ-CD1 4.02Å
487	T	94.7	Very high	94.2	Very high	58 Å²	58	53.6 Å²	53.6	36%	0.356	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.9	177.5	-61.6	0	0	0	0	108.3	D460 Q461	D460-T487 HydrophobicContact CB-CG2 4.09Å; Q461-T487 CarbonylContact O-C 3.59Å; Q461-T487 WeakPolarHBondContact O-CA 3.28Å; Q461-T487 WeakPolarHBondContact O-CG2 3.1Å
488	L	95.4	Very high	94.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.5	177.2	-174	64.7	0	0	0	108.9	V439 N455 Q461 M463 F486 Q492 V494	V439-L488 HydrophobicContact CG1-CD2 4.01Å; V439-L488 HydrophobicContact CG2-CD2 4.09Å; N455-L488 HydrophobicContact CB-CD2 3.98Å; N455-L488 HydrophobicContact CB-CG 4.02Å; N455-L488 PolarHBondContact ND2-O 3.5Å; N455-L488 VanDerWaalsContact ND2-O 3.07Å; Q461-L488 PolarHBondContact N-O 3.42Å; Q461-L488 PolarHBondContact O-N 2.9Å; M463-L488 HydrophobicContact CG-CB 4.03Å; F486-L488 HydrophobicContact CE1-CB 4.39Å; L488-Q492 HydrophobicContact CD1-CB 3.85Å; L488-Q492 HydrophobicContact CD1-CG 3.79Å; L488-Q492 HydrophobicContact CG-CB 4.29Å; L488-V494 HydrophobicContact CD1-CB 3.86Å; L488-V494 HydrophobicContact CD1-CG1 3.76Å; L488-V494 HydrophobicContact CD2-CG1 3.92Å; L488-V494 HydrophobicContact CG-CG1 4.47Å
489	K	94.4	Very high	94.3	Very high	126 Å²	126	49.5 Å²	49.5	55%	0.548	27%	0.268	S	S	.	.			trans	-66.8	163.7	-172.1	-63.4	-166.1	170.7	-171.1	0	113.4	N455 D460 G491 Q492	N455-K489 VanDerWaalsContact CB-O 3.28Å; N455-K489 WeakPolarHBondContact CB-O 3.47Å; N455-K489 PolarHBondContact ND2-O 2.86Å; D460-K489 WeakPolarHBondContact OD1-CA 3.24Å; D460-K489 WeakPolarHBondContact OD1-CB 3.44Å; K489-G491 PolarHBondContact O-N 2.92Å; K489-Q492 HydrophobicContact CB-CB 4.02Å; K489-Q492 VanDerWaalsContact CB-OE1 3.3Å; K489-Q492 WeakPolarHBondContact O-CB 3.42Å; K489-Q492 PolarHBondContact O-N 3.14Å
490	A	93.5	Very high	93.9	Very high	44 Å²	44	49.6 Å²	49.6	36%	0.364	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	130.2	169.9	0	0	0	0	0	111.5	S457 N458 D460 Q492	S457-A490 WeakPolarHBondContact O-CA 3.24Å; N458-A490 WeakPolarHBondContact O-CB 3.22Å; D460-A490 PolarHBondContact OD1-N 2.78Å; A490-Q492 PolarHBondContact O-N 2.88Å
491	G	90.9	Very high	93.6	Very high	47 Å²	47	50.2 Å²	50.2	49%	0.485	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	-5	-177.2	0	0	0	0	0	116.9	N455 S457 K489	N455-G491 CarbonylContact O-C 3.57Å; N455-G491 WeakPolarHBondContact O-CA 3.25Å; N455-G491 PolarHBondContact O-N 3.36Å; S457-G491 PolarHBondContact O-N 3.14Å; S457-G491 VanDerWaalsContact O-N 3.12Å; K489-G491 PolarHBondContact O-N 2.92Å
492	Q	94.3	Very high	93.1	Very high	34 Å²	34	46.8 Å²	46.8	16%	0.159	30%	0.299	C	S	.	.			trans	-76.7	144.8	-169.4	-168.6	-178.7	3	0	0	112.9	R454 N455 L488 K489 A490	R454-Q492 WeakPolarHBondContact CA-O 3.22Å; N455-Q492 PolarHBondContact N-O 3.12Å; L488-Q492 HydrophobicContact CD1-CB 3.85Å; L488-Q492 HydrophobicContact CD1-CG 3.79Å; L488-Q492 HydrophobicContact CG-CB 4.29Å; K489-Q492 HydrophobicContact CB-CB 4.02Å; K489-Q492 VanDerWaalsContact CB-OE1 3.3Å; K489-Q492 WeakPolarHBondContact O-CB 3.42Å; K489-Q492 PolarHBondContact O-N 3.14Å; A490-Q492 PolarHBondContact O-N 2.88Å
493	V	95.5	Very high	92.8	Very high	40 Å²	40	48.1 Å²	48.1	24%	0.242	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	141.8	171.3	179.9	0	0	0	0	110.4	R452 L453 R454	R452-V493 HydrophobicContact CG-CG1 3.47Å; R452-V493 VanDerWaalsContact CG-CG1 3.47Å; L453-V493 CarbonylContact O-C 3.49Å; L453-V493 WeakPolarHBondContact O-CA 3.19Å; R454-V493 HydrophobicContact CB-CG2 4.12Å; R454-V493 HydrophobicContact CG-CG2 3.85Å
494	V	96.4	Very high	92.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.2	166.4	56.8	0	0	0	0	109.9	R452 L453 F486 L488 I496 P508 T509 L511	R452-V494 WeakPolarHBondContact CA-O 3.37Å; L453-V494 HydrophobicContact CB-CG1 3.93Å; L453-V494 PolarHBondContact N-O 3.06Å; L453-V494 PolarHBondContact O-N 3.13Å; F486-V494 HydrophobicContact CE1-CG1 4.38Å; F486-V494 HydrophobicContact CZ-CB 4.24Å; F486-V494 HydrophobicContact CZ-CG1 4.4Å; F486-V494 HydrophobicContact CZ-CG2 3.93Å; L488-V494 HydrophobicContact CD1-CB 3.86Å; L488-V494 HydrophobicContact CD1-CG1 3.76Å; L488-V494 HydrophobicContact CD2-CG1 3.92Å; L488-V494 HydrophobicContact CG-CG1 4.47Å; V494-I496 HydrophobicContact CG1-CD1 4.26Å; V494-I496 HydrophobicContact CG2-CD1 4.25Å; V494-I496 HydrophobicContact CG2-CG1 4.49Å; V494-P508 WeakPolarHBondContact CG2-O 3.39Å; V494-T509 CarbonylContact C-O 3.33Å; V494-T509 WeakPolarHBondContact CA-O 3.3Å; V494-T509 WeakPolarHBondContact CG2-O 3.49Å; V494-L511 HydrophobicContact CG2-CD1 3.82Å; V494-L511 HydrophobicContact CG2-CG 3.81Å
495	T	96.4	Very high	92.7	Very high	10 Å²	10	50.6 Å²	50.6	6%	0.061	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.4	172.5	-53.5	0	0	0	0	109.1	F450 R452 W497 T509 L511	F450-T495 HydrophobicContact CB-CG2 3.61Å; F450-T495 HydrophobicContact CD2-CG2 3.64Å; F450-T495 HydrophobicContact CG-CG2 3.73Å; R452-T495 PolarHBondContact NE-OG1 2.64Å; T495-W497 HydrophobicContact CG2-CD2 3.94Å; T495-W497 VanDerWaalsContact CG2-CE2 3.48Å; T495-W497 HydrophobicContact CG2-CG 4.23Å; T495-W497 HydrophobicContact CG2-CZ2 3.85Å; T495-T509 PolarHBondContact N-O 3.48Å; T495-L511 PolarHBondContact O-N 3.47Å
496	I	96.6	Very high	92.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	98.1	177.2	-49.9	81.7	0	0	0	107.5	F450 V451 L453 I468 Y480 F482 V494 L511 W519	F450-I496 WeakPolarHBondContact CA-O 3.47Å; V451-I496 PolarHBondContact N-O 3.3Å; V451-I496 WeakPolarHBondContact O-CD1 3.46Å; V451-I496 PolarHBondContact O-N 3.33Å; L453-I496 HydrophobicContact CD1-CD1 4.3Å; L453-I496 HydrophobicContact CG-CD1 4.05Å; I468-I496 HydrophobicContact CD1-CB 4.46Å; I468-I496 HydrophobicContact CD1-CD1 3.65Å; I468-I496 HydrophobicContact CD1-CG1 3.92Å; Y480-I496 HydrophobicContact CD1-CG2 4.07Å; Y480-I496 HydrophobicContact CD2-CG2 4.13Å; Y480-I496 HydrophobicContact CE1-CG1 4.18Å; Y480-I496 HydrophobicContact CE1-CG2 3.92Å; Y480-I496 HydrophobicContact CE2-CG2 3.97Å; Y480-I496 HydrophobicContact CG-CG2 4.18Å; F482-I496 HydrophobicContact CE1-CG1 4.35Å; F482-I496 HydrophobicContact CZ-CD1 4.08Å; F482-I496 HydrophobicContact CZ-CG1 4.23Å; V494-I496 HydrophobicContact CG1-CD1 4.26Å; V494-I496 HydrophobicContact CG2-CD1 4.25Å; V494-I496 HydrophobicContact CG2-CG1 4.49Å; I496-L511 CarbonylContact C-O 3.51Å; I496-L511 VanDerWaalsContact CA-O 3.32Å; I496-L511 WeakPolarHBondContact CA-O 3.42Å; I496-L511 HydrophobicContact CG1-CB 4.35Å; I496-L511 HydrophobicContact CG1-CD1 4.45Å; I496-L511 HydrophobicContact CG2-CB 4.35Å; I496-W519 HydrophobicContact CB-CZ2 4Å; I496-W519 HydrophobicContact CG2-CZ2 3.74Å; I496-W519 PolarHBondContact O-NE1 3.45Å
497	W	96.1	Very high	92.4	Very high	54 Å²	54	47 Å²	47	21%	0.205	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	142.5	-179.1	-60.1	94.5	0	0	0	111.1	F450 T495 A501 A503 D510 L511 V512 W513	F450-W497 HydrophobicContact CB-CD2 4.05Å; F450-W497 HydrophobicContact CB-CE3 3.77Å; F450-W497 HydrophobicContact CB-CZ3 4.21Å; F450-W497 AromaticContact CD1-CE3 3.96Å; F450-W497 HydrophobicContact CD1-CE3 3.96Å; F450-W497 AromaticContact CD1-CH2 4Å; F450-W497 HydrophobicContact CD1-CH2 4Å; F450-W497 AromaticContact CD1-CZ3 3.51Å; F450-W497 HydrophobicContact CD1-CZ3 3.51Å; F450-W497 HydrophobicContact CE1-CH2 4.45Å; F450-W497 HydrophobicContact CE1-CZ3 4.26Å; F450-W497 HydrophobicContact CG-CE3 4.21Å; F450-W497 HydrophobicContact CG-CZ3 4.14Å; T495-W497 HydrophobicContact CG2-CD2 3.94Å; T495-W497 VanDerWaalsContact CG2-CE2 3.48Å; T495-W497 HydrophobicContact CG2-CG 4.23Å; T495-W497 HydrophobicContact CG2-CZ2 3.85Å; W497-A501 HydrophobicContact CE3-CB 3.95Å; W497-A503 HydrophobicContact CB-CB 3.81Å; W497-A503 HydrophobicContact CD2-CB 3.4Å; W497-A503 HydrophobicContact CE3-CB 3.85Å; W497-A503 HydrophobicContact CG-CB 3.38Å; W497-D510 PolarHBondContact NE1-OD1 3.42Å; W497-L511 PolarHBondContact N-O 3.49Å; W497-V512 HydrophobicContact CB-CG2 4.4Å; W497-W513 PolarHBondContact O-N 3.01Å
498	A	94.1	Very high	92	Very high	0 Å²	0	47 Å²	47	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	154.9	166.1	0	0	0	0	0	110.7	K449 G500 A501 N517 T518	K449-A498 PolarHBondContact O-N 3.28Å; A498-G500 VanDerWaalsContact C-N 3.25Å; A498-G500 PolarHBondContact O-N 3.03Å; A498-A501 WeakPolarHBondContact O-CB 3.48Å; A498-A501 PolarHBondContact O-N 3.48Å; A498-N517 WeakPolarHBondContact CB-O 3.42Å; A498-T518 VanDerWaalsContact CB-CA 3.46Å
499	A	91.9	Very high	91.8	Very high	36 Å²	36	49.7 Å²	49.7	30%	0.298	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-61.4	-31.7	-176	0	0	0	0	0	113.5	A501 Q516	A499-A501 VanDerWaalsContact C-N 3.28Å; A499-A501 PolarHBondContact O-N 3.42Å; A499-Q516 WeakPolarHBondContact CB-O 3.29Å; A499-Q516 PolarHBondContact N-O 3.12Å
500	G	87.2	Confident	91.8	Very high	57 Å²	57	45.7 Å²	45.7	59%	0.588	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-76.6	-8	177	0	0	0	0	0	114.6	A498 G502 N517	A498-G500 VanDerWaalsContact C-N 3.25Å; A498-G500 PolarHBondContact O-N 3.03Å; G500-G502 VanDerWaalsContact C-N 3.27Å; G500-G502 PolarHBondContact O-N 3.06Å; G500-N517 VanDerWaalsContact CA-O 3.27Å; G500-N517 WeakPolarHBondContact CA-O 3.38Å; G500-N517 PolarHBondContact N-O 2.79Å
501	A	88.1	Confident	91.9	Very high	33 Å²	33	43.8 Å²	43.8	27%	0.273	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-80.2	-4	179.1	0	0	0	0	0	113.9	K449 W497 A498 A499 A503	K449-A501 HydrophobicContact CB-CB 4.02Å; K449-A501 HydrophobicContact CG-CB 4.38Å; W497-A501 HydrophobicContact CE3-CB 3.95Å; A498-A501 WeakPolarHBondContact O-CB 3.48Å; A498-A501 PolarHBondContact O-N 3.48Å; A499-A501 VanDerWaalsContact C-N 3.28Å; A499-A501 PolarHBondContact O-N 3.42Å; A501-A503 PolarHBondContact O-N 2.96Å
502	G	85.4	Confident	92.1	Very high	73 Å²	73	42.6 Å²	42.6	75%	0.753	29%	0.285	S	S	*	.			trans	71.3	5.2	174.3	0	0	0	0	0	116.2	G500	G500-G502 VanDerWaalsContact C-N 3.27Å; G500-G502 PolarHBondContact O-N 3.06Å
503	A	88.7	Confident	92.1	Very high	30 Å²	30	42.2 Å²	42.2	25%	0.248	28%	0.283	C	S	.	.			trans	-74	144.8	-176.8	0	0	0	0	0	113.5	W497 A501 V512	W497-A503 HydrophobicContact CB-CB 3.81Å; W497-A503 HydrophobicContact CD2-CB 3.4Å; W497-A503 HydrophobicContact CE3-CB 3.85Å; W497-A503 HydrophobicContact CG-CB 3.38Å; A501-A503 PolarHBondContact O-N 2.96Å; A503-V512 WeakPolarHBondContact O-CG2 3.46Å
504	T	89.4	Confident	91.8	Very high	121 Å²	121	48.1 Å²	48.1	74%	0.742	31%	0.305	S	S	*	.			trans	-75.3	136	175.6	-56.5	0	0	0	0	111.2	S506	T504-S506 PolarHBondContact O-N 3.18Å
505	H	92.1	Very high	91.5	Very high	87 Å²	87	51.9 Å²	51.9	40%	0.403	34%	0.336	S	S	.	.			trans	-78.1	107.1	176.6	-171.1	31	0	0	0	111.4	P507 D510 V512	H505-P507 VanDerWaalsContact CE1-CG 3.47Å; H505-P507 WeakPolarHBondContact CE1-CG 3.22Å; H505-D510 PolarHBondContact ND1-O 3.06Å; H505-V512 HydrophobicContact CB-CB 4.12Å; H505-V512 HydrophobicContact CB-CG2 3.76Å; H505-V512 PolarHBondContact ND1-N 2.99Å
506	S	91.5	Very high	91.1	Very high	62 Å²	62	55.2 Å²	55.2	43%	0.434	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-131.8	79.1	179.5	-179.1	0	0	0	0	111.4	T504 T509 D510	T504-S506 PolarHBondContact O-N 3.18Å; S506-T509 PolarHBondContact O-N 3.25Å; S506-T509 PolarHBondContact O-OG1 2.92Å; S506-D510 CarbonylContact C-O 3.5Å; S506-D510 PolarHBondContact N-O 3.32Å; S506-D510 PolarHBondContact O-N 2.95Å
507	P	88.2	Confident	90.8	Very high	75 Å²	75	60.9 Å²	60.9	49%	0.487	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	145.4	172.1	-20.4	32.3	0	0	0	111.7	H505 L511	H505-P507 VanDerWaalsContact CE1-CG 3.47Å; H505-P507 WeakPolarHBondContact CE1-CG 3.22Å; P507-L511 HydrophobicContact CB-CD2 3.96Å; P507-L511 HydrophobicContact CG-CD2 4.02Å
508	P	86.6	Confident	90.5	Very high	59 Å²	59	61.2 Å²	61.2	38%	0.383	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.3	-6	5	33.8	-36.2	0	0	0	115.7	F486 V494	F486-P508 HydrophobicContact CE2-CB 3.84Å; F486-P508 HydrophobicContact CZ-CB 4.47Å; V494-P508 WeakPolarHBondContact CG2-O 3.39Å
509	T	90.7	Very high	90.3	Very high	55 Å²	55	61.2 Å²	61.2	34%	0.337	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-36.6	-174.3	55.4	0	0	0	0	113.4	V494 T495 S506	V494-T509 CarbonylContact C-O 3.33Å; V494-T509 WeakPolarHBondContact CA-O 3.3Å; V494-T509 WeakPolarHBondContact CG2-O 3.49Å; T495-T509 PolarHBondContact N-O 3.48Å; S506-T509 PolarHBondContact O-N 3.25Å; S506-T509 PolarHBondContact O-OG1 2.92Å
510	D	94.1	Very high	90	Very high	42 Å²	42	60 Å²	60	23%	0.225	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	100.8	-168.9	-66.3	-83.7	0	0	0	111.6	W497 H505 S506	W497-D510 PolarHBondContact NE1-OD1 3.42Å; H505-D510 PolarHBondContact ND1-O 3.06Å; S506-D510 CarbonylContact C-O 3.5Å; S506-D510 PolarHBondContact N-O 3.32Å; S506-D510 PolarHBondContact O-N 2.95Å
511	L	94.9	Very high	89.8	Confident	4 Å²	4	61 Å²	61	2%	0.021	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	132	-179.9	-53.4	-177	0	0	0	109.2	Y480 F482 F486 V494 T495 I496 W497 P507	Y480-L511 WeakPolarHBondContact OH-CD1 3.48Å; F482-L511 HydrophobicContact CD1-CD1 3.85Å; F482-L511 HydrophobicContact CE1-CD1 3.63Å; F486-L511 HydrophobicContact CD2-CD1 4.49Å; F486-L511 HydrophobicContact CE1-CD1 4.36Å; F486-L511 HydrophobicContact CE2-CD1 4.07Å; F486-L511 HydrophobicContact CE2-CD2 4.36Å; F486-L511 HydrophobicContact CZ-CD1 4.02Å; V494-L511 HydrophobicContact CG2-CD1 3.82Å; V494-L511 HydrophobicContact CG2-CG 3.81Å; T495-L511 PolarHBondContact O-N 3.47Å; I496-L511 CarbonylContact C-O 3.51Å; I496-L511 VanDerWaalsContact CA-O 3.32Å; I496-L511 WeakPolarHBondContact CA-O 3.42Å; I496-L511 HydrophobicContact CG1-CB 4.35Å; I496-L511 HydrophobicContact CG1-CD1 4.45Å; I496-L511 HydrophobicContact CG2-CB 4.35Å; W497-L511 PolarHBondContact N-O 3.49Å; P507-L511 HydrophobicContact CB-CD2 3.96Å; P507-L511 HydrophobicContact CG-CD2 4.02Å
512	V	95.1	Very high	89.4	Confident	22 Å²	22	61.2 Å²	61.2	13%	0.133	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.8	177.9	178.4	0	0	0	0	109.1	W497 A503 H505 K514	W497-V512 HydrophobicContact CB-CG2 4.4Å; A503-V512 WeakPolarHBondContact O-CG2 3.46Å; H505-V512 HydrophobicContact CB-CB 4.12Å; H505-V512 HydrophobicContact CB-CG2 3.76Å; H505-V512 PolarHBondContact ND1-N 2.99Å; V512-K514 VanDerWaalsContact C-N 3.28Å; V512-K514 HydrophobicContact CG1-CG 4.24Å; V512-K514 PolarHBondContact O-N 3.28Å
513	W	94.6	Very high	89.2	Confident	27 Å²	27	63.1 Å²	63.1	10%	0.102	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	77	176.3	-171.4	15	0	0	0	110.5	L478 T479 Y480 W497 A515 Q516 W519	L478-W513 HydrophobicContact CB-CH2 3.92Å; L478-W513 HydrophobicContact CB-CZ3 4.21Å; L478-W513 HydrophobicContact CD2-CH2 4.36Å; T479-W513 WeakPolarHBondContact O-CZ2 3.42Å; Y480-W513 HydrophobicContact CD2-CB 3.91Å; Y480-W513 AromaticContact CD2-CD1 3.66Å; Y480-W513 AromaticContact CD2-CD2 3.91Å; Y480-W513 HydrophobicContact CD2-CD2 3.91Å; Y480-W513 AromaticContact CD2-CG 3.56Å; Y480-W513 HydrophobicContact CD2-CG 3.56Å; Y480-W513 HydrophobicContact CE2-CB 4.16Å; Y480-W513 HydrophobicContact CE2-CG 4.19Å; W497-W513 PolarHBondContact O-N 3.01Å; W513-A515 PolarHBondContact O-N 3.3Å; W513-Q516 HydrophobicContact CD2-CB 3.83Å; W513-Q516 HydrophobicContact CD2-CG 4.06Å; W513-Q516 HydrophobicContact CE3-CB 3.83Å; W513-Q516 HydrophobicContact CE3-CG 4.15Å; W513-Q516 HydrophobicContact CG-CB 4.44Å; W513-Q516 HydrophobicContact CH2-CB 4.2Å; W513-Q516 HydrophobicContact CH2-CG 3.61Å; W513-Q516 HydrophobicContact CZ2-CB 4.2Å; W513-Q516 HydrophobicContact CZ2-CG 3.48Å; W513-Q516 VanDerWaalsContact CZ2-CG 3.48Å; W513-Q516 HydrophobicContact CZ3-CB 4Å; W513-Q516 HydrophobicContact CZ3-CG 3.94Å; W513-Q516 PolarHBondContact O-N 3.02Å; W513-Q516 VanDerWaalsContact O-O 3.12Å; W513-W519 HydrophobicContact CE3-CD2 4.19Å; W513-W519 HydrophobicContact CE3-CE3 4.22Å; W513-W519 AromaticContact CE3-CH2 3.98Å; W513-W519 HydrophobicContact CE3-CH2 3.98Å; W513-W519 AromaticContact CE3-CZ2 3.92Å; W513-W519 HydrophobicContact CE3-CZ2 3.92Å; W513-W519 HydrophobicContact CE3-CZ3 4.12Å; W513-W519 HydrophobicContact CZ3-CD2 4.11Å; W513-W519 AromaticContact CZ3-CE3 3.73Å; W513-W519 HydrophobicContact CZ3-CE3 3.73Å; W513-W519 AromaticContact CZ3-CH2 3.96Å; W513-W519 HydrophobicContact CZ3-CH2 3.96Å; W513-W519 HydrophobicContact CZ3-CZ2 4.3Å; W513-W519 AromaticContact CZ3-CZ3 3.65Å; W513-W519 HydrophobicContact CZ3-CZ3 3.65Å
514	K	90	Very high	89.1	Confident	164 Å²	164	63.8 Å²	63.8	71%	0.713	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-8.9	-176.8	-61.7	-173.7	179.4	-174.8	0	116.3	V512	V512-K514 VanDerWaalsContact C-N 3.28Å; V512-K514 HydrophobicContact CG1-CG 4.24Å; V512-K514 PolarHBondContact O-N 3.28Å
515	A	88.9	Confident	89.1	Confident	78 Å²	78	58.2 Å²	58.2	65%	0.645	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-2.2	-178.4	0	0	0	0	0	114	W513	W513-A515 PolarHBondContact O-N 3.3Å
516	Q	89.2	Confident	89.2	Confident	81 Å²	81	58 Å²	58	38%	0.379	34%	0.339	S	S	.	.			trans	-141.4	134.8	175.4	-74	-63.4	-5.3	0	0	111.7	L478 A499 W513	L478-Q516 HydrophobicContact CD2-CG 4.3Å; A499-Q516 WeakPolarHBondContact CB-O 3.29Å; A499-Q516 PolarHBondContact N-O 3.12Å; W513-Q516 HydrophobicContact CD2-CB 3.83Å; W513-Q516 HydrophobicContact CD2-CG 4.06Å; W513-Q516 HydrophobicContact CE3-CB 3.83Å; W513-Q516 HydrophobicContact CE3-CG 4.15Å; W513-Q516 HydrophobicContact CG-CB 4.44Å; W513-Q516 HydrophobicContact CH2-CB 4.2Å; W513-Q516 HydrophobicContact CH2-CG 3.61Å; W513-Q516 HydrophobicContact CZ2-CB 4.2Å; W513-Q516 HydrophobicContact CZ2-CG 3.48Å; W513-Q516 VanDerWaalsContact CZ2-CG 3.48Å; W513-Q516 HydrophobicContact CZ3-CB 4Å; W513-Q516 HydrophobicContact CZ3-CG 3.94Å; W513-Q516 PolarHBondContact O-N 3.02Å; W513-Q516 VanDerWaalsContact O-O 3.12Å
517	N	89.3	Confident	89.3	Confident	119 Å²	119	55 Å²	55	64%	0.636	32%	0.318	S	S	*	.	S	Bend	trans	-81	-22	-176.6	-71.9	-6.9	0	0	0	113.5	A498 G500	A498-N517 WeakPolarHBondContact CB-O 3.42Å; G500-N517 VanDerWaalsContact CA-O 3.27Å; G500-N517 WeakPolarHBondContact CA-O 3.38Å; G500-N517 PolarHBondContact N-O 2.79Å
518	T	90.4	Very high	89.6	Confident	61 Å²	61	51.5 Å²	51.5	37%	0.374	30%	0.296	S	S	.	.			trans	-148	156.4	175.9	-177.4	0	0	0	0	111.2	G448 A498 G520	G448-T518 PolarHBondContact O-OG1 3.07Å; A498-T518 VanDerWaalsContact CB-CA 3.46Å; T518-G520 VanDerWaalsContact C-N 3.26Å; T518-G520 PolarHBondContact OG1-N 3.16Å
519	W	90.8	Very high	90.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.278	C	S	.	.			trans	-81.1	-6.3	162.7	-72	99.2	0	0	0	113.2	G448 V451 I468 R470 N472 L478 Y480 I496 W513	G448-W519 WeakPolarHBondContact O-CB 3.41Å; G448-W519 PolarHBondContact O-N 3.38Å; V451-W519 HydrophobicContact CB-CH2 4.45Å; V451-W519 HydrophobicContact CB-CZ2 4.01Å; V451-W519 HydrophobicContact CG2-CD2 3.57Å; V451-W519 HydrophobicContact CG2-CE3 3.82Å; V451-W519 HydrophobicContact CG2-CG 4.04Å; V451-W519 HydrophobicContact CG2-CH2 4.07Å; V451-W519 HydrophobicContact CG2-CZ2 3.85Å; V451-W519 HydrophobicContact CG2-CZ3 4.07Å; I468-W519 HydrophobicContact CB-CH2 3.91Å; I468-W519 HydrophobicContact CB-CZ3 4.32Å; I468-W519 HydrophobicContact CD1-CH2 4.17Å; I468-W519 HydrophobicContact CG2-CH2 3.72Å; I468-W519 HydrophobicContact CG2-CZ3 3.82Å; R470-W519 HydrophobicContact CB-CE3 3.77Å; R470-W519 HydrophobicContact CB-CZ3 4.02Å; R470-W519 HydrophobicContact CG-CE3 4.08Å; R470-W519 WeakPolarHBondContact CG-O 3.32Å; N472-W519 PolarHBondContact ND2-O 3.13Å; L478-W519 VanDerWaalsContact CD1-O 3.29Å; L478-W519 WeakPolarHBondContact CD1-O 3.44Å; Y480-W519 HydrophobicContact CG-CH2 4.33Å; I496-W519 HydrophobicContact CB-CZ2 4Å; I496-W519 HydrophobicContact CG2-CZ2 3.74Å; I496-W519 PolarHBondContact O-NE1 3.45Å; W513-W519 HydrophobicContact CE3-CD2 4.19Å; W513-W519 HydrophobicContact CE3-CE3 4.22Å; W513-W519 AromaticContact CE3-CH2 3.98Å; W513-W519 HydrophobicContact CE3-CH2 3.98Å; W513-W519 AromaticContact CE3-CZ2 3.92Å; W513-W519 HydrophobicContact CE3-CZ2 3.92Å; W513-W519 HydrophobicContact CE3-CZ3 4.12Å; W513-W519 HydrophobicContact CZ3-CD2 4.11Å; W513-W519 AromaticContact CZ3-CE3 3.73Å; W513-W519 HydrophobicContact CZ3-CE3 3.73Å; W513-W519 AromaticContact CZ3-CH2 3.96Å; W513-W519 HydrophobicContact CZ3-CH2 3.96Å; W513-W519 HydrophobicContact CZ3-CZ2 4.3Å; W513-W519 AromaticContact CZ3-CZ3 3.65Å; W513-W519 HydrophobicContact CZ3-CZ3 3.65Å
520	G	84.9	Confident	90.3	Very high	10 Å²	10	47.1 Å²	47.1	10%	0.103	27%	0.267	C	S	.	.			trans	76.6	150.7	180	0	0	0	0	0	114.6	R470 N472 T518	R470-G520 PolarHBondContact NH2-O 3.09Å; N472-G520 WeakPolarHBondContact ND2-CA 3.29Å; T518-G520 VanDerWaalsContact C-N 3.26Å; T518-G520 PolarHBondContact OG1-N 3.16Å
521	C	83.1	Confident	90.2	Very high	79 Å²	79	46 Å²	46	53%	0.534	26%	0.261	S	S	.	.			trans	-120.9	157.4	-174.6	57.8	0	0	0	0	110.4	E446	E446-C521 VanDerWaalsContact O-CB 3.25Å; E446-C521 WeakPolarHBondContact O-CB 3.45Å
522	G	79.5	Confident	90	Very high	36 Å²	36	49.9 Å²	49.9	37%	0.371	29%	0.289	S	S	.	.			trans	160.7	172.9	-177.7	0	0	0	0	0	113.7	S524 L525	G522-S524 PolarHBondContact O-N 3.27Å; G522-L525 WeakPolarHBondContact O-CG 3.31Å
523	N	81.8	Confident	89.6	Confident	114 Å²	114	53.9 Å²	53.9	61%	0.61	31%	0.313	S	S	*	.	S	Bend	trans	-78.5	-15.5	-170.9	-67.7	-18.5	0	0	0	114.7	V543 R544	N523-V543 WeakPolarHBondContact O-CA 3.45Å; N523-R544 HydrophobicContact CB-CB 4.36Å; N523-R544 PolarHBondContact O-N 2.93Å
524	S	86.1	Confident	89.3	Confident	43 Å²	43	55.3 Å²	55.3	30%	0.301	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	115.3	173.5	168.5	0	0	0	0	109.7	G473 G522 K541 L542	G473-S524 PolarHBondContact N-O 2.99Å; G522-S524 PolarHBondContact O-N 3.27Å; S524-K541 WeakPolarHBondContact OG-CE 3.39Å; S524-L542 WeakPolarHBondContact CA-O 3.39Å
525	L	90.3	Very high	89.3	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.026	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	120	-168.5	-58.7	173.1	0	0	0	110	N472 G522 K541 L542	N472-L525 HydrophobicContact CB-CD2 3.92Å; N472-L525 WeakPolarHBondContact OD1-CD2 3.41Å; G522-L525 WeakPolarHBondContact O-CG 3.31Å; L525-K541 CarbonylContact O-C 3.54Å; L525-K541 VanDerWaalsContact O-CA 3.23Å; L525-K541 WeakPolarHBondContact O-CA 3.26Å; L525-L542 HydrophobicContact CB-CB 4.12Å; L525-L542 HydrophobicContact CD1-CB 4.47Å; L525-L542 HydrophobicContact CD1-CD2 4.23Å; L525-L542 PolarHBondContact N-O 3.06Å; L525-L542 PolarHBondContact O-N 3.1Å
526	R	92.9	Very high	89.5	Confident	81 Å²	81	53.2 Å²	53.2	31%	0.306	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.6	177.5	-170.6	-175.8	-166.8	-86	-8.7	110.6	R470 Q471 E536 M539 R540	R470-R526 WeakPolarHBondContact CA-O 3.37Å; Q471-R526 PolarHBondContact N-O 3.49Å; Q471-R526 PolarHBondContact O-N 2.86Å; R526-E536 IonicContact CZ-OE1 2.93Å; R526-E536 IonicContact CZ-OE2 2.63Å; R526-E536 VanDerWaalsContact CZ-OE2 3.26Å; R526-E536 IonicContact NH1-OE1 2.63Å; R526-E536 IonicContact NH1-OE2 3.16Å; R526-E536 PolarHBondContact NH1-OE2 3.47Å; R526-E536 IonicContact NH2-OE1 2.81Å; R526-E536 PolarHBondContact NH2-OE1 3.31Å; R526-E536 IonicContact NH2-OE2 2.98Å; R526-E536 PolarHBondContact NH2-OE2 3.41Å; R526-M539 PolarHBondContact NH2-SD 3.16Å; R526-R540 WeakPolarHBondContact CA-O 3.44Å
527	T	94.5	Very high	89.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.7	170.3	-53.1	0	0	0	0	109.4	V441 V444 V451 I468 K469 R470 M539 R540	V441-T527 HydrophobicContact CG1-CG2 4.08Å; V441-T527 HydrophobicContact CG2-CG2 4.46Å; V444-T527 HydrophobicContact CG2-CG2 4.32Å; V451-T527 HydrophobicContact CG1-CG2 4.01Å; V451-T527 HydrophobicContact CG2-CG2 4.21Å; I468-T527 HydrophobicContact CG2-CG2 3.69Å; K469-T527 CarbonylContact O-C 3.57Å; K469-T527 WeakPolarHBondContact O-CA 3.27Å; R470-T527 WeakPolarHBondContact CD-OG1 3.31Å; R470-T527 PolarHBondContact NH1-OG1 3.09Å; T527-M539 CarbonylContact O-C 3.43Å; T527-M539 WeakPolarHBondContact O-CA 3.45Å; T527-R540 PolarHBondContact N-O 3.23Å; T527-R540 PolarHBondContact O-N 3.41Å
528	A	94.8	Very high	89.8	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.017	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139	175.8	0	0	0	0	0	110.7	I468 K469 E536 A538	I468-A528 CarbonylContact C-O 3.58Å; I468-A528 WeakPolarHBondContact CA-O 3.12Å; K469-A528 PolarHBondContact N-O 2.98Å; K469-A528 PolarHBondContact O-N 2.9Å; A528-E536 HydrophobicContact CB-CG 4.07Å; A528-E536 WeakPolarHBondContact CB-OE2 3.36Å; A528-A538 CarbonylContact C-O 3.59Å; A528-A538 WeakPolarHBondContact CA-O 3.37Å
529	L	96.1	Very high	90	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.8	170.2	179.6	65	0	0	0	108	V439 V441 L453 M463 W466 I468 F482 E536 V537 A538	V439-L529 HydrophobicContact CB-CD2 3.97Å; V439-L529 HydrophobicContact CG1-CD2 3.68Å; V441-L529 HydrophobicContact CG2-CB 4.25Å; L453-L529 HydrophobicContact CD1-CD1 3.77Å; L453-L529 HydrophobicContact CD1-CD2 4.13Å; M463-L529 HydrophobicContact CE-CD1 4.04Å; M463-L529 HydrophobicContact CE-CD2 4.25Å; W466-L529 HydrophobicContact CE3-CD1 4.25Å; W466-L529 HydrophobicContact CE3-CD2 4.29Å; W466-L529 HydrophobicContact CE3-CG 4.18Å; W466-L529 HydrophobicContact CZ3-CD2 4.24Å; I468-L529 HydrophobicContact CG1-CD1 4.09Å; F482-L529 HydrophobicContact CE2-CD1 4.19Å; L529-E536 CarbonylContact O-C 3.59Å; L529-V537 HydrophobicContact CB-CG2 4.31Å; L529-V537 HydrophobicContact CD2-CG2 4.01Å; L529-V537 HydrophobicContact CG-CG2 3.82Å; L529-V537 WeakPolarHBondContact O-CG2 3.47Å; L529-V537 PolarHBondContact O-N 3.16Å; L529-A538 HydrophobicContact CB-CB 4.2Å; L529-A538 HydrophobicContact CD2-CB 4.47Å; L529-A538 PolarHBondContact N-O 3.4Å; L529-A538 PolarHBondContact O-N 3.27Å
530	I	94.8	Very high	90.1	Very high	22 Å²	22	44.9 Å²	44.9	11%	0.113	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.4	-174.8	-56.6	-177.1	0	0	0	108.7	W466 Q467 K469 G534 E535	W466-I530 CarbonylContact C-O 3.56Å; W466-I530 WeakPolarHBondContact CA-O 3.37Å; W466-I530 WeakPolarHBondContact CB-O 3.42Å; Q467-I530 HydrophobicContact CB-CB 4.45Å; Q467-I530 PolarHBondContact N-O 3.33Å; Q467-I530 PolarHBondContact O-N 3.45Å; K469-I530 HydrophobicContact CB-CD1 4.41Å; K469-I530 HydrophobicContact CD-CD1 3.64Å; K469-I530 HydrophobicContact CG-CD1 3.89Å; I530-G534 VanDerWaalsContact CG2-C 3.41Å; I530-G534 WeakPolarHBondContact CG2-O 3.48Å; I530-E535 VanDerWaalsContact CA-O 3.31Å; I530-E535 WeakPolarHBondContact CA-O 3.39Å
531	N	92.8	Very high	90.4	Very high	18 Å²	18	48.1 Å²	48.1	10%	0.096	28%	0.28	C	S	.	.			trans	-78.3	-176.2	-179.4	68.8	8.8	0	0	0	112.5	W466 T533 G534 E535 V537	W466-N531 HydrophobicContact CD2-CB 3.95Å; W466-N531 HydrophobicContact CE3-CB 4.3Å; W466-N531 HydrophobicContact CG-CB 4.47Å; W466-N531 HydrophobicContact CH2-CB 4.32Å; W466-N531 HydrophobicContact CZ2-CB 3.92Å; W466-N531 HydrophobicContact CZ3-CB 4.49Å; N531-T533 VanDerWaalsContact C-N 3.28Å; N531-T533 PolarHBondContact ND2-OG1 3.47Å; N531-T533 PolarHBondContact O-N 3.29Å; N531-T533 PolarHBondContact OD1-N 3.4Å; N531-T533 VanDerWaalsContact OD1-N 3.13Å; N531-T533 PolarHBondContact OD1-OG1 3.09Å; N531-G534 PolarHBondContact O-N 3.04Å; N531-G534 PolarHBondContact OD1-N 3.41Å; N531-E535 PolarHBondContact N-O 2.64Å; N531-E535 PolarHBondContact ND2-OE2 3.38Å; N531-E535 PolarHBondContact OD1-N 2.86Å; N531-E535 PolarHBondContact OD1-O 2.84Å; N531-V537 HydrophobicContact CB-CG1 3.91Å; N531-V537 HydrophobicContact CB-CG2 4.42Å
532	S	90.3	Very high	90.7	Very high	86 Å²	86	45.1 Å²	45.1	60%	0.601	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.3	178.8	48	0	0	0	0	114.9
533	T	87.4	Confident	91	Very high	106 Å²	106	45.9 Å²	45.9	65%	0.65	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-12.4	175.4	33.4	0	0	0	0	113	N531 E535	N531-T533 VanDerWaalsContact C-N 3.28Å; N531-T533 PolarHBondContact ND2-OG1 3.47Å; N531-T533 PolarHBondContact O-N 3.29Å; N531-T533 PolarHBondContact OD1-N 3.4Å; N531-T533 VanDerWaalsContact OD1-N 3.13Å; N531-T533 PolarHBondContact OD1-OG1 3.09Å; T533-E535 PolarHBondContact OG1-OE2 3.19Å
534	G	86.7	Confident	90.9	Very high	56 Å²	56	46.9 Å²	46.9	58%	0.577	25%	0.25	S	S	*	.	S	Bend	trans	101.6	5.3	177.5	0	0	0	0	0	114.9	I530 N531	I530-G534 VanDerWaalsContact CG2-C 3.41Å; I530-G534 WeakPolarHBondContact CG2-O 3.48Å; N531-G534 PolarHBondContact O-N 3.04Å; N531-G534 PolarHBondContact OD1-N 3.41Å
535	E	90.3	Very high	89.8	Confident	120 Å²	120	47.3 Å²	47.3	56%	0.561	25%	0.253	S	S	*	.			trans	-87.7	141.6	-177.6	-56.1	156.5	119.4	0	0	111.3	I530 N531 T533 V537	I530-E535 VanDerWaalsContact CA-O 3.31Å; I530-E535 WeakPolarHBondContact CA-O 3.39Å; N531-E535 PolarHBondContact N-O 2.64Å; N531-E535 PolarHBondContact ND2-OE2 3.38Å; N531-E535 PolarHBondContact OD1-N 2.86Å; N531-E535 PolarHBondContact OD1-O 2.84Å; T533-E535 PolarHBondContact OG1-OE2 3.19Å; E535-V537 PolarHBondContact O-N 3.18Å
536	E	93.5	Very high	88	Confident	79 Å²	79	52.7 Å²	52.7	37%	0.369	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	100.5	176.6	-172.7	176.4	102.3	0	0	110.8	R526 A528 L529 M539	R526-E536 IonicContact CZ-OE1 2.93Å; R526-E536 IonicContact CZ-OE2 2.63Å; R526-E536 VanDerWaalsContact CZ-OE2 3.26Å; R526-E536 IonicContact NH1-OE1 2.63Å; R526-E536 IonicContact NH1-OE2 3.16Å; R526-E536 PolarHBondContact NH1-OE2 3.47Å; R526-E536 IonicContact NH2-OE1 2.81Å; R526-E536 PolarHBondContact NH2-OE1 3.31Å; R526-E536 IonicContact NH2-OE2 2.98Å; R526-E536 PolarHBondContact NH2-OE2 3.41Å; A528-E536 HydrophobicContact CB-CG 4.07Å; A528-E536 WeakPolarHBondContact CB-OE2 3.36Å; L529-E536 CarbonylContact O-C 3.59Å; E536-M539 HydrophobicContact CG-CB 4.48Å; E536-M539 WeakPolarHBondContact OE1-CB 3.44Å; E536-M539 WeakPolarHBondContact OE1-CG 3.5Å
537	V	92.8	Very high	85.8	Confident	17 Å²	17	53.5 Å²	53.5	10%	0.103	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-18	-176.5	-68.2	0	0	0	0	113.5	S436 G437 W466 L529 N531 E535	S436-V537 PolarHBondContact N-O 3.33Å; G437-V537 PolarHBondContact N-O 3.39Å; W466-V537 HydrophobicContact CE3-CG2 4.08Å; W466-V537 HydrophobicContact CH2-CG2 4.3Å; W466-V537 HydrophobicContact CZ3-CG2 3.62Å; L529-V537 HydrophobicContact CB-CG2 4.31Å; L529-V537 HydrophobicContact CD2-CG2 4.01Å; L529-V537 HydrophobicContact CG-CG2 3.82Å; L529-V537 WeakPolarHBondContact O-CG2 3.47Å; L529-V537 PolarHBondContact O-N 3.16Å; N531-V537 HydrophobicContact CB-CG1 3.91Å; N531-V537 HydrophobicContact CB-CG2 4.42Å; E535-V537 PolarHBondContact O-N 3.18Å
538	A	93.2	Very high	83.2	Confident	2 Å²	2	58.6 Å²	58.6	2%	0.017	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	154	166.4	0	0	0	0	0	112	R434 T435 V439 V441 A528 L529	R434-A538 WeakPolarHBondContact O-CA 3.49Å; T435-A538 HydrophobicContact CG2-CB 4.16Å; V439-A538 WeakPolarHBondContact O-CB 3.4Å; V441-A538 HydrophobicContact CG2-CB 4.16Å; A528-A538 CarbonylContact C-O 3.59Å; A528-A538 WeakPolarHBondContact CA-O 3.37Å; L529-A538 HydrophobicContact CB-CB 4.2Å; L529-A538 HydrophobicContact CD2-CB 4.47Å; L529-A538 PolarHBondContact N-O 3.4Å; L529-A538 PolarHBondContact O-N 3.27Å
539	M	93.6	Very high	80.6	Confident	23 Å²	23	63.7 Å²	63.7	11%	0.113	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.8	171.4	60.5	153	-66.2	0	0	112.7	A433 R434 R526 T527 E536 K541	A433-M539 WeakPolarHBondContact CA-O 3.49Å; R434-M539 HydrophobicContact CB-CG 3.81Å; R434-M539 HydrophobicContact CB-SD 4.5Å; R434-M539 HydrophobicContact CG-CG 4.38Å; R434-M539 HydrophobicContact CG-SD 4.47Å; R434-M539 PolarHBondContact N-O 3.14Å; R434-M539 PolarHBondContact O-N 2.8Å; R434-M539 VanDerWaalsContact O-O 3.08Å; R526-M539 PolarHBondContact NH2-SD 3.16Å; T527-M539 CarbonylContact O-C 3.43Å; T527-M539 WeakPolarHBondContact O-CA 3.45Å; E536-M539 HydrophobicContact CG-CB 4.48Å; E536-M539 WeakPolarHBondContact OE1-CB 3.44Å; E536-M539 WeakPolarHBondContact OE1-CG 3.5Å; M539-K541 HydrophobicContact CE-CB 4.16Å
540	R	92.9	Very high	77.7	Confident	44 Å²	44	71.8 Å²	71.8	17%	0.166	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	134.2	168.1	-160.2	-178	-158.8	108.2	-13.1	109.3	H432 A433 V441 E442 R526 T527	H432-R540 CarbonylContact O-C 3.55Å; H432-R540 WeakPolarHBondContact O-CA 3.47Å; H432-R540 WeakPolarHBondContact O-CG 3.42Å; A433-R540 HydrophobicContact CB-CG 4.22Å; V441-R540 HydrophobicContact CB-CB 4.19Å; V441-R540 HydrophobicContact CG1-CB 3.94Å; V441-R540 PolarHBondContact O-NH1 2.74Å; E442-R540 PolarHBondContact O-NH1 3.41Å; E442-R540 PolarHBondContact O-NH2 3.03Å; R526-R540 WeakPolarHBondContact CA-O 3.44Å; T527-R540 PolarHBondContact N-O 3.23Å; T527-R540 PolarHBondContact O-N 3.41Å
541	K	91.5	Very high	75.1	Confident	78 Å²	78	77.4 Å²	77.4	34%	0.339	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.5	169.1	-166.3	-176.3	-179.8	-172.9	0	109.4	H432 S524 L525 M539 V543	H432-K541 PolarHBondContact N-O 3.5Å; H432-K541 PolarHBondContact O-N 2.95Å; H432-K541 VanDerWaalsContact O-O 3.11Å; S524-K541 WeakPolarHBondContact OG-CE 3.39Å; L525-K541 CarbonylContact O-C 3.54Å; L525-K541 VanDerWaalsContact O-CA 3.23Å; L525-K541 WeakPolarHBondContact O-CA 3.26Å; M539-K541 HydrophobicContact CE-CB 4.16Å; K541-V543 HydrophobicContact CD-CG2 4.16Å; K541-V543 HydrophobicContact CG-CG2 4.26Å
542	L	88.6	Confident	72.4	Confident	16 Å²	16	83.6 Å²	83.6	8%	0.084	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.3	171.1	-150.9	72.2	0	0	0	108.8	F429 Q431 E446 S524 L525	F429-L542 HydrophobicContact CE1-CD2 4.34Å; Q431-L542 HydrophobicContact CB-CD1 3.74Å; Q431-L542 HydrophobicContact CG-CD1 3.65Å; E446-L542 HydrophobicContact CG-CD2 3.75Å; S524-L542 WeakPolarHBondContact CA-O 3.39Å; L525-L542 HydrophobicContact CB-CB 4.12Å; L525-L542 HydrophobicContact CD1-CB 4.47Å; L525-L542 HydrophobicContact CD1-CD2 4.23Å; L525-L542 PolarHBondContact N-O 3.06Å; L525-L542 PolarHBondContact O-N 3.1Å
543	V	85.8	Confident	70.1	Confident	51 Å²	51	87.9 Å²	87.9	31%	0.309	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	128.6	176.7	-175.9	0	0	0	0	109.4	S430 N523 K541	S430-V543 PolarHBondContact N-O 3.14Å; S430-V543 VanDerWaalsContact N-O 3.07Å; S430-V543 PolarHBondContact O-N 3.41Å; S430-V543 VanDerWaalsContact O-O 3.09Å; N523-V543 WeakPolarHBondContact O-CA 3.45Å; K541-V543 HydrophobicContact CD-CG2 4.16Å; K541-V543 HydrophobicContact CG-CG2 4.26Å
544	R	79.9	Confident	67.7	Low	135 Å²	135	90.3 Å²	90.3	51%	0.509	48%	0.483	S	S	.	.			trans	-85.1	128	175	-166.9	172.1	-170.4	160.1	4	110.4	F429 N523	F429-R544 HydrophobicContact CD1-CB 4.02Å; F429-R544 HydrophobicContact CD1-CG 4.14Å; F429-R544 HydrophobicContact CD2-CG 4.24Å; F429-R544 HydrophobicContact CE1-CB 3.51Å; F429-R544 HydrophobicContact CE1-CG 3.72Å; F429-R544 HydrophobicContact CE2-CG 3.84Å; F429-R544 HydrophobicContact CG-CG 4.41Å; F429-R544 HydrophobicContact CZ-CB 3.84Å; F429-R544 HydrophobicContact CZ-CG 3.57Å; N523-R544 HydrophobicContact CB-CB 4.36Å; N523-R544 PolarHBondContact O-N 2.93Å
545	S	63.8	Low	65.6	Low	52 Å²	52	96.2 Å²	96.2	36%	0.364	50%	0.495	S	S	.	.			trans	-110.5	131.4	172	48.6	0	0	0	0	109.2
546	V	52.4	Low	63.2	Low	118 Å²	118	98.6 Å²	98.6	72%	0.715	51%	0.512	S	S	*	.			trans	-111.9	112.5	170.2	179	0	0	0	0	107.2	V548	V546-V548 PolarHBondContact O-N 3.17Å
547	T	45.9	Very low	60.5	Low	98 Å²	98	98.8 Å²	98.8	60%	0.601	54%	0.535	S	S	*	.			trans	-79.5	103.7	168.2	47.6	0	0	0	0	108.3
548	V	39.8	Very low	57.8	Low	107 Å²	107	105.7 Å²	105.7	65%	0.648	57%	0.571	S	S	*	*			trans	-71.8	137.2	154.7	-172.1	0	0	0	0	106.2	V546 E550	V546-V548 PolarHBondContact O-N 3.17Å; V548-E550 HydrophobicContact CG1-CG 3.91Å
549	V	41.2	Very low	55	Low	109 Å²	109	111.6 Å²	111.6	66%	0.661	60%	0.602	S	S	*	*			trans	-95.2	112.3	167.1	-179.9	0	0	0	0	105.7
550	E	35.6	Very low	52.2	Low	170 Å²	170	116.7 Å²	116.7	79%	0.794	63%	0.629	S	S	*	*			trans	-108.5	114	166.2	-66.6	177.6	149.7	0	0	104.7	V548	V548-E550 HydrophobicContact CG1-CG 3.91Å
551	D	39.1	Very low	49.3	Very low	141 Å²	141	120.8 Å²	120.8	75%	0.754	65%	0.654	S	S	*	*			trans	-92.2	115.5	177.7	-66	-60	0	0	0	108.5
552	D	36.7	Very low	46.5	Very low	148 Å²	148	124 Å²	124	79%	0.791	67%	0.67	S	S	*	*			trans	-152.2	105.2	165.3	-76.7	-55.7	0	0	0	105.1
553	E	40.6	Very low	43.8	Very low	176 Å²	176	130 Å²	130	82%	0.822	70%	0.697	S	S	*	*				72.9	84.4	82.3	-68.3	-160.3	171.8	0	0	115.5
554	D	38	Very low	41.2	Very low	156 Å²	156	134.3 Å²	134.3	83%	0.834	71%	0.713	S	S	*	*			trans	64.1	176	131.4	-64.7	-22.7	0	0	0	124.2
555	E	42.3	Very low	38.8	Very low	181 Å²	181	136.3 Å²	136.3	85%	0.846	73%	0.728	S	S	*	*			trans	74.9	91.7	172.1	-57.1	-159.3	147.8	0	0	120.8
556	D	39.3	Very low	37.1	Very low	170 Å²	170	137.1 Å²	137.1	91%	0.909	75%	0.745	S	S	*	*				35	137.7	116.2	-61	-27.4	0	0	0	122.1
557	G	37.9	Very low	36.2	Very low	82 Å²	82	136.4 Å²	136.4	85%	0.845	75%	0.745	S	S	*	*			trans	176.9	119.1	165.3	0	0	0	0	0	115
558	D	36.3	Very low	35.5	Very low	163 Å²	163	139.8 Å²	139.8	87%	0.872	75%	0.754	S	S	*	*			trans	-91.7	168.2	-175.3	-104.5	-47.8	0	0	0	115.2
559	D	33.5	Very low	35.1	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	76%	0.757	S	S	*	*			trans	94.1	124.6	139.9	-109.6	21.4	0	0	0	125.6
560	L	34.4	Very low	34.5	Very low	129 Å²	129	140.4 Å²	140.4	68%	0.675	76%	0.762	S	S	*	*				74	104.9	129.1	-105.6	59.2	0	0	0	125.4
561	L	33.7	Very low	34.3	Very low	131 Å²	131	137.2 Å²	137.2	69%	0.686	76%	0.758	S	S	*	*				76.9	126.5	126.5	-71.7	173.9	0	0	0	126.1
562	H	32.5	Very low	33.9	Very low	145 Å²	145	136 Å²	136	67%	0.671	76%	0.76	S	S	*	*				83.2	109.4	128.7	-82.6	-3	0	0	0	125.8
563	H	31.9	Very low	33.6	Very low	142 Å²	142	132.4 Å²	132.4	66%	0.657	76%	0.759	S	S	*	*				67.6	122.2	113.8	-77.1	-36.2	0	0	0	125.7
564	H	29.6	Very low	33.4	Very low	141 Å²	141	131.7 Å²	131.7	65%	0.653	76%	0.761	S	S	*	*				79	133.5	128.7	-89.7	-73.7	0	0	0	124.8
565	H	30	Very low	34	Very low	177 Å²	177	129.9 Å²	129.9	82%	0.819	76%	0.758	S	S	*	*			trans	64	153.5	155.2	-66.6	-62.6	0	0	0	118.8
566	G	28.2	Very low	33.5	Very low	69 Å²	69	125 Å²	125	71%	0.711	75%	0.748	S	S	*	*			cis	-170.6	172.2	-1.1	0	0	0	0	0	113.8
567	S	33	Very low	33.2	Very low	104 Å²	104	124.3 Å²	124.3	73%	0.727	74%	0.739	S	S	*	*			trans	-70.2	159.9	-174	-48.6	0	0	0	0	115.4
568	H	32.4	Very low	32.9	Very low	168 Å²	168	129.7 Å²	129.7	78%	0.778	74%	0.735	S	S	*	*				170.2	119.9	112.4	-95.5	-73.4	0	0	0	111.6
569	C	31	Very low	32.7	Very low	107 Å²	107	128.6 Å²	128.6	72%	0.723	73%	0.729	S	S	*	*				65.6	143.2	100.7	91.4	0	0	0	0	115.2
570	T	28.5	Very low	32.6	Very low	122 Å²	122	130 Å²	130	75%	0.748	74%	0.736	S	S	*	*				-136	149.5	51.1	43.8	0	0	0	0	113.6
571	S	31.1	Very low	32.5	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	74%	0.743	S	S	*	*				54.8	135.7	82.2	-146.7	0	0	0	0	114
572	S	31.8	Very low	32.5	Very low	114 Å²	114	133 Å²	133	80%	0.797	75%	0.746	S	S	*	*			cis	-171.1	164.6	-4.2	31	0	0	0	0	105.7
573	G	29.4	Very low	32.7	Very low	74 Å²	74	136.6 Å²	136.6	76%	0.763	75%	0.754	S	S	*	*			cis	156.4	151.3	19.6	0	0	0	0	0	107.2
574	D	37.6	Very low	32.8	Very low	161 Å²	161	137.1 Å²	137.1	86%	0.861	77%	0.767	S	S	*	*			trans	-63.5	171	178	-98.5	-59.6	0	0	0	113.6
575	P	49.7	Very low	33.1	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	77%	0.767	S	S	*	*			cis	-153.3	-174.8	33.1	45.4	-24.2	0	0	0	120.1
576	A	32.4	Very low	33.5	Very low	77 Å²	77	135 Å²	135	64%	0.636	77%	0.77	S	S	*	*			trans	88.2	116.2	135.4	0	0	0	0	0	124.2
577	E	31.4	Very low	33.7	Very low	156 Å²	156	138.3 Å²	138.3	73%	0.729	78%	0.78	S	S	*	*			trans	68.8	169.8	132.6	-60.8	-162.9	135.7	0	0	123.7
578	Y	32.9	Very low	34.2	Very low	195 Å²	195	135.8 Å²	135.8	77%	0.765	77%	0.771	S	S	*	*			trans	73.2	72.7	168.1	-57.6	-72	0	0	0	121.4
579	N	31.8	Very low	34.6	Very low	140 Å²	140	134.3 Å²	134.3	75%	0.749	77%	0.774	S	S	*	*				15.9	111.4	116.5	175.5	20.5	0	0	0	118
580	L	32.3	Very low	35.5	Very low	155 Å²	155	135.3 Å²	135.3	81%	0.812	78%	0.781	S	S	*	*			trans	-164	118.3	134.7	-110.1	164.6	0	0	0	115.5
581	R	31.7	Very low	36	Very low	216 Å²	216	133.1 Å²	133.1	82%	0.815	78%	0.782	S	S	*	*			trans	-3.2	137	157.5	-62.1	170.1	169.5	172.2	-4.2	120.6
582	S	33.8	Very low	36.5	Very low	109 Å²	109	137 Å²	137	76%	0.762	79%	0.788	S	S	*	*			trans	137.7	143.9	134.5	-67.2	0	0	0	0	112.2
583	R	36	Very low	37.1	Very low	219 Å²	219	136.6 Å²	136.6	83%	0.826	78%	0.783	S	S	*	*			cis	-164.3	132.3	-5.4	-117.4	178.6	179.3	-149.4	3.3	109
584	T	33.4	Very low	37.2	Very low	153 Å²	153	137.8 Å²	137.8	94%	0.939	79%	0.786	S	S	*	*			trans	-146.3	146.8	150	-28.5	0	0	0	0	108.8
585	V	36	Very low	37	Very low	109 Å²	109	137.2 Å²	137.2	66%	0.661	78%	0.783	S	S	*	*			trans	-128.2	117.8	-164.3	172.6	0	0	0	0	111.9
586	L	39.7	Very low	36.2	Very low	166 Å²	166	140.9 Å²	140.9	87%	0.869	79%	0.787	S	S	*	*			trans	40.1	118.8	146.8	-55.4	175.4	0	0	0	120.8
587	C	31	Very low	36.2	Very low	137 Å²	137	141 Å²	141	93%	0.926	79%	0.788	S	S	*	*				-152	149.1	122.7	-145.1	0	0	0	0	107.3
588	G	43.4	Very low	36.3	Very low	52 Å²	52	138.9 Å²	138.9	54%	0.536	79%	0.79	S	S	.	*			cis	156	105.7	-4.5	0	0	0	0	0	109.2
589	T	42.2	Very low	36.3	Very low	136 Å²	136	133.9 Å²	133.9	83%	0.834	79%	0.789	S	S	*	*	S	Bend	trans	71.1	140	-166.9	71.7	0	0	0	0	115.6
590	C	49	Very low	36.4	Very low	129 Å²	129	133.6 Å²	133.6	87%	0.872	80%	0.798	S	S	*	*			trans	37.2	115.9	176.7	58.1	0	0	0	0	120
591	G	38.6	Very low	36.4	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	79%	0.793	S	S	*	*			trans	-154.7	-29.9	-177.2	0	0	0	0	0	122
592	Q	43.2	Very low	36.5	Very low	185 Å²	185	125.6 Å²	125.6	86%	0.864	80%	0.799	S	S	*	*			trans	61	-177.8	-178.7	-67.1	-69.3	-7.7	0	0	115.3
593	P	43	Very low	36.4	Very low	107 Å²	107	124.5 Å²	124.5	70%	0.695	80%	0.804	S	S	*	*			cis	-125	173.5	-44.6	32.8	-17.8	0	0	0	113.4
594	A	31.2	Very low	36.2	Very low	98 Å²	98	118.8 Å²	118.8	81%	0.81	80%	0.804	S	S	*	*			trans	156	160.1	135.1	0	0	0	0	0	112.3
595	D	34.4	Very low	36.4	Very low	149 Å²	149	120 Å²	120	80%	0.797	80%	0.799	S	S	*	*			cis	-172	179.7	-47.8	-141.1	-44	0	0	0	107.9
596	K	33.1	Very low	36.4	Very low	195 Å²	195	121.2 Å²	121.2	85%	0.848	81%	0.807	S	S	*	*			trans	76.7	147.6	172.8	-64.5	-177.9	179.4	179.7	0	117.3
597	A	32.3	Very low	35.9	Very low	80 Å²	80	116.9 Å²	116.9	66%	0.661	80%	0.802	S	S	*	*			cis	-164.3	172	-12.7	0	0	0	0	0	112.2
598	S	32.6	Very low	35.9	Very low	111 Å²	111	113.9 Å²	113.9	78%	0.776	79%	0.794	S	S	*	*			trans	54.1	121.7	156.4	49.9	0	0	0	0	119.1
599	A	34.3	Very low	36.3	Very low	90 Å²	90	116.7 Å²	116.7	74%	0.744	80%	0.803	S	S	*	*			cis	88.4	132.6	33.3	0	0	0	0	0	116.1
600	S	33.9	Very low	36	Very low	135 Å²	135	117.5 Å²	117.5	94%	0.944	80%	0.801	S	S	*	*			trans	75.1	151.6	176.2	77.7	0	0	0	0	118.1
601	G	31	Very low	35.2	Very low	67 Å²	67	116.1 Å²	116.1	69%	0.691	79%	0.793	S	S	*	*			cis	163.8	116	-14.4	0	0	0	0	0	116.2
602	S	34.7	Very low	35	Very low	136 Å²	136	118.8 Å²	118.8	95%	0.951	80%	0.799	S	S	*	*			trans	52	122.5	152.9	-54.9	0	0	0	0	121.6
603	G	31.2	Very low	34.5	Very low	85 Å²	85	113.2 Å²	113.2	88%	0.876	79%	0.792	S	S	*	*			trans	176.2	96.8	163.5	0	0	0	0	0	117.5
604	A	32.6	Very low	34	Very low	99 Å²	99	113.7 Å²	113.7	82%	0.818	80%	0.797	S	S	*	*			trans	-149	163.2	163.3	0	0	0	0	0	107.4
605	Q	36.6	Very low	34.2	Very low	178 Å²	178	114.8 Å²	114.8	83%	0.832	80%	0.799	S	S	*	*			cis	-150.6	-172.2	11.5	-144.5	177.2	4.9	0	0	107.1
606	V	36.6	Very low	34.1	Very low	136 Å²	136	111.4 Å²	111.4	82%	0.824	79%	0.792	S	S	*	*				-176.7	144.6	69.7	165	0	0	0	0	109.7
607	G	29.1	Very low	34	Very low	75 Å²	75	107.2 Å²	107.2	77%	0.773	79%	0.787	S	S	*	*			trans	99.2	119.4	157.8	0	0	0	0	0	115.1
608	G	32.2	Very low	34.1	Very low	74 Å²	74	108.6 Å²	108.6	76%	0.763	79%	0.792	S	S	*	*			cis	148	179.7	3.6	0	0	0	0	0	109.1
609	P	51.7	Low	34	Very low	110 Å²	110	110.3 Å²	110.3	71%	0.714	80%	0.797	S	S	*	*			cis	-132.3	-169.8	-13.6	36.1	-14.8	0	0	0	113.3
610	I	34.4	Very low	34.1	Very low	154 Å²	154	111.7 Å²	111.7	79%	0.79	80%	0.797	S	S	*	*			trans	54.8	148.9	158.4	63.3	174.8	0	0	0	121.1
611	S	33.4	Very low	33.8	Very low	100 Å²	100	112.1 Å²	112.1	70%	0.699	79%	0.793	S	S	*	*			cis	-168.5	158.2	-15.1	-100.2	0	0	0	0	112.3
612	S	34.7	Very low	33.8	Very low	131 Å²	131	114.9 Å²	114.9	92%	0.916	80%	0.797	S	S	*	*			trans	66.8	152.5	161	71.6	0	0	0	0	119.4
613	G	31.1	Very low	33.7	Very low	68 Å²	68	118 Å²	118	70%	0.701	79%	0.788	S	S	*	*			cis	-177.6	145.1	-8.4	0	0	0	0	0	116.1
614	S	33.8	Very low	33.6	Very low	117 Å²	117	119.8 Å²	119.8	82%	0.818	79%	0.787	S	S	*	*			trans	48.8	127.6	140.3	-52.9	0	0	0	0	124.8
615	S	34.3	Very low	33.4	Very low	121 Å²	121	122.9 Å²	122.9	85%	0.846	78%	0.778	S	S	*	*			trans	81.2	152.8	138.5	-61.1	0	0	0	0	120.8
616	A	32	Very low	33.2	Very low	78 Å²	78	126.2 Å²	126.2	65%	0.645	78%	0.783	S	S	*	*			cis	-170.7	166.5	-24.1	0	0	0	0	0	110.6
617	S	32.3	Very low	32.9	Very low	106 Å²	106	124.7 Å²	124.7	74%	0.741	78%	0.779	S	S	*	*			trans	45.3	107.4	153.7	49.5	0	0	0	0	119.7
618	S	33.3	Very low	33.2	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	78%	0.783	S	S	*	*				87.7	124.5	62.5	70.8	0	0	0	0	116.4
619	V	32.1	Very low	33.1	Very low	147 Å²	147	128 Å²	128	89%	0.891	78%	0.784	S	S	*	*				-178.9	148.5	129.5	144.9	0	0	0	0	110
620	T	34.4	Very low	32.1	Very low	120 Å²	120	126.6 Å²	126.6	74%	0.736	79%	0.79	S	S	*	*			trans	-95.1	148.1	-172.3	40.9	0	0	0	0	115.7
621	V	28.4	Very low	32.2	Very low	143 Å²	143	125.7 Å²	125.7	87%	0.867	80%	0.797	S	S	*	*			trans	-140.3	133	130.5	-179.9	0	0	0	0	109.1
622	T	32	Very low	32.3	Very low	125 Å²	125	124.9 Å²	124.9	77%	0.767	81%	0.805	S	S	*	*			trans	-139.7	128.4	168.1	44.5	0	0	0	0	110.9
623	R	32	Very low	32.2	Very low	202 Å²	202	123 Å²	123	76%	0.762	81%	0.806	S	S	*	*			trans	-171	122.3	154.2	-114.3	166.8	172.9	-126.3	-0.8	111.5	Y625	R623-Y625 HydrophobicContact CB-CE1 3.83Å; R623-Y625 HydrophobicContact CG-CD1 4.43Å; R623-Y625 HydrophobicContact CG-CE1 3.61Å
624	S	27.8	Very low	32.3	Very low	122 Å²	122	123.6 Å²	123.6	85%	0.853	81%	0.812	S	S	*	*			trans	-117.9	141.3	171.9	-51.8	0	0	0	0	108.7
625	Y	29.9	Very low	32.3	Very low	164 Å²	164	122.5 Å²	122.5	64%	0.643	80%	0.804	S	S	*	*			trans	-147.6	147.3	173.7	-4.1	-99	0	0	0	114.6	R623	R623-Y625 HydrophobicContact CB-CE1 3.83Å; R623-Y625 HydrophobicContact CG-CD1 4.43Å; R623-Y625 HydrophobicContact CG-CE1 3.61Å
626	R	30.8	Very low	32.2	Very low	248 Å²	248	126.6 Å²	126.6	94%	0.936	81%	0.807	S	S	*	*			trans	76.1	143.5	153.9	-70.9	-174.1	175.4	-141.3	-2.3	119.4
627	S	30.9	Very low	32.4	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	82%	0.816	S	S	*	*			trans	-123	-175.3	169.4	179.3	0	0	0	0	107.1
628	V	34.8	Very low	32.4	Very low	141 Å²	141	128.9 Å²	128.9	86%	0.855	82%	0.819	S	S	*	*			trans	72	132.5	166.6	-141.9	0	0	0	0	117.8
629	G	31.5	Very low	32.6	Very low	77 Å²	77	130.4 Å²	130.4	79%	0.794	82%	0.819	S	S	*	*			trans	92.3	123.8	165.3	0	0	0	0	0	114.5
630	G	29.5	Very low	32.8	Very low	80 Å²	80	131.8 Å²	131.8	83%	0.825	82%	0.82	S	S	*	*			cis	114	79.5	-1.1	0	0	0	0	0	113.2
631	S	38	Very low	32.9	Very low	136 Å²	136	131.8 Å²	131.8	95%	0.951	82%	0.82	S	S	*	*			trans	-156.5	132.5	168.8	-86.3	0	0	0	0	109.6
632	G	34.5	Very low	33	Very low	83 Å²	83	131.6 Å²	131.6	86%	0.856	82%	0.819	S	S	*	*			trans	170.7	72.1	-176.4	0	0	0	0	0	111.4
633	G	32	Very low	33.2	Very low	91 Å²	91	136.4 Å²	136.4	94%	0.938	82%	0.823	S	S	*	*			trans	-80.4	132.6	-176.9	0	0	0	0	0	113.1
634	G	34.7	Very low	33.2	Very low	80 Å²	80	131.3 Å²	131.3	83%	0.825	82%	0.818	S	S	*	*			trans	-148.2	138.8	166.4	0	0	0	0	0	107.9
635	S	32.9	Very low	33.6	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	82%	0.817	S	S	*	*			trans	-127.5	158.9	-161.6	-169.3	0	0	0	0	113.6
636	F	33	Very low	33.9	Very low	208 Å²	208	135.1 Å²	135.1	91%	0.912	83%	0.825	S	S	*	*			trans	75.9	137.5	171.1	-54.2	-73.8	0	0	0	117.7
637	G	35	Very low	34.2	Very low	80 Å²	80	131.9 Å²	131.9	83%	0.825	83%	0.826	S	S	*	*			trans	159.2	100.3	-178.2	0	0	0	0	0	108.8
638	D	33.6	Very low	34.2	Very low	152 Å²	152	130.3 Å²	130.3	81%	0.813	83%	0.826	S	S	*	*			trans	-89.1	171.9	-162.5	-132.9	-49.3	0	0	0	114.9
639	N	36.8	Very low	34.2	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	83%	0.827	S	S	*	*			trans	-61.9	147.3	179	-60.9	-94.4	0	0	0	113
640	L	36	Very low	34.4	Very low	175 Å²	175	133.5 Å²	133.5	92%	0.916	83%	0.829	S	S	*	*			trans	-161.7	167	139.4	-111.5	166.3	0	0	0	112.6
641	V	36.1	Very low	35	Very low	121 Å²	121	135.2 Å²	135.2	73%	0.733	83%	0.828	S	S	*	*			trans	-117.1	140.1	-160.5	171.6	0	0	0	0	112.1
642	T	32.2	Very low	35.7	Very low	139 Å²	139	135 Å²	135	85%	0.853	82%	0.824	S	S	*	*			trans	-158.7	128.7	141.7	1	0	0	0	0	113.7
643	R	36.4	Very low	35.8	Very low	225 Å²	225	140.9 Å²	140.9	85%	0.849	82%	0.82	S	S	*	*			trans	-92.9	144.5	151.8	-86.5	172.4	150.6	-174.2	-4.2	107.7
644	S	31.9	Very low	36.5	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	82%	0.817	S	S	*	*			trans	-174.2	106.7	140.2	45.4	0	0	0	0	116
645	Y	34.7	Very low	36.7	Very low	212 Å²	212	147 Å²	147	83%	0.831	81%	0.813	S	S	*	*			trans	70.5	178.9	136.8	-58	-61.2	0	0	0	123
646	L	36.8	Very low	37.1	Very low	155 Å²	155	148 Å²	148	81%	0.812	82%	0.82	S	S	*	*			trans	-134.8	179.6	-146.2	-85.5	159.8	0	0	0	111.8
647	L	36.5	Very low	38.5	Very low	180 Å²	180	143.5 Å²	143.5	94%	0.942	81%	0.811	S	S	*	*			trans	84.5	142.5	172	-50.6	165.2	0	0	0	114.7
648	G	31.3	Very low	39	Very low	71 Å²	71	147.4 Å²	147.4	73%	0.732	81%	0.808	S	S	*	*			cis	-176.1	170.6	-3.3	0	0	0	0	0	113.7
649	N	35.6	Very low	39.5	Very low	165 Å²	165	146.5 Å²	146.5	88%	0.882	80%	0.804	S	S	*	*			trans	-34.7	145.8	-175.1	-67.9	0.7	0	0	0	119
650	S	35.8	Very low	39.4	Very low	120 Å²	120	145.4 Å²	145.4	84%	0.839	81%	0.806	S	S	*	*				-165.1	148.4	120.5	40.8	0	0	0	0	112.8
651	S	40.7	Very low	39.7	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	80%	0.795	S	S	*	*			trans	-107	163.6	172.5	-44.3	0	0	0	0	110.4
652	P	53.3	Low	39.9	Very low	131 Å²	131	143.2 Å²	143.2	85%	0.851	80%	0.797	S	S	*	*			trans	-113.3	164.5	147.5	35.6	-28.8	0	0	0	112.4
653	R	37.8	Very low	40.6	Very low	208 Å²	208	149 Å²	149	79%	0.785	82%	0.817	S	S	*	*			trans	-143	132.9	-174.8	175.7	-171.6	179.4	-166.7	3.5	109.6	Q655	R653-Q655 VanDerWaalsContact CZ-OE1 3.27Å
654	T	44.9	Very low	40.8	Very low	143 Å²	143	145.3 Å²	145.3	88%	0.877	82%	0.816	S	S	*	*			trans	-140.7	148.2	170.2	48.1	0	0	0	0	108.9
655	Q	39	Very low	41.3	Very low	155 Å²	155	147.9 Å²	147.9	72%	0.724	82%	0.824	S	S	*	*			trans	-147.1	152.7	-177.1	-69.8	-171.6	-112.7	0	0	111.7	R653	R653-Q655 VanDerWaalsContact CZ-OE1 3.27Å
656	S	42.4	Very low	41.7	Very low	116 Å²	116	144.3 Å²	144.3	81%	0.811	82%	0.823	S	S	*	*			trans	-123.9	142.2	-177.5	52.6	0	0	0	0	111.6
657	P	61.8	Low	42	Very low	113 Å²	113	143.7 Å²	143.7	73%	0.734	82%	0.824	S	S	*	*			trans	-117	178.1	-169.3	43.6	-35.2	0	0	0	115.8
658	Q	46.5	Very low	42.3	Very low	163 Å²	163	141.4 Å²	141.4	76%	0.762	82%	0.817	S	S	*	*			trans	79.5	140.9	162.7	-60.6	-172.6	-2	0	0	117.4
659	N	43.6	Very low	43	Very low	133 Å²	133	146.1 Å²	146.1	71%	0.711	82%	0.822	S	S	*	*			cis	-154.8	171.9	-7.8	-119	-8.2	0	0	0	114.9
660	C	33.7	Very low	43.6	Very low	118 Å²	118	144.8 Å²	144.8	80%	0.797	82%	0.818	S	S	*	*			trans	-43.2	176.9	166.8	-62.4	0	0	0	0	116.8
661	S	41.9	Very low	44.2	Very low	98 Å²	98	146.7 Å²	146.7	69%	0.685	82%	0.816	S	S	*	*			cis	165.4	144.9	-26.1	-178.2	0	0	0	0	107.3
662	I	42	Very low	44.4	Very low	152 Å²	152	149.3 Å²	149.3	78%	0.779	82%	0.817	S	S	*	*			trans	15.3	106.2	158.5	-57.8	162.8	0	0	0	116.9
663	M	46.4	Very low	43.6	Very low	261 Å²	261	150.9 Å²	150.9	100%	1.286	81%	0.814	S	S	*	*				-118.5	0	81.5	-92.9	-169.7	165.8	0	0	109.5

Retrieved 663 of 663 residues in 1330.1 ms (Link to these results)

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