A0A093HNQ0_STRCA Loading...

Voltage-dependent L-type calcium channel subunit beta-2

Beta subunit of voltage-dependent calcium channels which contributes to the function of the calcium channel by increasing peak calcium current. Plays a role in shifting voltage dependencies of activation and inactivation of the channel. May modulate G protein inhibition. May contribute to beta-adrenergic augmentation of Ca(2+) influx in cardiomyocytes, thereby regulating increases in heart rate and contractile force. Involved in membrane targeting of the alpha-1 subunit CACNA1C.

AlphaFold DB , UniProt , Accession A0A093HNQ0, Species STRCA (Struthio camelus australis), Gene n/a, Length 611 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.5	Very low	31	Very low	221 Å²	221	179.7 Å²	179.7	100%	1.089	85%	0.846	S	S	*	*				0	152.2	0	-60.6	-177	-167.2	0	0	108.6
2	K	30.4	Very low	31.2	Very low	185 Å²	185	173.5 Å²	173.5	80%	0.804	85%	0.848	S	S	*	*			trans	55.2	115.2	153.9	-61.9	167.4	-177.3	175.9	0	116.1
3	A	30.1	Very low	31.4	Very low	92 Å²	92	173.8 Å²	173.8	76%	0.76	84%	0.842	S	S	*	*				43.6	126	72.3	0	0	0	0	0	112.2
4	T	32.4	Very low	31.3	Very low	115 Å²	115	167.6 Å²	167.6	71%	0.706	85%	0.846	S	S	*	*			cis	-141.4	-172	33.6	-32.3	0	0	0	0	109.2
5	W	28.3	Very low	31.3	Very low	238 Å²	238	162 Å²	162	90%	0.902	85%	0.847	S	S	*	*				-168.4	147.2	75.5	-93.5	84.4	0	0	0	110.4
6	I	34.2	Very low	31.3	Very low	131 Å²	131	166.9 Å²	166.9	67%	0.672	85%	0.851	S	S	*	*			trans	-141.7	145.8	-176.5	-82.3	177.7	0	0	0	110
7	R	31.5	Very low	31.5	Very low	230 Å²	230	167.6 Å²	167.6	87%	0.868	86%	0.856	S	S	*	*			trans	76.3	116.3	178.9	-59	136.4	-174.3	176.2	2.1	117.3
8	L	31.4	Very low	31.8	Very low	170 Å²	170	168.8 Å²	168.8	89%	0.89	85%	0.854	S	S	*	*			trans	-143.8	167.3	133.6	-151.6	71.5	0	0	0	109.1
9	L	30.6	Very low	31.8	Very low	172 Å²	172	167.8 Å²	167.8	90%	0.901	85%	0.851	S	S	*	*			trans	81.5	85.3	-178.4	-63.1	164.7	0	0	0	117.3
10	K	31.2	Very low	31.9	Very low	212 Å²	212	164.3 Å²	164.3	92%	0.922	84%	0.842	S	S	*	*			trans	-148.9	146	146.3	-153.4	167.7	-170.8	172.2	0	108.6
11	R	29.8	Very low	32.2	Very low	211 Å²	211	164.4 Å²	164.4	80%	0.796	85%	0.845	S	S	*	*			trans	90.6	95.4	173.3	-162.1	-170.2	-164.6	106.7	-11.7	117.4
12	A	32.9	Very low	32.6	Very low	105 Å²	105	161.6 Å²	161.6	87%	0.868	83%	0.832	S	S	*	*			trans	-111.4	157.9	134.9	0	0	0	0	0	108.2
13	K	34.4	Very low	32.7	Very low	178 Å²	178	158.9 Å²	158.9	77%	0.774	84%	0.835	S	S	*	*			trans	-132.1	138.7	-178.6	-101.2	-162.9	175.4	-166.9	0	110.8
14	G	29.9	Very low	32.9	Very low	87 Å²	87	157.5 Å²	157.5	90%	0.897	83%	0.831	S	S	*	*			trans	94.1	109	133.6	0	0	0	0	0	118
15	G	30.6	Very low	33.1	Very low	83 Å²	83	158.1 Å²	158.1	86%	0.856	84%	0.84	S	S	*	*			trans	-135.7	134.2	148.8	0	0	0	0	0	107.6
16	R	31.4	Very low	33.9	Very low	241 Å²	241	150.7 Å²	150.7	91%	0.909	83%	0.829	S	S	*	*			trans	-142.3	120	-176.8	-172.8	-170.5	-166.3	-167.3	6.9	110
17	L	34.4	Very low	34.4	Very low	178 Å²	178	151.6 Å²	151.6	93%	0.932	84%	0.835	S	S	*	*			trans	-125.8	167.6	166.3	-73.1	173.7	0	0	0	109.9
18	K	37.4	Very low	35.3	Very low	190 Å²	190	146.2 Å²	146.2	83%	0.826	83%	0.832	S	S	*	*			trans	-104.8	172.2	-165.9	-92.6	-172.8	170	-172.5	0	112.9
19	N	31.5	Very low	35.6	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	83%	0.828	S	S	*	*			trans	109.3	140.2	160.1	-57	-6.9	0	0	0	113.1
20	S	34.3	Very low	36.6	Very low	97 Å²	97	145.3 Å²	145.3	68%	0.678	82%	0.821	S	S	*	*			cis	-167.7	145.5	-20.7	43.2	0	0	0	0	108.1	I22	S20-I22 PolarHBondContact O-N 2.72Å
21	D	38.5	Very low	37.6	Very low	167 Å²	167	140.5 Å²	140.5	89%	0.893	81%	0.813	S	S	*	*			trans	-67.4	127	-168.9	-49	-91	0	0	0	114.1
22	I	38.8	Very low	38.8	Very low	162 Å²	162	139.9 Å²	139.9	83%	0.831	81%	0.811	S	S	*	*			trans	-136.3	137.6	164.3	-63	-175.2	0	0	0	109.9	S20	S20-I22 PolarHBondContact O-N 2.72Å
23	C	33.8	Very low	39.8	Very low	128 Å²	128	139.8 Å²	139.8	87%	0.865	80%	0.802	S	S	*	*			trans	-51.3	154	178.1	-175.1	0	0	0	0	116
24	G	34	Very low	40.4	Very low	64 Å²	64	134.7 Å²	134.7	66%	0.66	79%	0.789	S	S	*	*			trans	152.3	104.4	146.2	0	0	0	0	0	117.5
25	S	36.2	Very low	41.6	Very low	128 Å²	128	136.9 Å²	136.9	90%	0.895	78%	0.78	S	S	*	*			trans	50.6	144.6	151.7	-59.4	0	0	0	0	122.3
26	A	45.3	Very low	42.7	Very low	82 Å²	82	136.8 Å²	136.8	68%	0.678	77%	0.766	S	S	*	*			trans	-76.7	146.7	154	0	0	0	0	0	110.1
27	D	44.4	Very low	43.8	Very low	149 Å²	149	130.2 Å²	130.2	80%	0.797	75%	0.749	S	S	*	*				-178.7	148.6	113	-92.6	-24.4	0	0	0	113.1	Y29	D27-Y29 PolarHBondContact O-N 2.62Å
28	S	49.6	Very low	44.9	Very low	117 Å²	117	125.2 Å²	125.2	82%	0.818	73%	0.725	S	S	*	*			trans	40.8	72.7	151.7	-56.9	0	0	0	0	119	T30	S28-T30 PolarHBondContact O-N 2.73Å
29	Y	38.4	Very low	46	Very low	201 Å²	201	118.9 Å²	118.9	79%	0.788	71%	0.705	S	S	*	*			trans	-83.6	110.4	159.9	-142.8	-92.3	0	0	0	110.7	D27 S31	D27-Y29 PolarHBondContact O-N 2.62Å; Y29-S31 PolarHBondContact O-N 2.74Å
30	T	51.4	Low	47.5	Very low	123 Å²	123	116.1 Å²	116.1	76%	0.755	69%	0.69	S	S	*	*			trans	-66.9	120.1	163.1	161.1	0	0	0	0	108.6	S28 R32	S28-T30 PolarHBondContact O-N 2.73Å; T30-R32 PolarHBondContact O-N 3.49Å
31	S	52	Low	48.8	Very low	110 Å²	110	117.5 Å²	117.5	77%	0.769	69%	0.686	S	S	*	*			trans	-68.3	89.1	-177.3	-61.3	0	0	0	0	111.4	Y29	Y29-S31 PolarHBondContact O-N 2.74Å
32	R	56.5	Low	50.1	Low	198 Å²	198	116.1 Å²	116.1	75%	0.747	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-51.4	129	157.3	-91.8	-178.4	156.9	-154.6	-7.7	108.7	T30	T30-R32 PolarHBondContact O-N 3.49Å
33	P	52.4	Low	51.9	Low	103 Å²	103	113 Å²	113	67%	0.669	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-62.5	140.2	162.3	28.9	-33	0	0	0	108.5
34	S	48.3	Very low	54.2	Low	72 Å²	72	114.8 Å²	114.8	50%	0.503	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-73.8	129.9	178.5	-60.8	0	0	0	0	110.3	S36 D37	S34-S36 PolarHBondContact O-N 2.71Å; S34-D37 PolarHBondContact O-N 2.78Å
35	D	54.4	Low	56.5	Low	132 Å²	132	115.1 Å²	115.1	71%	0.706	63%	0.632	S	S	*	*	H	α-helix	trans	-54.1	-23.4	175.9	-72.3	-58.5	0	0	0	113.2	V38 S39	D35-V38 VanDerWaalsContact O-CG2 3.26Å; D35-V38 WeakPolarHBondContact O-CG2 3.48Å; D35-S39 WeakPolarHBondContact O-CB 3.2Å; D35-S39 PolarHBondContact O-N 3.33Å
36	S	54.2	Low	58.8	Low	82 Å²	82	111 Å²	111	57%	0.573	61%	0.606	S	S	*	*	H	α-helix	trans	-72.1	-24.2	175.7	60.2	0	0	0	0	115.2	S34 L40	S34-S36 PolarHBondContact O-N 2.71Å; S36-L40 WeakPolarHBondContact O-CG 3.33Å
37	D	53.9	Low	60.9	Low	103 Å²	103	112.2 Å²	112.2	55%	0.551	60%	0.604	S	S	*	*	H	α-helix	trans	-84.6	-45.7	-179.7	-123.9	-20.4	0	0	0	110.1	S34 S39 L40 E41	S34-D37 PolarHBondContact O-N 2.78Å; D37-S39 VanDerWaalsContact C-N 3.27Å; D37-S39 PolarHBondContact O-N 3.46Å; D37-L40 PolarHBondContact O-N 3.2Å; D37-E41 PolarHBondContact O-N 3.23Å
38	V	57.8	Low	62.9	Low	72 Å²	72	112.1 Å²	112.1	44%	0.436	59%	0.593	S	S	.	*	H	α-helix	trans	-59.7	-37	175.9	-63.3	0	0	0	0	112	D35 L40 E41 E42	D35-V38 VanDerWaalsContact O-CG2 3.26Å; D35-V38 WeakPolarHBondContact O-CG2 3.48Å; V38-L40 VanDerWaalsContact C-N 3.33Å; V38-L40 PolarHBondContact O-N 3.05Å; V38-E41 PolarHBondContact O-N 2.96Å; V38-E42 VanDerWaalsContact O-CB 3.28Å; V38-E42 WeakPolarHBondContact O-CB 3.17Å; V38-E42 PolarHBondContact O-N 3.21Å
39	S	60.1	Low	64.8	Low	57 Å²	57	113.3 Å²	113.3	40%	0.399	58%	0.58	S	S	.	*	H	α-helix	trans	-64.5	-33.6	173.9	172.8	0	0	0	0	113	D35 D37 D43	D35-S39 WeakPolarHBondContact O-CB 3.2Å; D35-S39 PolarHBondContact O-N 3.33Å; D37-S39 VanDerWaalsContact C-N 3.27Å; D37-S39 PolarHBondContact O-N 3.46Å; S39-D43 WeakPolarHBondContact O-CB 3.19Å; S39-D43 PolarHBondContact O-N 3.21Å
40	L	63.1	Low	67.4	Low	92 Å²	92	107.1 Å²	107.1	48%	0.482	56%	0.558	S	S	.	*	H	α-helix	trans	-81	-24.8	178.2	-70.3	174.6	0	0	0	112.9	S36 D37 V38 R44	S36-L40 WeakPolarHBondContact O-CG 3.33Å; D37-L40 PolarHBondContact O-N 3.2Å; V38-L40 VanDerWaalsContact C-N 3.33Å; V38-L40 PolarHBondContact O-N 3.05Å; L40-R44 VanDerWaalsContact O-CD 3.31Å; L40-R44 WeakPolarHBondContact O-CD 3.2Å; L40-R44 VanDerWaalsContact O-CG 3.23Å; L40-R44 WeakPolarHBondContact O-CG 3.37Å; L40-R44 PolarHBondContact O-N 3.46Å
41	E	62	Low	69.3	Low	126 Å²	126	103.8 Å²	103.8	59%	0.589	54%	0.542	S	S	*	.	H	α-helix	trans	-76.1	-40.2	167.5	-64	-158.3	129.6	0	0	111.4	D37 V38 R44 E45	D37-E41 PolarHBondContact O-N 3.23Å; V38-E41 PolarHBondContact O-N 2.96Å; E41-R44 PolarHBondContact O-N 2.87Å; E41-E45 WeakPolarHBondContact O-CB 3.42Å; E41-E45 PolarHBondContact O-N 3.45Å
42	E	66.2	Low	71.2	Confident	137 Å²	137	102 Å²	102	64%	0.64	52%	0.522	S	S	*	.	H	α-helix	trans	-62.1	-43.7	175.1	-174.1	168	-159.1	0	0	112	V38 R44 E45 A46	V38-E42 VanDerWaalsContact O-CB 3.28Å; V38-E42 WeakPolarHBondContact O-CB 3.17Å; V38-E42 PolarHBondContact O-N 3.21Å; E42-R44 VanDerWaalsContact C-N 3.32Å; E42-R44 PolarHBondContact O-N 2.93Å; E42-E45 PolarHBondContact O-N 3.33Å; E42-A46 VanDerWaalsContact O-CB 3.24Å; E42-A46 WeakPolarHBondContact O-CB 3.48Å; E42-A46 PolarHBondContact O-N 3.34Å
43	D	75.8	Confident	73.1	Confident	98 Å²	98	99.1 Å²	99.1	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-57.3	-42.7	172.2	-88.8	-16.9	0	0	0	112.1	S39 V47	S39-D43 WeakPolarHBondContact O-CB 3.19Å; S39-D43 PolarHBondContact O-N 3.21Å; D43-V47 WeakPolarHBondContact O-CG2 3.44Å; D43-V47 PolarHBondContact O-N 3.39Å
44	R	81.4	Confident	75.1	Confident	165 Å²	165	99.5 Å²	99.5	62%	0.623	50%	0.504	S	S	*	.	H	α-helix	trans	-68	-41.1	178.4	-73	167.7	-176.4	165.7	5.3	111.9	L40 E41 E42 V47 R48	L40-R44 VanDerWaalsContact O-CD 3.31Å; L40-R44 WeakPolarHBondContact O-CD 3.2Å; L40-R44 VanDerWaalsContact O-CG 3.23Å; L40-R44 WeakPolarHBondContact O-CG 3.37Å; L40-R44 PolarHBondContact O-N 3.46Å; E41-R44 PolarHBondContact O-N 2.87Å; E42-R44 VanDerWaalsContact C-N 3.32Å; E42-R44 PolarHBondContact O-N 2.93Å; R44-V47 PolarHBondContact O-N 3.27Å; R44-R48 PolarHBondContact O-N 2.79Å
45	E	82.6	Confident	77.3	Confident	71 Å²	71	96.1 Å²	96.1	33%	0.332	48%	0.481	S	S	.	.	H	α-helix	trans	-70.7	-35.5	178.6	-159.8	61.4	-128.4	0	0	111.4	E41 E42 R48 R49	E41-E45 WeakPolarHBondContact O-CB 3.42Å; E41-E45 PolarHBondContact O-N 3.45Å; E42-E45 PolarHBondContact O-N 3.33Å; E45-R48 PolarHBondContact O-N 3.13Å; E45-R48 IonicContact OE1-CZ 2.69Å; E45-R48 IonicContact OE1-NE 3.73Å; E45-R48 IonicContact OE1-NH1 2.78Å; E45-R48 PolarHBondContact OE1-NH1 2.95Å; E45-R48 IonicContact OE2-CZ 2.74Å; E45-R48 VanDerWaalsContact OE2-CZ 3.3Å; E45-R48 IonicContact OE2-NH1 2.78Å; E45-R48 PolarHBondContact OE2-NH1 3.44Å; E45-R48 IonicContact OE2-NH2 2.65Å; E45-R49 VanDerWaalsContact O-CB 3.28Å; E45-R49 WeakPolarHBondContact O-CB 3.5Å; E45-R49 PolarHBondContact O-N 3.47Å
46	A	85.6	Confident	79.3	Confident	42 Å²	42	92.4 Å²	92.4	35%	0.347	46%	0.459	S	S	.	.	H	α-helix	trans	-63	-45.2	171	0	0	0	0	0	111.5	E42 R48 R49 E50	E42-A46 VanDerWaalsContact O-CB 3.24Å; E42-A46 WeakPolarHBondContact O-CB 3.48Å; E42-A46 PolarHBondContact O-N 3.34Å; A46-R48 PolarHBondContact O-N 3.33Å; A46-R49 PolarHBondContact O-N 3.07Å; A46-E50 VanDerWaalsContact O-CB 3.26Å; A46-E50 WeakPolarHBondContact O-CB 3.43Å; A46-E50 PolarHBondContact O-N 2.92Å
47	V	88.7	Confident	81.3	Confident	106 Å²	106	91.3 Å²	91.3	64%	0.642	46%	0.455	S	S	*	.	H	α-helix	trans	-63	-38.5	174.2	168.9	0	0	0	0	112	D43 R44 A51	D43-V47 WeakPolarHBondContact O-CG2 3.44Å; D43-V47 PolarHBondContact O-N 3.39Å; R44-V47 PolarHBondContact O-N 3.27Å; V47-A51 WeakPolarHBondContact O-CB 3.16Å; V47-A51 PolarHBondContact O-N 3.15Å
48	R	86.8	Confident	83.2	Confident	147 Å²	147	89.3 Å²	89.3	56%	0.555	44%	0.442	S	S	*	.	H	α-helix	trans	-63	-51.1	174.1	-171.7	-170.7	-61.6	143	7	111.3	R44 E45 A46 E50 A51 E52	R44-R48 PolarHBondContact O-N 2.79Å; E45-R48 PolarHBondContact O-N 3.13Å; E45-R48 IonicContact OE1-CZ 2.69Å; E45-R48 IonicContact OE1-NE 3.73Å; E45-R48 IonicContact OE1-NH1 2.78Å; E45-R48 PolarHBondContact OE1-NH1 2.95Å; E45-R48 IonicContact OE2-CZ 2.74Å; E45-R48 VanDerWaalsContact OE2-CZ 3.3Å; E45-R48 IonicContact OE2-NH1 2.78Å; E45-R48 PolarHBondContact OE2-NH1 3.44Å; E45-R48 IonicContact OE2-NH2 2.65Å; A46-R48 PolarHBondContact O-N 3.33Å; R48-E50 VanDerWaalsContact C-N 3.28Å; R48-E50 PolarHBondContact O-N 3.47Å; R48-A51 PolarHBondContact O-N 3.48Å; R48-A51 VanDerWaalsContact O-N 3.13Å; R48-E52 PolarHBondContact O-N 3.17Å
49	R	89.4	Confident	85	Confident	143 Å²	143	85.9 Å²	85.9	54%	0.54	42%	0.421	S	S	.	.	H	α-helix	trans	-62	-34.9	179.8	-167.5	-176.1	-57.6	113.7	2.9	112.5	E45 A46 R53	E45-R49 VanDerWaalsContact O-CB 3.28Å; E45-R49 WeakPolarHBondContact O-CB 3.5Å; E45-R49 PolarHBondContact O-N 3.47Å; A46-R49 PolarHBondContact O-N 3.07Å; R49-R53 WeakPolarHBondContact O-CB 3.43Å; R49-R53 PolarHBondContact O-N 3.12Å
50	E	91.8	Very high	86.6	Confident	70 Å²	70	87.1 Å²	87.1	33%	0.327	42%	0.421	S	S	.	.	H	α-helix	trans	-65.2	-47.2	172.2	178.7	56.3	-144.6	0	0	111.5	A46 R48 R53 Q54	A46-E50 VanDerWaalsContact O-CB 3.26Å; A46-E50 WeakPolarHBondContact O-CB 3.43Å; A46-E50 PolarHBondContact O-N 2.92Å; R48-E50 VanDerWaalsContact C-N 3.28Å; R48-E50 PolarHBondContact O-N 3.47Å; E50-R53 PolarHBondContact O-N 2.93Å; E50-R53 IonicContact OE1-CZ 2.78Å; E50-R53 IonicContact OE1-NH1 3.19Å; E50-R53 IonicContact OE1-NH2 2.9Å; E50-R53 PolarHBondContact OE1-NH2 3.33Å; E50-R53 IonicContact OE2-CZ 2.67Å; E50-R53 VanDerWaalsContact OE2-CZ 3.26Å; E50-R53 IonicContact OE2-NE 3.8Å; E50-R53 IonicContact OE2-NH2 3.03Å; E50-R53 PolarHBondContact OE2-NH2 3.34Å; E50-Q54 WeakPolarHBondContact O-CG 3.3Å; E50-Q54 PolarHBondContact O-N 3.21Å; E50-Q54 PolarHBondContact OE1-NE2 3.11Å
51	A	91.4	Very high	88.1	Confident	53 Å²	53	89.8 Å²	89.8	44%	0.438	43%	0.428	S	S	.	.	H	α-helix	trans	-63.8	-40.5	177.3	0	0	0	0	0	112.5	V47 R48 Q54 A55	V47-A51 WeakPolarHBondContact O-CB 3.16Å; V47-A51 PolarHBondContact O-N 3.15Å; R48-A51 PolarHBondContact O-N 3.48Å; R48-A51 VanDerWaalsContact O-N 3.13Å; A51-Q54 PolarHBondContact O-N 3.11Å; A51-A55 WeakPolarHBondContact O-CB 3.17Å; A51-A55 PolarHBondContact O-N 3.21Å
52	E	93.8	Very high	89.6	Confident	73 Å²	73	83.8 Å²	83.8	34%	0.341	40%	0.4	S	S	.	.	H	α-helix	trans	-60.4	-47.4	172.6	-176.1	-175	170	0	0	111.2	R48 Q54 A55 Q56 V87	R48-E52 PolarHBondContact O-N 3.17Å; E52-Q54 VanDerWaalsContact C-N 3.29Å; E52-Q54 PolarHBondContact O-N 2.91Å; E52-A55 WeakPolarHBondContact O-CB 2.98Å; E52-A55 PolarHBondContact O-N 3.02Å; E52-A55 VanDerWaalsContact O-N 3.14Å; E52-Q56 PolarHBondContact O-N 3.41Å; E52-V87 HydrophobicContact CG-CB 4.47Å; E52-V87 HydrophobicContact CG-CG1 4.21Å; E52-V87 HydrophobicContact CG-CG2 4.25Å
53	R	94.6	Very high	90.9	Very high	138 Å²	138	79.1 Å²	79.1	52%	0.521	38%	0.378	S	S	.	.	H	α-helix	trans	-61.8	-36.2	176.4	-168.4	-176.9	56.2	49.7	-14.5	112.2	R49 E50 A57	R49-R53 WeakPolarHBondContact O-CB 3.43Å; R49-R53 PolarHBondContact O-N 3.12Å; E50-R53 PolarHBondContact O-N 2.93Å; E50-R53 IonicContact OE1-CZ 2.78Å; E50-R53 IonicContact OE1-NH1 3.19Å; E50-R53 IonicContact OE1-NH2 2.9Å; E50-R53 PolarHBondContact OE1-NH2 3.33Å; E50-R53 IonicContact OE2-CZ 2.67Å; E50-R53 VanDerWaalsContact OE2-CZ 3.26Å; E50-R53 IonicContact OE2-NE 3.8Å; E50-R53 IonicContact OE2-NH2 3.03Å; E50-R53 PolarHBondContact OE2-NH2 3.34Å; R53-A57 WeakPolarHBondContact O-CB 3.28Å; R53-A57 PolarHBondContact O-N 2.96Å
54	Q	94.9	Very high	91.6	Very high	110 Å²	110	79.3 Å²	79.3	51%	0.514	38%	0.383	S	S	.	.	H	α-helix	trans	-68.6	-41.3	173.6	-71.1	176.9	23.2	0	0	111.8	E50 A51 E52 A57 Q58	E50-Q54 WeakPolarHBondContact O-CG 3.3Å; E50-Q54 PolarHBondContact O-N 3.21Å; E50-Q54 PolarHBondContact OE1-NE2 3.11Å; A51-Q54 PolarHBondContact O-N 3.11Å; E52-Q54 VanDerWaalsContact C-N 3.29Å; E52-Q54 PolarHBondContact O-N 2.91Å; Q54-A57 PolarHBondContact O-N 3.36Å; Q54-Q58 PolarHBondContact O-N 2.99Å
55	A	95.6	Very high	92.2	Very high	2 Å²	2	73.9 Å²	73.9	2%	0.017	36%	0.364	C	S	.	.	H	α-helix	trans	-62.4	-44.1	175.7	0	0	0	0	0	111.8	A51 E52 Q58 L59 P86 V87 F106 F124	A51-A55 WeakPolarHBondContact O-CB 3.17Å; A51-A55 PolarHBondContact O-N 3.21Å; E52-A55 WeakPolarHBondContact O-CB 2.98Å; E52-A55 PolarHBondContact O-N 3.02Å; E52-A55 VanDerWaalsContact O-N 3.14Å; A55-Q58 PolarHBondContact O-N 3.45Å; A55-L59 WeakPolarHBondContact O-CB 3.45Å; A55-L59 PolarHBondContact O-N 2.93Å; A55-P86 HydrophobicContact CB-CB 3.84Å; A55-V87 HydrophobicContact CB-CG2 3.74Å; A55-F106 HydrophobicContact CB-CE2 4Å; A55-F106 HydrophobicContact CB-CZ 3.69Å; A55-F124 HydrophobicContact CB-CZ 4.12Å
56	Q	95.7	Very high	92.7	Very high	54 Å²	54	75.6 Å²	75.6	25%	0.252	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-42.4	175.1	-172.5	60.5	26.3	0	0	112	E52 Q58 L59 E60 V87	E52-Q56 PolarHBondContact O-N 3.41Å; Q56-Q58 VanDerWaalsContact C-N 3.28Å; Q56-Q58 PolarHBondContact O-N 2.83Å; Q56-L59 WeakPolarHBondContact O-CB 3.46Å; Q56-L59 PolarHBondContact O-N 3.39Å; Q56-L59 VanDerWaalsContact O-N 3.15Å; Q56-E60 PolarHBondContact NE2-OE1 3.43Å; Q56-E60 VanDerWaalsContact NE2-OE1 3.11Å; Q56-E60 PolarHBondContact O-N 3.21Å; Q56-V87 HydrophobicContact CB-CG2 4.02Å
57	A	95.4	Very high	93.3	Very high	58 Å²	58	74.3 Å²	74.3	48%	0.479	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-34.6	176	0	0	0	0	0	112.4	R53 Q54 K61	R53-A57 WeakPolarHBondContact O-CB 3.28Å; R53-A57 PolarHBondContact O-N 2.96Å; Q54-A57 PolarHBondContact O-N 3.36Å; A57-K61 VanDerWaalsContact O-CB 3.31Å; A57-K61 WeakPolarHBondContact O-CB 3.4Å; A57-K61 PolarHBondContact O-N 3.42Å; A57-K61 VanDerWaalsContact O-N 3.13Å
58	Q	95.7	Very high	93.7	Very high	61 Å²	61	72.4 Å²	72.4	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-70.9	-38.4	172.6	-174.9	168.7	-9.8	0	0	112.3	Q54 A55 Q56 K61 A62 E104 F106 I112	Q54-Q58 PolarHBondContact O-N 2.99Å; A55-Q58 PolarHBondContact O-N 3.45Å; Q56-Q58 VanDerWaalsContact C-N 3.28Å; Q56-Q58 PolarHBondContact O-N 2.83Å; Q58-K61 CarbonylContact O-C 3.55Å; Q58-K61 PolarHBondContact O-N 3.44Å; Q58-A62 WeakPolarHBondContact O-CB 3.15Å; Q58-A62 PolarHBondContact O-N 3.44Å; Q58-E104 WeakPolarHBondContact CG-OE1 3.36Å; Q58-E104 VanDerWaalsContact NE2-CD 3.35Å; Q58-E104 PolarHBondContact NE2-OE1 3.22Å; Q58-F106 HydrophobicContact CG-CD2 4.4Å; Q58-I112 HydrophobicContact CG-CD1 3.96Å
59	L	95.1	Very high	94.2	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-62	-46.9	177.2	-173.7	61.8	0	0	0	111.8	A55 Q56 A62 K63 M90 I112 I122 F124	A55-L59 WeakPolarHBondContact O-CB 3.45Å; A55-L59 PolarHBondContact O-N 2.93Å; Q56-L59 WeakPolarHBondContact O-CB 3.46Å; Q56-L59 PolarHBondContact O-N 3.39Å; Q56-L59 VanDerWaalsContact O-N 3.15Å; L59-A62 WeakPolarHBondContact O-CB 3.34Å; L59-A62 PolarHBondContact O-N 2.91Å; L59-A62 VanDerWaalsContact O-N 3.1Å; L59-K63 PolarHBondContact O-N 3.27Å; L59-M90 HydrophobicContact CD2-CB 4.16Å; L59-M90 HydrophobicContact CD2-CE 3.68Å; L59-M90 HydrophobicContact CD2-CG 4.34Å; L59-I112 HydrophobicContact CD1-CG1 4.16Å; L59-I112 HydrophobicContact CD1-CG2 3.65Å; L59-I122 HydrophobicContact CD1-CB 4.4Å; L59-I122 HydrophobicContact CD1-CD1 4.48Å; L59-I122 HydrophobicContact CD1-CG1 4.1Å; L59-I122 HydrophobicContact CD1-CG2 3.76Å; L59-I122 HydrophobicContact CG-CG2 3.99Å; L59-F124 HydrophobicContact CB-CZ 4.38Å; L59-F124 HydrophobicContact CD2-CD2 4.48Å; L59-F124 HydrophobicContact CD2-CE2 3.91Å; L59-F124 HydrophobicContact CD2-CZ 4.47Å
60	E	93.6	Very high	94.6	Very high	84 Å²	84	62 Å²	62	39%	0.393	33%	0.328	S	S	.	.	H	α-helix	trans	-61.1	-45.2	173	-67.5	-54.9	132.9	0	0	111.6	Q56 A62 K63	Q56-E60 PolarHBondContact NE2-OE1 3.43Å; Q56-E60 VanDerWaalsContact NE2-OE1 3.11Å; Q56-E60 PolarHBondContact O-N 3.21Å; E60-A62 PolarHBondContact O-N 2.92Å; E60-A62 VanDerWaalsContact O-N 3.11Å; E60-K63 WeakPolarHBondContact O-CB 3.45Å; E60-K63 PolarHBondContact O-N 3.3Å; E60-K63 VanDerWaalsContact O-N 3.1Å; E60-K63 WeakPolarHBondContact OE1-CE 3.25Å; E60-K63 IonicContact OE1-NZ 3.54Å; E60-K63 PolarHBondContact OE1-NZ 3.41Å; E60-K63 WeakPolarHBondContact OE2-CD 3.39Å; E60-K63 WeakPolarHBondContact OE2-CE 3.23Å; E60-K63 IonicContact OE2-NZ 3.55Å; E60-K63 PolarHBondContact OE2-NZ 3.1Å
61	K	94.1	Very high	94.9	Very high	147 Å²	147	58.7 Å²	58.7	64%	0.639	31%	0.313	S	S	*	.	H	α-helix	trans	-61.2	-19.6	175.2	-175.5	173.6	179.7	178.7	0	113.2	A57 Q58 K65	A57-K61 VanDerWaalsContact O-CB 3.31Å; A57-K61 WeakPolarHBondContact O-CB 3.4Å; A57-K61 PolarHBondContact O-N 3.42Å; A57-K61 VanDerWaalsContact O-N 3.13Å; Q58-K61 CarbonylContact O-C 3.55Å; Q58-K61 PolarHBondContact O-N 3.44Å; K61-K65 WeakPolarHBondContact O-CE 3.48Å
62	A	94.7	Very high	95.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-87.9	-15.1	178	0	0	0	0	0	114.3	Q58 L59 E60 T64 K65 K103 I112 I122	Q58-A62 WeakPolarHBondContact O-CB 3.15Å; Q58-A62 PolarHBondContact O-N 3.44Å; L59-A62 WeakPolarHBondContact O-CB 3.34Å; L59-A62 PolarHBondContact O-N 2.91Å; L59-A62 VanDerWaalsContact O-N 3.1Å; E60-A62 PolarHBondContact O-N 2.92Å; E60-A62 VanDerWaalsContact O-N 3.11Å; A62-T64 VanDerWaalsContact C-N 3.27Å; A62-T64 PolarHBondContact O-N 3.06Å; A62-K65 HydrophobicContact CB-CD 4.17Å; A62-K65 PolarHBondContact O-N 3.46Å; A62-K103 HydrophobicContact CB-CB 4.44Å; A62-I112 HydrophobicContact CB-CG2 3.47Å; A62-I112 VanDerWaalsContact CB-CG2 3.47Å; A62-I122 VanDerWaalsContact C-CD1 3.47Å; A62-I122 HydrophobicContact CB-CD1 3.59Å; A62-I122 WeakPolarHBondContact O-CD1 3.25Å
63	K	91.9	Very high	95.3	Very high	39 Å²	39	54.2 Å²	54.2	17%	0.17	28%	0.281	C	S	.	.	H	α-helix	trans	-56	-41.5	176.2	-69.7	-177.6	-178.7	175	0	112.2	L59 E60 E121 I122	L59-K63 PolarHBondContact O-N 3.27Å; E60-K63 WeakPolarHBondContact O-CB 3.45Å; E60-K63 PolarHBondContact O-N 3.3Å; E60-K63 VanDerWaalsContact O-N 3.1Å; E60-K63 WeakPolarHBondContact OE1-CE 3.25Å; E60-K63 IonicContact OE1-NZ 3.54Å; E60-K63 PolarHBondContact OE1-NZ 3.41Å; E60-K63 WeakPolarHBondContact OE2-CD 3.39Å; E60-K63 WeakPolarHBondContact OE2-CE 3.23Å; E60-K63 IonicContact OE2-NZ 3.55Å; E60-K63 PolarHBondContact OE2-NZ 3.1Å; K63-E121 WeakPolarHBondContact CE-OE2 3.43Å; K63-E121 IonicContact NZ-OE2 3.33Å; K63-E121 PolarHBondContact NZ-OE2 2.83Å; K63-E121 VanDerWaalsContact NZ-OE2 3.12Å; K63-I122 HydrophobicContact CD-CG2 4.19Å; K63-I122 HydrophobicContact CG-CB 4.38Å; K63-I122 HydrophobicContact CG-CG2 3.5Å; K63-I122 VanDerWaalsContact CG-CG2 3.5Å
64	T	90.9	Very high	95.3	Very high	103 Å²	103	49.9 Å²	49.9	63%	0.632	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.3	-178.3	56.7	0	0	0	0	114.8	A62	A62-T64 VanDerWaalsContact C-N 3.27Å; A62-T64 PolarHBondContact O-N 3.06Å
65	K	93.9	Very high	95.3	Very high	50 Å²	50	47.6 Å²	47.6	22%	0.217	26%	0.262	C	S	.	.	S	Bend	trans	-74	151	176.3	-69.3	177.4	-170	169.3	0	110.7	K61 A62 K103 E104	K61-K65 WeakPolarHBondContact O-CE 3.48Å; A62-K65 HydrophobicContact CB-CD 4.17Å; A62-K65 PolarHBondContact O-N 3.46Å; K65-K103 HydrophobicContact CB-CB 4.48Å; K65-K103 WeakPolarHBondContact O-CD 3.5Å; K65-K103 WeakPolarHBondContact O-CE 3.18Å; K65-K103 PolarHBondContact O-NZ 3.35Å; K65-E104 IonicContact NZ-OE1 3.26Å; K65-E104 PolarHBondContact NZ-OE1 3.01Å; K65-E104 IonicContact NZ-OE2 3.93Å; K65-E104 PolarHBondContact NZ-OE2 3.07Å
66	P	94.4	Very high	95.3	Very high	108 Å²	108	49.8 Å²	49.8	70%	0.701	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-62.2	163.6	167.6	28.8	-35.4	0	0	0	111.1	A68 K103	P66-A68 PolarHBondContact O-N 2.99Å; P66-K103 VanDerWaalsContact O-CD 3.25Å; P66-K103 WeakPolarHBondContact O-CD 3.49Å
67	V	96.8	Very high	95.2	Very high	14 Å²	14	48.2 Å²	48.2	9%	0.085	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-73.8	122.7	168.3	178.9	0	0	0	0	107.9	F69 H101 K103 L320	V67-F69 WeakPolarHBondContact CG1-O 3.31Å; V67-H101 HydrophobicContact CG1-CB 4.02Å; V67-H101 HydrophobicContact CG2-CB 3.97Å; V67-K103 HydrophobicContact CG2-CD 4.32Å; V67-L320 HydrophobicContact CG2-CD1 4.04Å; V67-L320 HydrophobicContact CG2-CD2 4.37Å
68	A	96.4	Very high	95.1	Very high	66 Å²	66	49.9 Å²	49.9	55%	0.545	29%	0.285	S	S	.	.			trans	-79.3	-41.5	179.9	0	0	0	0	0	111.4	P66 V102	P66-A68 PolarHBondContact O-N 2.99Å; A68-V102 PolarHBondContact N-O 3.5Å
69	F	97.3	Very high	94.7	Very high	66 Å²	66	48.8 Å²	48.8	29%	0.289	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	166.1	171.9	61.1	-85	0	0	0	110.1	V67 V71 V102 W111	V67-F69 WeakPolarHBondContact CG1-O 3.31Å; F69-V71 HydrophobicContact CD2-CG1 3.94Å; F69-V71 HydrophobicContact CE2-CG1 3.83Å; F69-V102 HydrophobicContact CD1-CB 4.27Å; F69-V102 HydrophobicContact CD1-CG1 4.45Å; F69-V102 HydrophobicContact CD2-CB 4.21Å; F69-V102 HydrophobicContact CD2-CG2 4.2Å; F69-V102 HydrophobicContact CE1-CB 3.93Å; F69-V102 HydrophobicContact CE1-CG1 3.73Å; F69-V102 HydrophobicContact CE2-CB 3.88Å; F69-V102 HydrophobicContact CE2-CG1 4.29Å; F69-V102 HydrophobicContact CE2-CG2 3.65Å; F69-V102 HydrophobicContact CG-CB 4.4Å; F69-V102 HydrophobicContact CZ-CB 3.73Å; F69-V102 HydrophobicContact CZ-CG1 3.63Å; F69-V102 HydrophobicContact CZ-CG2 3.85Å; F69-V102 PolarHBondContact N-O 2.88Å; F69-V102 PolarHBondContact O-N 2.87Å; F69-W111 HydrophobicContact CE2-CE3 4.39Å; F69-W111 HydrophobicContact CE2-CH2 4.07Å; F69-W111 AromaticContact CE2-CZ3 3.86Å; F69-W111 HydrophobicContact CE2-CZ3 3.86Å; F69-W111 HydrophobicContact CZ-CD2 4.45Å; F69-W111 HydrophobicContact CZ-CE3 4.17Å; F69-W111 HydrophobicContact CZ-CH2 4.04Å; F69-W111 HydrophobicContact CZ-CZ2 4.34Å; F69-W111 AromaticContact CZ-CZ3 3.96Å; F69-W111 HydrophobicContact CZ-CZ3 3.96Å
70	A	98.1	Very high	94.1	Very high	5 Å²	5	51 Å²	51	4%	0.041	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	155.2	170.1	0	0	0	0	0	111.8	L100 V230	A70-L100 VanDerWaalsContact CA-O 3.27Å; A70-L100 WeakPolarHBondContact CA-O 3.22Å; A70-V230 HydrophobicContact CB-CG2 4.02Å; A70-V230 PolarHBondContact O-N 2.92Å
71	V	98	Very high	92.9	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	149.3	172.1	-64.3	0	0	0	0	111.2	F69 F99 L100 Y227 D228 V229	F69-V71 HydrophobicContact CD2-CG1 3.94Å; F69-V71 HydrophobicContact CE2-CG1 3.83Å; V71-F99 WeakPolarHBondContact O-CA 3.12Å; V71-L100 HydrophobicContact CG2-CB 3.82Å; V71-L100 HydrophobicContact CG2-CD1 4.16Å; V71-L100 HydrophobicContact CG2-CG 4.31Å; V71-L100 PolarHBondContact N-O 3.16Å; V71-L100 PolarHBondContact O-N 2.89Å; V71-Y227 HydrophobicContact CB-CG 4.31Å; V71-Y227 HydrophobicContact CG2-CD1 4.07Å; V71-Y227 HydrophobicContact CG2-CG 4.05Å; V71-D228 CarbonylContact C-O 3.54Å; V71-D228 WeakPolarHBondContact CA-O 3.47Å; V71-D228 WeakPolarHBondContact CB-O 3.48Å; V71-V229 HydrophobicContact CG1-CG2 4.3Å
72	R	97.5	Very high	91.9	Very high	31 Å²	31	55.9 Å²	55.9	12%	0.117	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.1	160	-175.2	-169.3	63.7	-145.9	-9.6	108.9	D98 F99 Y227 D228 V230 R282	R72-D98 CarbonylContact C-O 3.55Å; R72-D98 VanDerWaalsContact CA-O 3.29Å; R72-D98 WeakPolarHBondContact CA-O 3.49Å; R72-F99 HydrophobicContact CB-CD1 4.29Å; R72-F99 HydrophobicContact CB-CE1 4.12Å; R72-F99 HydrophobicContact CG-CE1 4.25Å; R72-F99 HydrophobicContact CG-CZ 4.3Å; R72-Y227 WeakPolarHBondContact O-CA 3.46Å; R72-D228 IonicContact CZ-OD2 3.62Å; R72-D228 PolarHBondContact N-O 3.28Å; R72-D228 IonicContact NE-OD2 3.64Å; R72-D228 IonicContact NH2-OD2 2.75Å; R72-D228 PolarHBondContact NH2-OD2 2.64Å; R72-D228 PolarHBondContact O-N 2.85Å; R72-V230 HydrophobicContact CB-CG1 3.77Å; R72-R282 VanDerWaalsContact NH2-CZ 3.34Å
73	T	97.2	Very high	91.3	Very high	0 Å²	0	57 Å²	57	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	145.2	177.8	70	0	0	0	0	111.5	F94 E95 A96 K97 D98 L100 Y227	T73-F94 HydrophobicContact CG2-CD2 3.56Å; T73-F94 HydrophobicContact CG2-CE2 3.81Å; T73-F94 HydrophobicContact CG2-CG 4.11Å; T73-E95 PolarHBondContact OG1-O 2.93Å; T73-A96 WeakPolarHBondContact OG1-CA 3.49Å; T73-K97 VanDerWaalsContact O-CA 3.3Å; T73-K97 WeakPolarHBondContact O-CA 3.43Å; T73-K97 PolarHBondContact O-N 3.31Å; T73-K97 PolarHBondContact OG1-N 3.43Å; T73-D98 HydrophobicContact CG2-CB 4.2Å; T73-D98 PolarHBondContact N-O 2.89Å; T73-D98 PolarHBondContact OG1-N 2.83Å; T73-D98 PolarHBondContact OG1-O 3.23Å; T73-L100 HydrophobicContact CG2-CD1 3.87Å; T73-L100 HydrophobicContact CG2-CG 4.08Å; T73-Y227 HydrophobicContact CG2-CD1 4.13Å; T73-Y227 HydrophobicContact CG2-CE1 3.99Å
74	N	95.1	Very high	91.1	Very high	47 Å²	47	61.3 Å²	61.3	25%	0.251	37%	0.365	S	S	.	.	S	Bend	trans	-112.4	-6.8	169.9	-71.1	-43.4	0	0	0	112.3	I224 P225 P226 D228	N74-I224 HydrophobicContact CB-CG2 3.8Å; N74-P225 WeakPolarHBondContact CB-O 3.16Å; N74-P225 PolarHBondContact ND2-O 2.86Å; N74-P226 PolarHBondContact N-O 3.05Å; N74-D228 VanDerWaalsContact ND2-CG 3.28Å; N74-D228 PolarHBondContact ND2-OD2 2.92Å; N74-D228 PolarHBondContact OD1-OD2 3.49Å
75	V	94.9	Very high	91.1	Very high	62 Å²	62	57.7 Å²	57.7	38%	0.376	34%	0.343	S	S	.	.	S	Bend	trans	-132.6	152.3	175.1	-62.4	0	0	0	0	108.9	F94 L131 P226	V75-F94 WeakPolarHBondContact O-CE2 3.18Å; V75-L131 HydrophobicContact CG2-CD1 4.21Å; V75-P226 HydrophobicContact CG2-CB 3.69Å
76	G	94.8	Very high	91	Very high	49 Å²	49	56.5 Å²	56.5	51%	0.505	34%	0.34	S	S	.	.			trans	-87	156.6	167.2	0	0	0	0	0	111.8	F94	G76-F94 CarbonylContact C-O 3.53Å; G76-F94 VanDerWaalsContact CA-O 3.26Å; G76-F94 WeakPolarHBondContact CA-O 3.39Å
77	Y	94.6	Very high	91	Very high	21 Å²	21	51.9 Å²	51.9	8%	0.082	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-141.5	132.9	173.6	167.3	-111	0	0	0	109	A79 D83 I92 S93 F94 P126 L131 M134	Y77-A79 HydrophobicContact CE1-CB 4.3Å; Y77-A79 WeakPolarHBondContact OH-CA 3.34Å; Y77-D83 WeakPolarHBondContact CE2-OD2 3.4Å; Y77-D83 PolarHBondContact OH-OD2 3.49Å; Y77-I92 VanDerWaalsContact CD1-O 3.31Å; Y77-I92 WeakPolarHBondContact CD1-O 3.32Å; Y77-S93 CarbonylContact O-C 3.52Å; Y77-S93 VanDerWaalsContact O-CA 3.26Å; Y77-S93 WeakPolarHBondContact O-CA 3.48Å; Y77-F94 VanDerWaalsContact CB-CZ 3.47Å; Y77-F94 HydrophobicContact CD1-CD1 4.35Å; Y77-F94 AromaticContact CD1-CE1 3.84Å; Y77-F94 HydrophobicContact CD1-CE1 3.84Å; Y77-F94 HydrophobicContact CD1-CZ 4.2Å; Y77-F94 HydrophobicContact CG-CE1 4.31Å; Y77-F94 HydrophobicContact CG-CZ 4.21Å; Y77-F94 PolarHBondContact N-O 3.28Å; Y77-F94 PolarHBondContact O-N 2.95Å; Y77-F94 VanDerWaalsContact O-O 3.05Å; Y77-P126 HydrophobicContact CD1-CG 3.67Å; Y77-P126 HydrophobicContact CD2-CG 4.25Å; Y77-P126 HydrophobicContact CE1-CG 3.77Å; Y77-P126 HydrophobicContact CE2-CG 4.36Å; Y77-P126 HydrophobicContact CG-CG 3.91Å; Y77-L131 HydrophobicContact CD2-CD2 4.3Å; Y77-L131 HydrophobicContact CG-CD2 4.4Å; Y77-M134 HydrophobicContact CD2-CE 3.97Å; Y77-M134 HydrophobicContact CE2-CE 3.75Å; Y77-M134 HydrophobicContact CE2-SD 4.36Å
78	S	92.7	Very high	90.7	Very high	93 Å²	93	55.4 Å²	55.4	65%	0.65	33%	0.333	S	S	*	.			trans	-115.9	124.5	169.8	179.9	0	0	0	0	108	A80	S78-A80 PolarHBondContact O-N 3.18Å
79	A	87.7	Confident	90.3	Very high	37 Å²	37	56.1 Å²	56.1	31%	0.306	35%	0.346	S	S	.	.			trans	-59.9	128.6	175	0	0	0	0	0	111.2	Y77 A91 S93	Y77-A79 HydrophobicContact CE1-CB 4.3Å; Y77-A79 WeakPolarHBondContact OH-CA 3.34Å; A79-A91 HydrophobicContact CB-CB 3.64Å; A79-S93 PolarHBondContact N-OG 3.3Å
80	A	81.9	Confident	90.2	Very high	48 Å²	48	55.9 Å²	55.9	40%	0.397	35%	0.347	S	S	.	.			trans	-115.1	160.1	171.9	0	0	0	0	0	110.8	S78 D82 D83	S78-A80 PolarHBondContact O-N 3.18Å; A80-D82 PolarHBondContact O-N 2.96Å; A80-D83 PolarHBondContact N-OD2 3.15Å; A80-D83 WeakPolarHBondContact O-CB 3.32Å; A80-D83 PolarHBondContact O-N 3.29Å
81	H	67.8	Low	90	Very high	198 Å²	198	56.4 Å²	56.4	92%	0.917	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-25.5	177.8	-63.1	90.4	0	0	0	112.7	D83	H81-D83 VanDerWaalsContact C-N 3.33Å; H81-D83 PolarHBondContact O-N 2.89Å
82	D	74.4	Confident	89.9	Confident	135 Å²	135	57.3 Å²	57.3	72%	0.722	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	1.9	-177.8	-60.2	3.9	0	0	0	113.6	A80 D84	A80-D82 PolarHBondContact O-N 2.96Å; D82-D84 VanDerWaalsContact C-N 3.32Å; D82-D84 PolarHBondContact O-N 3.41Å
83	D	80.6	Confident	89.8	Confident	23 Å²	23	58.5 Å²	58.5	12%	0.123	37%	0.369	C	S	.	.	S	Bend	trans	-81.2	3.5	-167.4	-77.1	-19.1	0	0	0	115.2	Y77 A80 H81 V85 W110 K130	Y77-D83 WeakPolarHBondContact CE2-OD2 3.4Å; Y77-D83 PolarHBondContact OH-OD2 3.49Å; A80-D83 PolarHBondContact N-OD2 3.15Å; A80-D83 WeakPolarHBondContact O-CB 3.32Å; A80-D83 PolarHBondContact O-N 3.29Å; H81-D83 VanDerWaalsContact C-N 3.33Å; H81-D83 PolarHBondContact O-N 2.89Å; D83-V85 HydrophobicContact CB-CG2 4.05Å; D83-V85 PolarHBondContact O-N 3Å; D83-W110 HydrophobicContact CB-CZ2 4.5Å; D83-W110 WeakPolarHBondContact O-CZ2 3.13Å; D83-K130 WeakPolarHBondContact O-CE 3.24Å; D83-K130 PolarHBondContact O-NZ 3.46Å
84	D	87.2	Confident	89.8	Confident	130 Å²	130	59 Å²	59	70%	0.695	37%	0.371	S	S	*	.			trans	52.1	50.5	-173	-53.7	-54.7	0	0	0	113	D82 W110 K130	D82-D84 VanDerWaalsContact C-N 3.32Å; D82-D84 PolarHBondContact O-N 3.41Å; D84-W110 PolarHBondContact O-NE1 2.78Å; D84-K130 IonicContact OD2-NZ 3.88Å
85	V	92.2	Very high	89.9	Confident	27 Å²	27	64 Å²	64	16%	0.164	39%	0.393	C	S	.	.			trans	-72.1	136.4	177.6	-167.1	0	0	0	0	110	D83 V87 A91 W110 F124	D83-V85 HydrophobicContact CB-CG2 4.05Å; D83-V85 PolarHBondContact O-N 3Å; V85-V87 WeakPolarHBondContact CG1-O 3.32Å; V85-V87 PolarHBondContact O-N 2.92Å; V85-A91 HydrophobicContact CB-CB 4.46Å; V85-A91 HydrophobicContact CG1-CB 3.74Å; V85-A91 HydrophobicContact CG2-CB 3.81Å; V85-W110 HydrophobicContact CB-CH2 4.44Å; V85-W110 HydrophobicContact CB-CZ2 4.22Å; V85-W110 HydrophobicContact CG1-CH2 4.35Å; V85-W110 HydrophobicContact CG1-CZ2 4.43Å; V85-W110 HydrophobicContact CG2-CH2 3.9Å; V85-W110 HydrophobicContact CG2-CZ2 3.94Å; V85-F124 HydrophobicContact CG1-CB 4.19Å; V85-F124 HydrophobicContact CG1-CD2 4.15Å; V85-F124 HydrophobicContact CG1-CG 4.42Å
86	P	92.4	Very high	89.9	Confident	24 Å²	24	63.5 Å²	63.5	16%	0.156	40%	0.395	C	S	.	.	S	Bend	trans	-64.7	-22.7	-176.4	-23.5	35.8	0	0	0	115	A55 F106 W110 F124	A55-P86 HydrophobicContact CB-CB 3.84Å; P86-F106 HydrophobicContact CB-CD1 4.25Å; P86-F106 HydrophobicContact CB-CE1 3.53Å; P86-F106 HydrophobicContact CB-CZ 3.96Å; P86-F106 HydrophobicContact CG-CD1 3.82Å; P86-F106 HydrophobicContact CG-CE1 3.53Å; P86-F106 HydrophobicContact CG-CZ 4.42Å; P86-W110 HydrophobicContact CG-CB 4.18Å; P86-W110 HydrophobicContact CG-CD2 4.43Å; P86-W110 HydrophobicContact CG-CG 3.81Å; P86-F124 HydrophobicContact CB-CD1 4.29Å; P86-F124 HydrophobicContact CB-CE1 3.88Å; P86-F124 HydrophobicContact CB-CE2 4.26Å; P86-F124 HydrophobicContact CB-CZ 3.88Å; P86-F124 HydrophobicContact CG-CD1 3.83Å; P86-F124 HydrophobicContact CG-CE1 3.87Å; P86-F124 HydrophobicContact CG-CG 4.24Å; P86-F124 HydrophobicContact CG-CZ 4.32Å
87	V	92.8	Very high	89.9	Confident	11 Å²	11	68.2 Å²	68.2	7%	0.067	40%	0.402	C	S	.	.	S	Bend	trans	-134.4	121.9	163.6	-175.9	0	0	0	0	107.3	E52 A55 Q56 V85 M90 F124	E52-V87 HydrophobicContact CG-CB 4.47Å; E52-V87 HydrophobicContact CG-CG1 4.21Å; E52-V87 HydrophobicContact CG-CG2 4.25Å; A55-V87 HydrophobicContact CB-CG2 3.74Å; Q56-V87 HydrophobicContact CB-CG2 4.02Å; V85-V87 WeakPolarHBondContact CG1-O 3.32Å; V85-V87 PolarHBondContact O-N 2.92Å; V87-M90 HydrophobicContact CB-CB 4.12Å; V87-M90 HydrophobicContact CB-CG 3.98Å; V87-M90 HydrophobicContact CG1-CB 4.41Å; V87-M90 HydrophobicContact CG1-CG 3.72Å; V87-M90 PolarHBondContact O-N 3.19Å; V87-F124 HydrophobicContact CB-CE2 3.92Å; V87-F124 HydrophobicContact CG2-CE2 3.77Å; V87-F124 HydrophobicContact CG2-CZ 4.19Å
88	P	90.5	Very high	90	Very high	89 Å²	89	69.6 Å²	69.6	58%	0.578	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	141.4	178.5	-27.3	36	0	0	0	112.7	M90	P88-M90 PolarHBondContact O-N 2.95Å; P88-M90 VanDerWaalsContact O-N 3.11Å
89	G	89.7	Confident	90.3	Very high	80 Å²	80	67.2 Å²	67.2	83%	0.825	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	-15.1	-179.3	0	0	0	0	0	116	A91	G89-A91 PolarHBondContact O-N 3.22Å
90	M	93.7	Very high	90.8	Very high	61 Å²	61	65.4 Å²	65.4	30%	0.3	37%	0.374	S	S	.	.			trans	-91.3	16.3	-176.7	-59.9	-57.5	-65.5	0	0	114.4	L59 V87 P88 G123 F124	L59-M90 HydrophobicContact CD2-CB 4.16Å; L59-M90 HydrophobicContact CD2-CE 3.68Å; L59-M90 HydrophobicContact CD2-CG 4.34Å; V87-M90 HydrophobicContact CB-CB 4.12Å; V87-M90 HydrophobicContact CB-CG 3.98Å; V87-M90 HydrophobicContact CG1-CB 4.41Å; V87-M90 HydrophobicContact CG1-CG 3.72Å; V87-M90 PolarHBondContact O-N 3.19Å; P88-M90 PolarHBondContact O-N 2.95Å; P88-M90 VanDerWaalsContact O-N 3.11Å; M90-G123 CarbonylContact O-C 3.54Å; M90-G123 VanDerWaalsContact O-CA 3.3Å; M90-G123 WeakPolarHBondContact O-CA 3.45Å; M90-F124 HydrophobicContact CB-CD2 3.98Å; M90-F124 HydrophobicContact CB-CE2 4.24Å; M90-F124 PolarHBondContact O-N 3.07Å
91	A	94.9	Very high	91.5	Very high	16 Å²	16	63.3 Å²	63.3	13%	0.132	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-85.1	141.8	174.6	0	0	0	0	0	111.9	A79 V85 G89 W110 F124	A79-A91 HydrophobicContact CB-CB 3.64Å; V85-A91 HydrophobicContact CB-CB 4.46Å; V85-A91 HydrophobicContact CG1-CB 3.74Å; V85-A91 HydrophobicContact CG2-CB 3.81Å; G89-A91 PolarHBondContact O-N 3.22Å; A91-W110 HydrophobicContact CB-CH2 4.3Å; A91-W110 HydrophobicContact CB-CZ3 4.3Å; A91-F124 WeakPolarHBondContact CA-O 3.36Å
92	I	95.6	Very high	93	Very high	22 Å²	22	53.9 Å²	53.9	11%	0.113	31%	0.312	C	S	.	.			trans	-93.4	111.2	-179.3	-59.9	-172.8	0	0	0	110.4	Y77 F94 G113 L115 F124 I125	Y77-I92 VanDerWaalsContact CD1-O 3.31Å; Y77-I92 WeakPolarHBondContact CD1-O 3.32Å; I92-F94 HydrophobicContact CG2-CD1 4.49Å; I92-F94 WeakPolarHBondContact O-CD1 3.39Å; I92-G113 VanDerWaalsContact CD1-O 3.25Å; I92-G113 WeakPolarHBondContact CD1-O 3.33Å; I92-L115 HydrophobicContact CG2-CB 4.19Å; I92-F124 PolarHBondContact N-O 2.91Å; I92-I125 HydrophobicContact CB-CG1 4.29Å; I92-I125 HydrophobicContact CD1-CG1 4.14Å
93	S	95.8	Very high	94	Very high	56 Å²	56	48.4 Å²	48.4	39%	0.392	28%	0.282	S	S	.	.			trans	-72.3	144.5	163.2	-57.6	0	0	0	0	111.2	Y77 A79	Y77-S93 CarbonylContact O-C 3.52Å; Y77-S93 VanDerWaalsContact O-CA 3.26Å; Y77-S93 WeakPolarHBondContact O-CA 3.48Å; A79-S93 PolarHBondContact N-OG 3.3Å
94	F	96.9	Very high	94.8	Very high	10 Å²	10	49.4 Å²	49.4	4%	0.044	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-154.1	155.5	178.2	52.3	-101.9	0	0	0	111.3	T73 V75 G76 Y77 I92 D98 L100 L115 I125 P126 Y227	T73-F94 HydrophobicContact CG2-CD2 3.56Å; T73-F94 HydrophobicContact CG2-CE2 3.81Å; T73-F94 HydrophobicContact CG2-CG 4.11Å; V75-F94 WeakPolarHBondContact O-CE2 3.18Å; G76-F94 CarbonylContact C-O 3.53Å; G76-F94 VanDerWaalsContact CA-O 3.26Å; G76-F94 WeakPolarHBondContact CA-O 3.39Å; Y77-F94 VanDerWaalsContact CB-CZ 3.47Å; Y77-F94 HydrophobicContact CD1-CD1 4.35Å; Y77-F94 AromaticContact CD1-CE1 3.84Å; Y77-F94 HydrophobicContact CD1-CE1 3.84Å; Y77-F94 HydrophobicContact CD1-CZ 4.2Å; Y77-F94 HydrophobicContact CG-CE1 4.31Å; Y77-F94 HydrophobicContact CG-CZ 4.21Å; Y77-F94 PolarHBondContact N-O 3.28Å; Y77-F94 PolarHBondContact O-N 2.95Å; Y77-F94 VanDerWaalsContact O-O 3.05Å; I92-F94 HydrophobicContact CG2-CD1 4.49Å; I92-F94 WeakPolarHBondContact O-CD1 3.39Å; F94-D98 WeakPolarHBondContact CA-OD2 3.32Å; F94-D98 HydrophobicContact CB-CB 4.1Å; F94-D98 WeakPolarHBondContact CB-OD2 3.5Å; F94-L100 HydrophobicContact CB-CD2 4.35Å; F94-L100 HydrophobicContact CD1-CD1 3.94Å; F94-L100 HydrophobicContact CD1-CD2 4.22Å; F94-L100 HydrophobicContact CE1-CD1 3.95Å; F94-L100 HydrophobicContact CG-CD1 4.41Å; F94-L100 HydrophobicContact CG-CD2 4.46Å; F94-L100 HydrophobicContact CZ-CD1 4.45Å; F94-L115 HydrophobicContact CB-CD1 4.49Å; F94-I125 HydrophobicContact CE1-CG2 4.39Å; F94-P126 HydrophobicContact CE1-CG 4.29Å; F94-P126 HydrophobicContact CZ-CG 4.3Å; F94-Y227 HydrophobicContact CE2-CE1 4.11Å; F94-Y227 AromaticContact CZ-CE1 3.81Å; F94-Y227 HydrophobicContact CZ-CE1 3.81Å; F94-Y227 AromaticContact CZ-CZ 3.99Å; F94-Y227 VanDerWaalsContact CZ-OH 3.24Å; F94-Y227 WeakPolarHBondContact CZ-OH 3.36Å
95	E	96.8	Very high	95.3	Very high	152 Å²	152	48.8 Å²	48.8	71%	0.71	28%	0.277	S	S	*	.			trans	-92.5	-179.3	172.6	-63.4	-164	175.3	0	0	111.7	T73 D98	T73-E95 PolarHBondContact OG1-O 2.93Å; E95-D98 PolarHBondContact N-OD2 3.31Å
96	A	94.7	Very high	95.5	Very high	51 Å²	51	50 Å²	50	42%	0.421	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	139.9	171.7	0	0	0	0	0	110.7	T73 D98	T73-A96 WeakPolarHBondContact OG1-CA 3.49Å; A96-D98 VanDerWaalsContact C-N 3.33Å
97	K	94.9	Very high	95.6	Very high	149 Å²	149	51.8 Å²	51.8	65%	0.648	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	-0.7	-169	-47.4	172.7	-174.9	172.4	0	116	T73	T73-K97 VanDerWaalsContact O-CA 3.3Å; T73-K97 WeakPolarHBondContact O-CA 3.43Å; T73-K97 PolarHBondContact O-N 3.31Å; T73-K97 PolarHBondContact OG1-N 3.43Å
98	D	97.1	Very high	95.8	Very high	50 Å²	50	56.5 Å²	56.5	27%	0.267	31%	0.313	S	S	.	.			trans	-61.7	158.6	171.8	-93.1	-22.7	0	0	0	112.1	R72 T73 F94 E95 A96 L115	R72-D98 CarbonylContact C-O 3.55Å; R72-D98 VanDerWaalsContact CA-O 3.29Å; R72-D98 WeakPolarHBondContact CA-O 3.49Å; T73-D98 HydrophobicContact CG2-CB 4.2Å; T73-D98 PolarHBondContact N-O 2.89Å; T73-D98 PolarHBondContact OG1-N 2.83Å; T73-D98 PolarHBondContact OG1-O 3.23Å; F94-D98 WeakPolarHBondContact CA-OD2 3.32Å; F94-D98 HydrophobicContact CB-CB 4.1Å; F94-D98 WeakPolarHBondContact CB-OD2 3.5Å; E95-D98 PolarHBondContact N-OD2 3.31Å; A96-D98 VanDerWaalsContact C-N 3.33Å; D98-L115 HydrophobicContact CB-CD1 3.87Å
99	F	98.1	Very high	96	Very high	42 Å²	42	54.8 Å²	54.8	18%	0.184	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.3	-180	-68.7	-91.7	0	0	0	110.8	V71 R72 V116 V230 R234 A342	V71-F99 WeakPolarHBondContact O-CA 3.12Å; R72-F99 HydrophobicContact CB-CD1 4.29Å; R72-F99 HydrophobicContact CB-CE1 4.12Å; R72-F99 HydrophobicContact CG-CE1 4.25Å; R72-F99 HydrophobicContact CG-CZ 4.3Å; F99-V116 HydrophobicContact CB-CB 4.03Å; F99-V116 HydrophobicContact CB-CG2 4.11Å; F99-V116 WeakPolarHBondContact O-CB 3.47Å; F99-V116 WeakPolarHBondContact O-CG2 3.36Å; F99-V116 PolarHBondContact O-N 2.91Å; F99-V230 HydrophobicContact CD1-CG2 4.18Å; F99-V230 HydrophobicContact CE1-CG2 4.34Å; F99-R234 HydrophobicContact CD1-CG 4.25Å; F99-R234 HydrophobicContact CE1-CG 3.84Å; F99-R234 HydrophobicContact CZ-CG 4.17Å; F99-R234 VanDerWaalsContact CZ-NE 3.34Å; F99-A342 HydrophobicContact CE1-CB 3.66Å; F99-A342 HydrophobicContact CZ-CB 3.94Å
100	L	98.3	Very high	96.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.9	-179.8	-51.5	176.2	0	0	0	110.5	A70 V71 T73 F94 R114 L115 I125 Y227	A70-L100 VanDerWaalsContact CA-O 3.27Å; A70-L100 WeakPolarHBondContact CA-O 3.22Å; V71-L100 HydrophobicContact CG2-CB 3.82Å; V71-L100 HydrophobicContact CG2-CD1 4.16Å; V71-L100 HydrophobicContact CG2-CG 4.31Å; V71-L100 PolarHBondContact N-O 3.16Å; V71-L100 PolarHBondContact O-N 2.89Å; T73-L100 HydrophobicContact CG2-CD1 3.87Å; T73-L100 HydrophobicContact CG2-CG 4.08Å; F94-L100 HydrophobicContact CB-CD2 4.35Å; F94-L100 HydrophobicContact CD1-CD1 3.94Å; F94-L100 HydrophobicContact CD1-CD2 4.22Å; F94-L100 HydrophobicContact CE1-CD1 3.95Å; F94-L100 HydrophobicContact CG-CD1 4.41Å; F94-L100 HydrophobicContact CG-CD2 4.46Å; F94-L100 HydrophobicContact CZ-CD1 4.45Å; L100-R114 CarbonylContact C-O 3.47Å; L100-R114 WeakPolarHBondContact CA-O 3.45Å; L100-L115 HydrophobicContact CD2-CB 4.3Å; L100-L115 HydrophobicContact CD2-CD1 3.8Å; L100-I125 HydrophobicContact CB-CD1 4.13Å; L100-I125 HydrophobicContact CD1-CD1 4.19Å; L100-I125 HydrophobicContact CD1-CG1 4.47Å; L100-I125 HydrophobicContact CD1-CG2 3.8Å; L100-Y227 HydrophobicContact CD1-CE1 4.05Å
101	H	98.1	Very high	96.6	Very high	4 Å²	4	50 Å²	50	2%	0.019	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	112.7	168.8	-81.3	176.9	0	0	0	109.4	V67 G113 R114 V116 S232	V67-H101 HydrophobicContact CG1-CB 4.02Å; V67-H101 HydrophobicContact CG2-CB 3.97Å; H101-G113 CarbonylContact O-C 3.2Å; H101-G113 WeakPolarHBondContact O-CA 3.34Å; H101-R114 HydrophobicContact CB-CG 4Å; H101-R114 PolarHBondContact N-O 3.42Å; H101-R114 PolarHBondContact O-N 2.7Å; H101-V116 HydrophobicContact CB-CG2 4.23Å; H101-V116 VanDerWaalsContact CD2-CG2 3.45Å; H101-V116 WeakPolarHBondContact CD2-CG2 3.27Å; H101-S232 PolarHBondContact NE2-O 3.18Å
102	V	98.1	Very high	96.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.7	177.3	-175.6	0	0	0	0	109.6	A68 F69 W111	A68-V102 PolarHBondContact N-O 3.5Å; F69-V102 HydrophobicContact CD1-CB 4.27Å; F69-V102 HydrophobicContact CD1-CG1 4.45Å; F69-V102 HydrophobicContact CD2-CB 4.21Å; F69-V102 HydrophobicContact CD2-CG2 4.2Å; F69-V102 HydrophobicContact CE1-CB 3.93Å; F69-V102 HydrophobicContact CE1-CG1 3.73Å; F69-V102 HydrophobicContact CE2-CB 3.88Å; F69-V102 HydrophobicContact CE2-CG1 4.29Å; F69-V102 HydrophobicContact CE2-CG2 3.65Å; F69-V102 HydrophobicContact CG-CB 4.4Å; F69-V102 HydrophobicContact CZ-CB 3.73Å; F69-V102 HydrophobicContact CZ-CG1 3.63Å; F69-V102 HydrophobicContact CZ-CG2 3.85Å; F69-V102 PolarHBondContact N-O 2.88Å; F69-V102 PolarHBondContact O-N 2.87Å; V102-W111 HydrophobicContact CG1-CB 4.14Å; V102-W111 HydrophobicContact CG1-CD2 4.46Å; V102-W111 HydrophobicContact CG1-CE3 4.33Å; V102-W111 HydrophobicContact CG1-CG 4.44Å; V102-W111 HydrophobicContact CG2-CE3 3.77Å; V102-W111 HydrophobicContact CG2-CZ3 4.19Å
103	K	96.5	Very high	96.8	Very high	19 Å²	19	48.2 Å²	48.2	8%	0.083	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-44.9	176.2	-62	-65.7	-165.8	170.6	0	111	A62 K65 P66 V67 I112 I122	A62-K103 HydrophobicContact CB-CB 4.44Å; K65-K103 HydrophobicContact CB-CB 4.48Å; K65-K103 WeakPolarHBondContact O-CD 3.5Å; K65-K103 WeakPolarHBondContact O-CE 3.18Å; K65-K103 PolarHBondContact O-NZ 3.35Å; P66-K103 VanDerWaalsContact O-CD 3.25Å; P66-K103 WeakPolarHBondContact O-CD 3.49Å; V67-K103 HydrophobicContact CG2-CD 4.32Å; K103-I112 PolarHBondContact N-O 3.45Å; K103-I122 HydrophobicContact CB-CD1 4.39Å; K103-I122 HydrophobicContact CG-CD1 3.79Å
104	E	96.4	Very high	96.9	Very high	44 Å²	44	45.8 Å²	45.8	21%	0.206	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	169.4	174.9	67.4	-175	166.8	0	0	113.5	Q58 K65 I112	Q58-E104 WeakPolarHBondContact CG-OE1 3.36Å; Q58-E104 VanDerWaalsContact NE2-CD 3.35Å; Q58-E104 PolarHBondContact NE2-OE1 3.22Å; K65-E104 IonicContact NZ-OE1 3.26Å; K65-E104 PolarHBondContact NZ-OE1 3.01Å; K65-E104 IonicContact NZ-OE2 3.93Å; K65-E104 PolarHBondContact NZ-OE2 3.07Å; E104-I112 HydrophobicContact CG-CB 4.16Å; E104-I112 HydrophobicContact CG-CD1 4.48Å; E104-I112 PolarHBondContact N-O 2.75Å; E104-I112 VanDerWaalsContact N-O 3.16Å; E104-I112 PolarHBondContact O-N 2.94Å
105	K	96.9	Very high	96.9	Very high	118 Å²	118	46.2 Å²	46.2	51%	0.513	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.2	166.2	178.8	-179.4	176.9	-174.5	0	108.9	N107 N108	K105-N107 WeakPolarHBondContact CE-O 3.28Å; K105-N107 WeakPolarHBondContact CG-O 3.48Å; K105-N108 WeakPolarHBondContact CE-OD1 3.27Å; K105-N108 PolarHBondContact NZ-OD1 2.69Å
106	F	96.5	Very high	96.9	Very high	52 Å²	52	40.1 Å²	40.1	23%	0.228	20%	0.199	C	C	.	.			trans	-83	-56.5	175.4	174.6	-104.5	0	0	0	110.8	A55 Q58 P86 W110 I112 F124	A55-F106 HydrophobicContact CB-CE2 4Å; A55-F106 HydrophobicContact CB-CZ 3.69Å; Q58-F106 HydrophobicContact CG-CD2 4.4Å; P86-F106 HydrophobicContact CB-CD1 4.25Å; P86-F106 HydrophobicContact CB-CE1 3.53Å; P86-F106 HydrophobicContact CB-CZ 3.96Å; P86-F106 HydrophobicContact CG-CD1 3.82Å; P86-F106 HydrophobicContact CG-CE1 3.53Å; P86-F106 HydrophobicContact CG-CZ 4.42Å; F106-W110 WeakPolarHBondContact CB-O 3.29Å; F106-W110 HydrophobicContact CD1-CB 4.22Å; F106-W110 PolarHBondContact N-O 3.14Å; F106-I112 HydrophobicContact CB-CD1 3.86Å; F106-I112 HydrophobicContact CB-CG1 3.98Å; F106-I112 HydrophobicContact CD2-CD1 3.81Å; F106-I112 HydrophobicContact CG-CD1 4.17Å; F106-F124 HydrophobicContact CB-CE1 4.36Å; F106-F124 HydrophobicContact CD1-CE1 4.05Å; F106-F124 HydrophobicContact CD2-CE1 4.12Å; F106-F124 HydrophobicContact CE1-CE1 4.39Å; F106-F124 HydrophobicContact CE2-CE1 4.45Å; F106-F124 AromaticContact CG-CE1 3.91Å; F106-F124 HydrophobicContact CG-CE1 3.91Å
107	N	95.6	Very high	96.8	Very high	62 Å²	62	43.7 Å²	43.7	33%	0.332	21%	0.206	S	C	.	.	S	Bend	trans	-144.5	-162	173.1	69.5	21.2	0	0	0	110.2	K105 D109 W110	K105-N107 WeakPolarHBondContact CE-O 3.28Å; K105-N107 WeakPolarHBondContact CG-O 3.48Å; N107-D109 VanDerWaalsContact C-N 3.35Å; N107-D109 PolarHBondContact OD1-N 3.45Å; N107-W110 PolarHBondContact N-O 3.38Å; N107-W110 PolarHBondContact OD1-N 2.87Å
108	N	95.9	Very high	96.6	Very high	110 Å²	110	41.4 Å²	41.4	59%	0.588	20%	0.197	S	C	*	.	S	Bend	trans	-72.2	-27.4	-179.3	-73.5	-28.1	0	0	0	113.8	K105 S127	K105-N108 WeakPolarHBondContact CE-OD1 3.27Å; K105-N108 PolarHBondContact NZ-OD1 2.69Å; N108-S127 VanDerWaalsContact O-CB 3.31Å; N108-S127 WeakPolarHBondContact O-CB 3.38Å; N108-S127 PolarHBondContact O-OG 3Å
109	D	95.9	Very high	96.1	Very high	53 Å²	53	43 Å²	43	28%	0.283	23%	0.226	S	C	.	.	S	Bend	trans	-99	-20.3	-175.6	-66	-71	0	0	0	113	N107 S127 K130	N107-D109 VanDerWaalsContact C-N 3.35Å; N107-D109 PolarHBondContact OD1-N 3.45Å; D109-S127 PolarHBondContact O-N 2.97Å; D109-K130 HydrophobicContact CB-CB 3.95Å; D109-K130 HydrophobicContact CB-CD 4.13Å; D109-K130 HydrophobicContact CB-CG 4.26Å; D109-K130 WeakPolarHBondContact O-CB 3.06Å
110	W	97.1	Very high	95.8	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.015	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.8	-173.9	-64.1	105	0	0	0	113.1	D83 D84 V85 P86 A91 F106 N107 F124 P126	D83-W110 HydrophobicContact CB-CZ2 4.5Å; D83-W110 WeakPolarHBondContact O-CZ2 3.13Å; D84-W110 PolarHBondContact O-NE1 2.78Å; V85-W110 HydrophobicContact CB-CH2 4.44Å; V85-W110 HydrophobicContact CB-CZ2 4.22Å; V85-W110 HydrophobicContact CG1-CH2 4.35Å; V85-W110 HydrophobicContact CG1-CZ2 4.43Å; V85-W110 HydrophobicContact CG2-CH2 3.9Å; V85-W110 HydrophobicContact CG2-CZ2 3.94Å; P86-W110 HydrophobicContact CG-CB 4.18Å; P86-W110 HydrophobicContact CG-CD2 4.43Å; P86-W110 HydrophobicContact CG-CG 3.81Å; A91-W110 HydrophobicContact CB-CH2 4.3Å; A91-W110 HydrophobicContact CB-CZ3 4.3Å; F106-W110 WeakPolarHBondContact CB-O 3.29Å; F106-W110 HydrophobicContact CD1-CB 4.22Å; F106-W110 PolarHBondContact N-O 3.14Å; N107-W110 PolarHBondContact N-O 3.38Å; N107-W110 PolarHBondContact OD1-N 2.87Å; W110-F124 HydrophobicContact CB-CD1 4.28Å; W110-F124 HydrophobicContact CD2-CB 4.3Å; W110-F124 HydrophobicContact CE3-CB 3.67Å; W110-F124 HydrophobicContact CZ3-CB 4.08Å; W110-P126 HydrophobicContact CE3-CB 4.26Å; W110-P126 HydrophobicContact CH2-CB 4.42Å; W110-P126 HydrophobicContact CZ3-CB 3.95Å; W110-P126 HydrophobicContact CZ3-CG 4.41Å
111	W	98.3	Very high	95.5	Very high	36 Å²	36	48.3 Å²	48.3	14%	0.136	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	160.5	165.8	-61.2	-14	0	0	0	109.7	F69 V102 F124 I125 P128 Y227	F69-W111 HydrophobicContact CE2-CE3 4.39Å; F69-W111 HydrophobicContact CE2-CH2 4.07Å; F69-W111 AromaticContact CE2-CZ3 3.86Å; F69-W111 HydrophobicContact CE2-CZ3 3.86Å; F69-W111 HydrophobicContact CZ-CD2 4.45Å; F69-W111 HydrophobicContact CZ-CE3 4.17Å; F69-W111 HydrophobicContact CZ-CH2 4.04Å; F69-W111 HydrophobicContact CZ-CZ2 4.34Å; F69-W111 AromaticContact CZ-CZ3 3.96Å; F69-W111 HydrophobicContact CZ-CZ3 3.96Å; V102-W111 HydrophobicContact CG1-CB 4.14Å; V102-W111 HydrophobicContact CG1-CD2 4.46Å; V102-W111 HydrophobicContact CG1-CE3 4.33Å; V102-W111 HydrophobicContact CG1-CG 4.44Å; V102-W111 HydrophobicContact CG2-CE3 3.77Å; V102-W111 HydrophobicContact CG2-CZ3 4.19Å; W111-F124 WeakPolarHBondContact O-CA 3.19Å; W111-I125 HydrophobicContact CB-CB 4.34Å; W111-I125 HydrophobicContact CE3-CG2 4.43Å; W111-I125 PolarHBondContact N-O 2.9Å; W111-I125 PolarHBondContact O-N 2.82Å; W111-P128 HydrophobicContact CH2-CG 4Å; W111-P128 VanDerWaalsContact CZ2-CD 3.47Å; W111-P128 HydrophobicContact CZ2-CG 4.14Å; W111-Y227 HydrophobicContact CE3-CE2 4.25Å; W111-Y227 AromaticContact CH2-CD2 3.86Å; W111-Y227 HydrophobicContact CH2-CD2 3.86Å; W111-Y227 HydrophobicContact CH2-CE2 4.23Å; W111-Y227 AromaticContact CZ3-CD2 3.6Å; W111-Y227 HydrophobicContact CZ3-CD2 3.6Å; W111-Y227 AromaticContact CZ3-CE2 3.72Å; W111-Y227 HydrophobicContact CZ3-CE2 3.72Å
112	I	98	Very high	95.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.3	171	-72.8	164.6	0	0	0	108.3	Q58 L59 A62 K103 E104 F106 I122 F124	Q58-I112 HydrophobicContact CG-CD1 3.96Å; L59-I112 HydrophobicContact CD1-CG1 4.16Å; L59-I112 HydrophobicContact CD1-CG2 3.65Å; A62-I112 HydrophobicContact CB-CG2 3.47Å; A62-I112 VanDerWaalsContact CB-CG2 3.47Å; K103-I112 PolarHBondContact N-O 3.45Å; E104-I112 HydrophobicContact CG-CB 4.16Å; E104-I112 HydrophobicContact CG-CD1 4.48Å; E104-I112 PolarHBondContact N-O 2.75Å; E104-I112 VanDerWaalsContact N-O 3.16Å; E104-I112 PolarHBondContact O-N 2.94Å; F106-I112 HydrophobicContact CB-CD1 3.86Å; F106-I112 HydrophobicContact CB-CG1 3.98Å; F106-I112 HydrophobicContact CD2-CD1 3.81Å; F106-I112 HydrophobicContact CG-CD1 4.17Å; I112-I122 HydrophobicContact CG2-CD1 3.52Å; I112-I122 HydrophobicContact CG2-CG1 3.79Å; I112-F124 HydrophobicContact CD1-CE1 3.9Å; I112-F124 HydrophobicContact CG1-CD1 3.86Å; I112-F124 HydrophobicContact CG1-CE1 3.66Å; I112-F124 HydrophobicContact CG1-CZ 4.48Å
113	G	97.4	Very high	95.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	-166.7	-176	0	0	0	0	0	112.2	I92 H101 I122 G123	I92-G113 VanDerWaalsContact CD1-O 3.25Å; I92-G113 WeakPolarHBondContact CD1-O 3.33Å; H101-G113 CarbonylContact O-C 3.2Å; H101-G113 WeakPolarHBondContact O-CA 3.34Å; G113-I122 CarbonylContact O-C 3.41Å; G113-I122 WeakPolarHBondContact O-CA 3.42Å; G113-I122 VanDerWaalsContact O-CG1 3.24Å; G113-I122 WeakPolarHBondContact O-CG1 3.39Å; G113-G123 PolarHBondContact N-O 3.43Å; G113-G123 PolarHBondContact O-N 3.24Å; G113-G123 VanDerWaalsContact O-O 3.11Å
114	R	96.6	Very high	95.3	Very high	6 Å²	6	47.9 Å²	47.9	2%	0.023	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.7	178.6	61.9	177.1	-70.1	-90.4	-0.5	113.1	L100 H101 K117 C120 E121 A415	L100-R114 CarbonylContact C-O 3.47Å; L100-R114 WeakPolarHBondContact CA-O 3.45Å; H101-R114 HydrophobicContact CB-CG 4Å; H101-R114 PolarHBondContact N-O 3.42Å; H101-R114 PolarHBondContact O-N 2.7Å; R114-K117 PolarHBondContact NH2-O 2.67Å; R114-C120 PolarHBondContact NE-O 3.3Å; R114-C120 PolarHBondContact NH2-O 3.22Å; R114-E121 WeakPolarHBondContact CB-O 3.11Å; R114-A415 VanDerWaalsContact CZ-O 3.31Å; R114-A415 PolarHBondContact NH1-O 3.22Å; R114-A415 PolarHBondContact NH2-O 3.34Å
115	L	97.1	Very high	95.4	Very high	18 Å²	18	45.8 Å²	45.8	9%	0.094	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135.4	164	-177	65.5	0	0	0	109.4	I92 F94 D98 L100 K117 C120	I92-L115 HydrophobicContact CG2-CB 4.19Å; F94-L115 HydrophobicContact CB-CD1 4.49Å; D98-L115 HydrophobicContact CB-CD1 3.87Å; L100-L115 HydrophobicContact CD2-CB 4.3Å; L100-L115 HydrophobicContact CD2-CD1 3.8Å; L115-K117 HydrophobicContact CD2-CB 4.2Å; L115-K117 HydrophobicContact CD2-CD 4.09Å; L115-K117 HydrophobicContact CG-CB 4.08Å; L115-K117 PolarHBondContact O-N 2.85Å; L115-C120 HydrophobicContact CB-CB 4.09Å
116	V	96.9	Very high	95.4	Very high	24 Å²	24	40.2 Å²	40.2	15%	0.145	22%	0.22	C	C	.	.	S	Bend	trans	-80.8	73.8	179.8	-176	0	0	0	0	109.7	F99 H101 Y412 T416	F99-V116 HydrophobicContact CB-CB 4.03Å; F99-V116 HydrophobicContact CB-CG2 4.11Å; F99-V116 WeakPolarHBondContact O-CB 3.47Å; F99-V116 WeakPolarHBondContact O-CG2 3.36Å; F99-V116 PolarHBondContact O-N 2.91Å; H101-V116 HydrophobicContact CB-CG2 4.23Å; H101-V116 VanDerWaalsContact CD2-CG2 3.45Å; H101-V116 WeakPolarHBondContact CD2-CG2 3.27Å; V116-Y412 HydrophobicContact CG1-CE2 4.27Å; V116-T416 HydrophobicContact CG1-CG2 3.49Å; V116-T416 VanDerWaalsContact CG1-CG2 3.49Å
117	K	93.7	Very high	95.5	Very high	127 Å²	127	37.8 Å²	37.8	55%	0.552	21%	0.209	S	C	*	.	S	Bend	trans	-148.9	145.7	-177.3	-176.7	173.2	-178.9	175	0	109.8	R114 L115 C120	R114-K117 PolarHBondContact NH2-O 2.67Å; L115-K117 HydrophobicContact CD2-CB 4.2Å; L115-K117 HydrophobicContact CD2-CD 4.09Å; L115-K117 HydrophobicContact CG-CB 4.08Å; L115-K117 PolarHBondContact O-N 2.85Å; K117-C120 HydrophobicContact CB-CB 4.28Å; K117-C120 PolarHBondContact O-N 3.18Å
118	E	89.9	Confident	95.5	Very high	101 Å²	101	37 Å²	37	47%	0.472	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	143.3	174.7	-67.2	-168.1	-169.2	0	0	111.1	C120 K414 A415	E118-C120 PolarHBondContact O-N 3.32Å; E118-C120 VanDerWaalsContact O-N 3.1Å; E118-K414 HydrophobicContact CG-CB 3.94Å; E118-K414 VanDerWaalsContact OE1-CB 3.24Å; E118-K414 WeakPolarHBondContact OE1-CB 3.47Å; E118-K414 WeakPolarHBondContact OE1-CD 3.31Å; E118-A415 HydrophobicContact CG-CB 4.22Å
119	G	86.9	Confident	95.4	Very high	84 Å²	84	35.8 Å²	35.8	87%	0.866	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	73	-14	-176.5	0	0	0	0	0	116.1	E121	G119-E121 PolarHBondContact O-N 3.25Å
120	C	91.7	Very high	95.3	Very high	38 Å²	38	34.1 Å²	34.1	26%	0.257	19%	0.194	S	C	.	.			trans	-79.8	109	179.2	-67.3	0	0	0	0	112.2	R114 L115 K117 E118	R114-C120 PolarHBondContact NE-O 3.3Å; R114-C120 PolarHBondContact NH2-O 3.22Å; L115-C120 HydrophobicContact CB-CB 4.09Å; K117-C120 HydrophobicContact CB-CB 4.28Å; K117-C120 PolarHBondContact O-N 3.18Å; E118-C120 PolarHBondContact O-N 3.32Å; E118-C120 VanDerWaalsContact O-N 3.1Å
121	E	92.4	Very high	95.1	Very high	114 Å²	114	34.9 Å²	34.9	53%	0.533	20%	0.198	S	C	.	.			trans	-71.7	-178.4	173.4	-78.8	-146.5	-146.8	0	0	113.6	K63 R114 G119	K63-E121 WeakPolarHBondContact CE-OE2 3.43Å; K63-E121 IonicContact NZ-OE2 3.33Å; K63-E121 PolarHBondContact NZ-OE2 2.83Å; K63-E121 VanDerWaalsContact NZ-OE2 3.12Å; R114-E121 WeakPolarHBondContact CB-O 3.11Å; G119-E121 PolarHBondContact O-N 3.25Å
122	I	95	Very high	94.8	Very high	13 Å²	13	36.2 Å²	36.2	7%	0.067	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	146.2	175.5	-155.8	174.7	0	0	0	111.1	L59 A62 K63 K103 I112 G113	L59-I122 HydrophobicContact CD1-CB 4.4Å; L59-I122 HydrophobicContact CD1-CD1 4.48Å; L59-I122 HydrophobicContact CD1-CG1 4.1Å; L59-I122 HydrophobicContact CD1-CG2 3.76Å; L59-I122 HydrophobicContact CG-CG2 3.99Å; A62-I122 VanDerWaalsContact C-CD1 3.47Å; A62-I122 HydrophobicContact CB-CD1 3.59Å; A62-I122 WeakPolarHBondContact O-CD1 3.25Å; K63-I122 HydrophobicContact CD-CG2 4.19Å; K63-I122 HydrophobicContact CG-CB 4.38Å; K63-I122 HydrophobicContact CG-CG2 3.5Å; K63-I122 VanDerWaalsContact CG-CG2 3.5Å; K103-I122 HydrophobicContact CB-CD1 4.39Å; K103-I122 HydrophobicContact CG-CD1 3.79Å; I112-I122 HydrophobicContact CG2-CD1 3.52Å; I112-I122 HydrophobicContact CG2-CG1 3.79Å; G113-I122 CarbonylContact O-C 3.41Å; G113-I122 WeakPolarHBondContact O-CA 3.42Å; G113-I122 VanDerWaalsContact O-CG1 3.24Å; G113-I122 WeakPolarHBondContact O-CG1 3.39Å
123	G	96.3	Very high	94.5	Very high	2 Å²	2	39.6 Å²	39.6	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	-173.5	-179.1	0	0	0	0	0	112	M90 G113	M90-G123 CarbonylContact O-C 3.54Å; M90-G123 VanDerWaalsContact O-CA 3.3Å; M90-G123 WeakPolarHBondContact O-CA 3.45Å; G113-G123 PolarHBondContact N-O 3.43Å; G113-G123 PolarHBondContact O-N 3.24Å; G113-G123 VanDerWaalsContact O-O 3.11Å
124	F	97.7	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.5	178.6	-64.9	-78.8	0	0	0	111.3	A55 L59 V85 P86 V87 M90 A91 I92 F106 W110 W111 I112	A55-F124 HydrophobicContact CB-CZ 4.12Å; L59-F124 HydrophobicContact CB-CZ 4.38Å; L59-F124 HydrophobicContact CD2-CD2 4.48Å; L59-F124 HydrophobicContact CD2-CE2 3.91Å; L59-F124 HydrophobicContact CD2-CZ 4.47Å; V85-F124 HydrophobicContact CG1-CB 4.19Å; V85-F124 HydrophobicContact CG1-CD2 4.15Å; V85-F124 HydrophobicContact CG1-CG 4.42Å; P86-F124 HydrophobicContact CB-CD1 4.29Å; P86-F124 HydrophobicContact CB-CE1 3.88Å; P86-F124 HydrophobicContact CB-CE2 4.26Å; P86-F124 HydrophobicContact CB-CZ 3.88Å; P86-F124 HydrophobicContact CG-CD1 3.83Å; P86-F124 HydrophobicContact CG-CE1 3.87Å; P86-F124 HydrophobicContact CG-CG 4.24Å; P86-F124 HydrophobicContact CG-CZ 4.32Å; V87-F124 HydrophobicContact CB-CE2 3.92Å; V87-F124 HydrophobicContact CG2-CE2 3.77Å; V87-F124 HydrophobicContact CG2-CZ 4.19Å; M90-F124 HydrophobicContact CB-CD2 3.98Å; M90-F124 HydrophobicContact CB-CE2 4.24Å; M90-F124 PolarHBondContact O-N 3.07Å; A91-F124 WeakPolarHBondContact CA-O 3.36Å; I92-F124 PolarHBondContact N-O 2.91Å; F106-F124 HydrophobicContact CB-CE1 4.36Å; F106-F124 HydrophobicContact CD1-CE1 4.05Å; F106-F124 HydrophobicContact CD2-CE1 4.12Å; F106-F124 HydrophobicContact CE1-CE1 4.39Å; F106-F124 HydrophobicContact CE2-CE1 4.45Å; F106-F124 AromaticContact CG-CE1 3.91Å; F106-F124 HydrophobicContact CG-CE1 3.91Å; W110-F124 HydrophobicContact CB-CD1 4.28Å; W110-F124 HydrophobicContact CD2-CB 4.3Å; W110-F124 HydrophobicContact CE3-CB 3.67Å; W110-F124 HydrophobicContact CZ3-CB 4.08Å; W111-F124 WeakPolarHBondContact O-CA 3.19Å; I112-F124 HydrophobicContact CD1-CE1 3.9Å; I112-F124 HydrophobicContact CG1-CD1 3.86Å; I112-F124 HydrophobicContact CG1-CE1 3.66Å; I112-F124 HydrophobicContact CG1-CZ 4.48Å
125	I	98	Very high	93.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.3	177.1	-65.2	166	0	0	0	107.4	I92 F94 L100 W111 S127 Y227	I92-I125 HydrophobicContact CB-CG1 4.29Å; I92-I125 HydrophobicContact CD1-CG1 4.14Å; F94-I125 HydrophobicContact CE1-CG2 4.39Å; L100-I125 HydrophobicContact CB-CD1 4.13Å; L100-I125 HydrophobicContact CD1-CD1 4.19Å; L100-I125 HydrophobicContact CD1-CG1 4.47Å; L100-I125 HydrophobicContact CD1-CG2 3.8Å; W111-I125 HydrophobicContact CB-CB 4.34Å; W111-I125 HydrophobicContact CE3-CG2 4.43Å; W111-I125 PolarHBondContact N-O 2.9Å; W111-I125 PolarHBondContact O-N 2.82Å; I125-S127 PolarHBondContact O-N 3.16Å; I125-Y227 HydrophobicContact CG2-CE2 4.48Å; I125-Y227 VanDerWaalsContact CG2-OH 3.32Å; I125-Y227 WeakPolarHBondContact CG2-OH 3.36Å
126	P	97.1	Very high	93.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	136.1	178.1	28.7	-35.4	0	0	0	110.2	Y77 F94 W110 K130 L131 M134 Y227	Y77-P126 HydrophobicContact CD1-CG 3.67Å; Y77-P126 HydrophobicContact CD2-CG 4.25Å; Y77-P126 HydrophobicContact CE1-CG 3.77Å; Y77-P126 HydrophobicContact CE2-CG 4.36Å; Y77-P126 HydrophobicContact CG-CG 3.91Å; F94-P126 HydrophobicContact CE1-CG 4.29Å; F94-P126 HydrophobicContact CZ-CG 4.3Å; W110-P126 HydrophobicContact CE3-CB 4.26Å; W110-P126 HydrophobicContact CH2-CB 4.42Å; W110-P126 HydrophobicContact CZ3-CB 3.95Å; W110-P126 HydrophobicContact CZ3-CG 4.41Å; P126-K130 HydrophobicContact CB-CB 4.13Å; P126-K130 HydrophobicContact CB-CG 3.87Å; P126-L131 HydrophobicContact CB-CD2 4.17Å; P126-L131 HydrophobicContact CB-CG 4.14Å; P126-L131 HydrophobicContact CG-CD2 3.77Å; P126-L131 HydrophobicContact CG-CG 4.07Å; P126-M134 HydrophobicContact CB-CE 4.23Å; P126-Y227 WeakPolarHBondContact O-CE2 3.24Å; P126-Y227 PolarHBondContact O-OH 2.92Å
127	S	97.3	Very high	92.9	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.014	28%	0.279	C	S	.	.			trans	-70.3	163.6	177.1	88.9	0	0	0	0	111	N108 D109 I125 V129 K130 L131	N108-S127 VanDerWaalsContact O-CB 3.31Å; N108-S127 WeakPolarHBondContact O-CB 3.38Å; N108-S127 PolarHBondContact O-OG 3Å; D109-S127 PolarHBondContact O-N 2.97Å; I125-S127 PolarHBondContact O-N 3.16Å; S127-V129 PolarHBondContact O-N 2.7Å; S127-V129 VanDerWaalsContact O-N 3.09Å; S127-V129 PolarHBondContact OG-N 3.12Å; S127-V129 VanDerWaalsContact OG-N 3.15Å; S127-K130 PolarHBondContact O-N 2.88Å; S127-K130 VanDerWaalsContact O-N 3.09Å; S127-K130 PolarHBondContact OG-N 2.94Å; S127-L131 PolarHBondContact O-N 2.89Å
128	P	95.9	Very high	92.5	Very high	46 Å²	46	53 Å²	53	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-52.7	-29.7	171	-28.1	35.9	0	0	0	114	W111 E132 P226 Y227	W111-P128 HydrophobicContact CH2-CG 4Å; W111-P128 VanDerWaalsContact CZ2-CD 3.47Å; W111-P128 HydrophobicContact CZ2-CG 4.14Å; P128-E132 PolarHBondContact O-N 3.34Å; P128-E132 VanDerWaalsContact O-N 3.15Å; P128-P226 HydrophobicContact CB-CG 3.87Å; P128-P226 HydrophobicContact CG-CG 4.4Å; P128-Y227 HydrophobicContact CG-CD2 3.81Å; P128-Y227 HydrophobicContact CG-CE2 4.24Å
129	V	94.4	Very high	92.4	Very high	83 Å²	83	51.5 Å²	51.5	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-74.7	-44.4	178.1	-178.5	0	0	0	0	110.8	S127 E132 N133	S127-V129 PolarHBondContact O-N 2.7Å; S127-V129 VanDerWaalsContact O-N 3.09Å; S127-V129 PolarHBondContact OG-N 3.12Å; S127-V129 VanDerWaalsContact OG-N 3.15Å; V129-E132 PolarHBondContact O-N 3.16Å; V129-N133 WeakPolarHBondContact O-CB 3.47Å; V129-N133 PolarHBondContact O-N 2.8Å; V129-N133 PolarHBondContact O-ND2 3.46Å
130	K	94.1	Very high	92.4	Very high	18 Å²	18	53 Å²	53	8%	0.078	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-43	175.3	-178.9	61.2	166.9	-173.5	0	111.3	D83 D84 D109 P126 S127 N133 M134	D83-K130 WeakPolarHBondContact O-CE 3.24Å; D83-K130 PolarHBondContact O-NZ 3.46Å; D84-K130 IonicContact OD2-NZ 3.88Å; D109-K130 HydrophobicContact CB-CB 3.95Å; D109-K130 HydrophobicContact CB-CD 4.13Å; D109-K130 HydrophobicContact CB-CG 4.26Å; D109-K130 WeakPolarHBondContact O-CB 3.06Å; P126-K130 HydrophobicContact CB-CB 4.13Å; P126-K130 HydrophobicContact CB-CG 3.87Å; S127-K130 PolarHBondContact O-N 2.88Å; S127-K130 VanDerWaalsContact O-N 3.09Å; S127-K130 PolarHBondContact OG-N 2.94Å; K130-N133 PolarHBondContact O-N 2.74Å; K130-M134 HydrophobicContact CD-CG 4.22Å; K130-M134 HydrophobicContact CD-SD 4.13Å; K130-M134 HydrophobicContact CG-CE 4.02Å; K130-M134 HydrophobicContact CG-SD 4.15Å; K130-M134 WeakPolarHBondContact O-CB 3.33Å; K130-M134 VanDerWaalsContact O-CG 3.27Å; K130-M134 WeakPolarHBondContact O-CG 3.22Å; K130-M134 PolarHBondContact O-N 3.28Å
131	L	93.4	Very high	92	Very high	20 Å²	20	57.5 Å²	57.5	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-46.8	175.5	-72.8	175	0	0	0	112.3	V75 Y77 P126 S127 M134 R135 P226 Y227	V75-L131 HydrophobicContact CG2-CD1 4.21Å; Y77-L131 HydrophobicContact CD2-CD2 4.3Å; Y77-L131 HydrophobicContact CG-CD2 4.4Å; P126-L131 HydrophobicContact CB-CD2 4.17Å; P126-L131 HydrophobicContact CB-CG 4.14Å; P126-L131 HydrophobicContact CG-CD2 3.77Å; P126-L131 HydrophobicContact CG-CG 4.07Å; S127-L131 PolarHBondContact O-N 2.89Å; L131-M134 HydrophobicContact CD2-CE 3.83Å; L131-M134 PolarHBondContact O-N 3.46Å; L131-R135 WeakPolarHBondContact O-CB 3.35Å; L131-R135 PolarHBondContact O-N 2.74Å; L131-P226 HydrophobicContact CD1-CB 3.61Å; L131-P226 HydrophobicContact CD1-CG 4.12Å; L131-Y227 HydrophobicContact CD1-CE1 4.13Å; L131-Y227 HydrophobicContact CD1-CE2 4.12Å
132	E	91.1	Very high	91.4	Very high	65 Å²	65	54.7 Å²	54.7	30%	0.304	27%	0.273	S	S	.	.	H	α-helix	trans	-67.8	-38.7	177.5	-179.9	57.4	-164.9	0	0	112.2	P128 V129 M134 R135 L136	P128-E132 PolarHBondContact O-N 3.34Å; P128-E132 VanDerWaalsContact O-N 3.15Å; V129-E132 PolarHBondContact O-N 3.16Å; E132-M134 PolarHBondContact O-N 3.3Å; E132-R135 WeakPolarHBondContact O-CB 3.26Å; E132-R135 PolarHBondContact O-N 3.26Å; E132-R135 IonicContact OE1-CZ 3.56Å; E132-R135 IonicContact OE1-NE 2.71Å; E132-R135 PolarHBondContact OE1-NE 3.07Å; E132-R135 IonicContact OE1-NH2 2.65Å; E132-R135 PolarHBondContact OE1-NH2 2.8Å; E132-R135 IonicContact OE2-CZ 2.73Å; E132-R135 IonicContact OE2-NE 3.51Å; E132-R135 PolarHBondContact OE2-NE 2.71Å; E132-R135 IonicContact OE2-NH2 3.3Å; E132-L136 HydrophobicContact CG-CD1 4.14Å; E132-L136 WeakPolarHBondContact O-CB 3.48Å; E132-L136 WeakPolarHBondContact O-CG 3.46Å; E132-L136 PolarHBondContact O-N 3.34Å
133	N	91.9	Very high	90.5	Very high	70 Å²	70	59.9 Å²	59.9	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-59.3	-46.4	173.1	-75.7	-22.7	0	0	0	111.6	V129 K130 L136 Q137	V129-N133 WeakPolarHBondContact O-CB 3.47Å; V129-N133 PolarHBondContact O-N 2.8Å; V129-N133 PolarHBondContact O-ND2 3.46Å; K130-N133 PolarHBondContact O-N 2.74Å; N133-L136 PolarHBondContact O-N 3.18Å; N133-Q137 WeakPolarHBondContact O-CG 3.49Å; N133-Q137 PolarHBondContact O-N 3.41Å
134	M	89.8	Confident	88.9	Confident	34 Å²	34	65.3 Å²	65.3	17%	0.167	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-39.5	176.9	-68.6	-176.6	-50.3	0	0	111.7	Y77 P126 K130 L131 E132 L136 Q137 H138	Y77-M134 HydrophobicContact CD2-CE 3.97Å; Y77-M134 HydrophobicContact CE2-CE 3.75Å; Y77-M134 HydrophobicContact CE2-SD 4.36Å; P126-M134 HydrophobicContact CB-CE 4.23Å; K130-M134 HydrophobicContact CD-CG 4.22Å; K130-M134 HydrophobicContact CD-SD 4.13Å; K130-M134 HydrophobicContact CG-CE 4.02Å; K130-M134 HydrophobicContact CG-SD 4.15Å; K130-M134 WeakPolarHBondContact O-CB 3.33Å; K130-M134 VanDerWaalsContact O-CG 3.27Å; K130-M134 WeakPolarHBondContact O-CG 3.22Å; K130-M134 PolarHBondContact O-N 3.28Å; L131-M134 HydrophobicContact CD2-CE 3.83Å; L131-M134 PolarHBondContact O-N 3.46Å; E132-M134 PolarHBondContact O-N 3.3Å; M134-L136 PolarHBondContact O-N 3.37Å; M134-Q137 PolarHBondContact O-N 3.25Å; M134-H138 WeakPolarHBondContact O-CB 3.43Å; M134-H138 PolarHBondContact O-N 3.46Å
135	R	89.3	Confident	86.9	Confident	115 Å²	115	67.5 Å²	67.5	43%	0.434	34%	0.342	S	S	.	.	H	α-helix	trans	-59.1	-46	174	-164.8	-162	66.8	66.5	3	111.6	L131 E132 H138 E139	L131-R135 WeakPolarHBondContact O-CB 3.35Å; L131-R135 PolarHBondContact O-N 2.74Å; E132-R135 WeakPolarHBondContact O-CB 3.26Å; E132-R135 PolarHBondContact O-N 3.26Å; E132-R135 IonicContact OE1-CZ 3.56Å; E132-R135 IonicContact OE1-NE 2.71Å; E132-R135 PolarHBondContact OE1-NE 3.07Å; E132-R135 IonicContact OE1-NH2 2.65Å; E132-R135 PolarHBondContact OE1-NH2 2.8Å; E132-R135 IonicContact OE2-CZ 2.73Å; E132-R135 IonicContact OE2-NE 3.51Å; E132-R135 PolarHBondContact OE2-NE 2.71Å; E132-R135 IonicContact OE2-NH2 3.3Å; R135-H138 PolarHBondContact O-N 3.37Å; R135-E139 IonicContact CZ-OE2 3.89Å; R135-E139 IonicContact NH1-OE2 2.74Å; R135-E139 PolarHBondContact NH1-OE2 2.84Å; R135-E139 IonicContact NH2-OE2 3.12Å; R135-E139 WeakPolarHBondContact O-CB 3.3Å; R135-E139 PolarHBondContact O-N 3.47Å
136	L	88.9	Confident	84.8	Confident	64 Å²	64	75.2 Å²	75.2	34%	0.335	38%	0.375	S	S	.	.	H	α-helix	trans	-65.9	-41.1	177	-72.8	168	0	0	0	112.4	E132 N133 M134 E139 Q140	E132-L136 HydrophobicContact CG-CD1 4.14Å; E132-L136 WeakPolarHBondContact O-CB 3.48Å; E132-L136 WeakPolarHBondContact O-CG 3.46Å; E132-L136 PolarHBondContact O-N 3.34Å; N133-L136 PolarHBondContact O-N 3.18Å; M134-L136 PolarHBondContact O-N 3.37Å; L136-E139 PolarHBondContact O-N 3.15Å; L136-Q140 VanDerWaalsContact O-CG 3.32Å; L136-Q140 WeakPolarHBondContact O-CG 3.24Å; L136-Q140 PolarHBondContact O-N 3.41Å
137	Q	86.9	Confident	82.5	Confident	104 Å²	104	83.2 Å²	83.2	49%	0.486	41%	0.411	S	S	.	.	H	α-helix	trans	-63.4	-43.1	174.4	-73.6	-176.4	25.1	0	0	112.1	N133 M134 Q140 K141	N133-Q137 WeakPolarHBondContact O-CG 3.49Å; N133-Q137 PolarHBondContact O-N 3.41Å; M134-Q137 PolarHBondContact O-N 3.25Å; Q137-Q140 PolarHBondContact O-N 2.83Å; Q137-K141 WeakPolarHBondContact O-CG 3.46Å; Q137-K141 PolarHBondContact O-N 3.04Å
138	H	85.6	Confident	80	Confident	141 Å²	141	92.3 Å²	92.3	65%	0.653	45%	0.446	S	S	*	.	H	α-helix	trans	-63.2	-42.3	176	-170.9	96.2	0	0	0	111.2	M134 R135 Q140 K141 A142	M134-H138 WeakPolarHBondContact O-CB 3.43Å; M134-H138 PolarHBondContact O-N 3.46Å; R135-H138 PolarHBondContact O-N 3.37Å; H138-Q140 VanDerWaalsContact C-N 3.32Å; H138-Q140 PolarHBondContact O-N 3Å; H138-K141 PolarHBondContact O-N 2.89Å; H138-A142 WeakPolarHBondContact O-CB 3.47Å; H138-A142 PolarHBondContact O-N 2.93Å
139	E	87.7	Confident	77.4	Confident	69 Å²	69	95.7 Å²	95.7	32%	0.322	47%	0.471	S	S	.	.	H	α-helix	trans	-62.5	-37	175.3	-163.5	-174	145	0	0	112.2	R135 L136 K143	R135-E139 IonicContact CZ-OE2 3.89Å; R135-E139 IonicContact NH1-OE2 2.74Å; R135-E139 PolarHBondContact NH1-OE2 2.84Å; R135-E139 IonicContact NH2-OE2 3.12Å; R135-E139 WeakPolarHBondContact O-CB 3.3Å; R135-E139 PolarHBondContact O-N 3.47Å; L136-E139 PolarHBondContact O-N 3.15Å; E139-K143 HydrophobicContact CG-CD 4.46Å; E139-K143 WeakPolarHBondContact O-CB 3.34Å; E139-K143 VanDerWaalsContact O-CG 3.26Å; E139-K143 WeakPolarHBondContact O-CG 3.45Å; E139-K143 PolarHBondContact O-N 3.19Å; E139-K143 WeakPolarHBondContact OE1-CE 3.46Å; E139-K143 IonicContact OE1-NZ 2.59Å; E139-K143 PolarHBondContact OE1-NZ 2.94Å
140	Q	85.8	Confident	75.1	Confident	114 Å²	114	96.2 Å²	96.2	53%	0.533	48%	0.478	S	S	.	.	H	α-helix	trans	-68.6	-47.5	173.4	-72.4	175.9	35.8	0	0	112.3	L136 Q137 H138 A142 K143 Q144	L136-Q140 VanDerWaalsContact O-CG 3.32Å; L136-Q140 WeakPolarHBondContact O-CG 3.24Å; L136-Q140 PolarHBondContact O-N 3.41Å; Q137-Q140 PolarHBondContact O-N 2.83Å; H138-Q140 VanDerWaalsContact C-N 3.32Å; H138-Q140 PolarHBondContact O-N 3Å; Q140-A142 VanDerWaalsContact C-N 3.32Å; Q140-A142 PolarHBondContact O-N 3.46Å; Q140-K143 PolarHBondContact O-N 2.97Å; Q140-K143 VanDerWaalsContact O-N 3.14Å; Q140-Q144 WeakPolarHBondContact O-CG 3.22Å; Q140-Q144 PolarHBondContact O-N 2.91Å
141	K	82.6	Confident	73	Confident	134 Å²	134	105.2 Å²	105.2	58%	0.583	52%	0.517	S	S	*	.	H	α-helix	trans	-56.9	-44.9	175.4	-73.1	176	179.4	179.3	0	110.8	Q137 H138 K143 Q144 G145	Q137-K141 WeakPolarHBondContact O-CG 3.46Å; Q137-K141 PolarHBondContact O-N 3.04Å; H138-K141 PolarHBondContact O-N 2.89Å; K141-K143 PolarHBondContact O-N 2.88Å; K141-Q144 PolarHBondContact O-N 2.83Å; K141-G145 PolarHBondContact O-N 3.28Å
142	A	79.8	Confident	70.4	Confident	55 Å²	55	110.2 Å²	110.2	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-64.7	-34.2	176.5	0	0	0	0	0	113.8	H138 Q140	H138-A142 WeakPolarHBondContact O-CB 3.47Å; H138-A142 PolarHBondContact O-N 2.93Å; Q140-A142 VanDerWaalsContact C-N 3.32Å; Q140-A142 PolarHBondContact O-N 3.46Å
143	K	77.6	Confident	67.8	Low	122 Å²	122	111.1 Å²	111.1	53%	0.53	58%	0.581	S	S	.	*	H	α-helix	trans	-73.7	-39.1	174.7	-75.8	170.5	-176.8	173.7	0	112.5	E139 Q140 K141	E139-K143 HydrophobicContact CG-CD 4.46Å; E139-K143 WeakPolarHBondContact O-CB 3.34Å; E139-K143 VanDerWaalsContact O-CG 3.26Å; E139-K143 WeakPolarHBondContact O-CG 3.45Å; E139-K143 PolarHBondContact O-N 3.19Å; E139-K143 WeakPolarHBondContact OE1-CE 3.46Å; E139-K143 IonicContact OE1-NZ 2.59Å; E139-K143 PolarHBondContact OE1-NZ 2.94Å; Q140-K143 PolarHBondContact O-N 2.97Å; Q140-K143 VanDerWaalsContact O-N 3.14Å; K141-K143 PolarHBondContact O-N 2.88Å
144	Q	61.3	Low	65	Low	116 Å²	116	111.4 Å²	111.4	54%	0.542	60%	0.601	S	S	.	*	H	α-helix	trans	-70.1	-34.1	176	-69.7	179	8.1	0	0	112.3	Q140 K141 K146 F147	Q140-Q144 WeakPolarHBondContact O-CG 3.22Å; Q140-Q144 PolarHBondContact O-N 2.91Å; K141-Q144 PolarHBondContact O-N 2.83Å; Q144-K146 PolarHBondContact O-N 3.33Å; Q144-K146 VanDerWaalsContact O-N 3.09Å; Q144-F147 PolarHBondContact O-N 3.38Å
145	G	55.7	Low	62.3	Low	45 Å²	45	117.2 Å²	117.2	46%	0.464	63%	0.632	S	S	.	*	H	α-helix	trans	-55.6	-27	176	0	0	0	0	0	114.4	K141 F147	K141-G145 PolarHBondContact O-N 3.28Å; G145-F147 PolarHBondContact O-N 3.02Å
146	K	53.8	Low	59.7	Low	162 Å²	162	116.9 Å²	116.9	70%	0.704	65%	0.647	S	S	*	*	H	α-helix	trans	-71.1	-11.2	174.7	-68.6	-171.8	177.1	-173.6	0	114.6	Q144	Q144-K146 PolarHBondContact O-N 3.33Å; Q144-K146 VanDerWaalsContact O-N 3.09Å
147	F	49.4	Very low	57.3	Low	168 Å²	168	118.8 Å²	118.8	74%	0.737	67%	0.666	S	S	*	*	H	α-helix	trans	-114.1	-10.1	-176.8	-74.3	-79.5	0	0	0	115.1	Q144 G145	Q144-F147 PolarHBondContact O-N 3.38Å; G145-F147 PolarHBondContact O-N 3.02Å
148	Y	44.4	Very low	54.9	Low	193 Å²	193	119.7 Å²	119.7	76%	0.757	68%	0.684	S	S	*	*	H	α-helix	trans	-113.6	-2.4	-177.2	-74.9	-80.4	0	0	0	115.5	S150	Y148-S150 PolarHBondContact O-N 3.34Å
149	S	42.8	Very low	52.6	Low	117 Å²	117	117.4 Å²	117.4	82%	0.818	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	34.7	175.8	-171.5	0	0	0	0	114.1
150	S	46.1	Very low	50.3	Low	95 Å²	95	122.2 Å²	122.2	66%	0.664	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.2	31	-174.3	58.5	0	0	0	0	115	Y148	Y148-S150 PolarHBondContact O-N 3.34Å
151	K	49.3	Very low	48	Very low	206 Å²	206	120.1 Å²	120.1	90%	0.896	72%	0.72	S	S	*	*			trans	-161.2	70.5	167.4	-114.3	154.4	-171.4	176.4	0	115.9
152	S	39.2	Very low	45.7	Very low	126 Å²	126	121.4 Å²	121.4	88%	0.881	73%	0.733	S	S	*	*	S	Bend	trans	-155.8	108.8	159.8	57.9	0	0	0	0	110.5
153	G	35.2	Very low	43.7	Very low	83 Å²	83	125.8 Å²	125.8	86%	0.856	75%	0.747	S	S	*	*			trans	132.9	62.7	-175.5	0	0	0	0	0	112.9
154	G	34	Very low	41.8	Very low	77 Å²	77	126.3 Å²	126.3	79%	0.794	76%	0.761	S	S	*	*			trans	-107	100.3	-179.2	0	0	0	0	0	112.4
155	N	33.4	Very low	41.5	Very low	155 Å²	155	126.1 Å²	126.1	83%	0.829	77%	0.769	S	S	*	*			trans	-117.9	150.4	163.9	-80.9	52.8	0	0	0	109.6
156	S	34.2	Very low	40.2	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	79%	0.786	S	S	*	*			trans	73.3	88.8	165.2	-53.4	0	0	0	0	119.2
157	S	38.2	Very low	39.2	Very low	105 Å²	105	125.5 Å²	125.5	73%	0.734	78%	0.779	S	S	*	*				67.6	144.5	120.8	65.2	0	0	0	0	123.1
158	S	36.2	Very low	38.5	Very low	122 Å²	122	128.8 Å²	128.8	85%	0.853	79%	0.786	S	S	*	*			trans	72.7	157.6	165.4	79.8	0	0	0	0	117.1
159	S	38.5	Very low	37.9	Very low	93 Å²	93	128.3 Å²	128.3	65%	0.65	79%	0.788	S	S	*	*			cis	-170.6	135.9	-37.7	-174.3	0	0	0	0	107.4
160	L	39	Very low	37.3	Very low	170 Å²	170	127.3 Å²	127.3	89%	0.89	78%	0.781	S	S	*	*			trans	62.3	143.3	-177.5	-52.8	133.9	0	0	0	113.6
161	G	36.1	Very low	36.9	Very low	71 Å²	71	129.1 Å²	129.1	73%	0.732	79%	0.788	S	S	*	*			cis	113.1	82.4	-5.4	0	0	0	0	0	113.6
162	D	34.3	Very low	37.2	Very low	160 Å²	160	124.4 Å²	124.4	86%	0.856	78%	0.779	S	S	*	*			trans	-157.5	-178.3	149.2	-141.6	-27.4	0	0	0	112.3
163	I	37.8	Very low	37.3	Very low	147 Å²	147	124.7 Å²	124.7	75%	0.754	78%	0.777	S	S	*	*			trans	-129.6	148.7	-144.8	-74	173	0	0	0	114.9
164	V	38.4	Very low	37.1	Very low	133 Å²	133	126.1 Å²	126.1	81%	0.806	78%	0.775	S	S	*	*			trans	77.5	138.2	161.8	154.7	0	0	0	0	120
165	P	55	Low	37	Very low	112 Å²	112	128.4 Å²	128.4	73%	0.727	78%	0.778	S	S	*	*			trans	-107.3	147.5	178.9	39.6	-33.6	0	0	0	115.6
166	S	29.3	Very low	36.8	Very low	115 Å²	115	124.6 Å²	124.6	80%	0.804	77%	0.768	S	S	*	*			trans	-176.3	160.9	161.3	-99.4	0	0	0	0	110.8
167	S	32.6	Very low	36.8	Very low	80 Å²	80	126.6 Å²	126.6	56%	0.559	77%	0.769	S	S	*	*			cis	-169	143	-15	-112.1	0	0	0	0	108.7
168	R	34.2	Very low	36.3	Very low	236 Å²	236	128 Å²	128	89%	0.891	77%	0.768	S	S	*	*			trans	66.6	169.8	156.8	-58	159.1	-160.9	-144.2	1.5	115.5
169	K	31.6	Very low	36.4	Very low	183 Å²	183	129.5 Å²	129.5	80%	0.796	77%	0.765	S	S	*	*			cis	-169.9	154.2	-40.8	-172.1	-159.8	170.4	-169	0	107.5
170	S	30.6	Very low	36	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	77%	0.772	S	S	*	*			trans	86.1	146	159	-49.2	0	0	0	0	117.9
171	T	37.6	Very low	35.8	Very low	134 Å²	134	127.9 Å²	127.9	82%	0.822	76%	0.761	S	S	*	*			trans	-111.8	-158.1	170.7	51.3	0	0	0	0	109.5
172	P	55.7	Low	35.7	Very low	107 Å²	107	131 Å²	131	70%	0.695	77%	0.766	S	S	*	*				-108.4	-166.7	-114.9	38.1	-19.4	0	0	0	113.5
173	P	40.3	Very low	35.6	Very low	131 Å²	131	126.5 Å²	126.5	85%	0.851	76%	0.758	S	S	*	*				-139.3	179.7	116.6	38.9	-27.6	0	0	0	114.3
174	S	32	Very low	35.6	Very low	114 Å²	114	127.2 Å²	127.2	80%	0.797	76%	0.762	S	S	*	*			trans	-121.5	135.7	-177.3	-54.1	0	0	0	0	113.3
175	S	31.8	Very low	35.1	Very low	124 Å²	124	127.6 Å²	127.6	87%	0.867	76%	0.76	S	S	*	*			trans	177.3	160	155	49.3	0	0	0	0	108.5
176	A	29	Very low	34.5	Very low	75 Å²	75	126.1 Å²	126.1	62%	0.62	76%	0.757	S	S	*	*			cis	-172.7	-179.8	-29.5	0	0	0	0	0	106.4
177	I	33.9	Very low	34.6	Very low	151 Å²	151	129.3 Å²	129.3	77%	0.774	76%	0.759	S	S	*	*			trans	71	148.3	161.6	-54.5	143.6	0	0	0	114
178	D	29.3	Very low	34.7	Very low	134 Å²	134	133.4 Å²	133.4	72%	0.717	77%	0.769	S	S	*	*			cis	-162.7	-162	-37.2	-102	-55.9	0	0	0	106
179	I	38.3	Very low	34.3	Very low	154 Å²	154	128 Å²	128	79%	0.79	76%	0.758	S	S	*	*			trans	77.1	97.6	163.7	-50.8	171.3	0	0	0	112.7
180	D	30.2	Very low	34.2	Very low	148 Å²	148	125.5 Å²	125.5	79%	0.791	75%	0.753	S	S	*	*				67.6	122.5	61.6	-170.9	30.5	0	0	0	114.6
181	A	33.4	Very low	34.5	Very low	81 Å²	81	128.1 Å²	128.1	67%	0.669	76%	0.759	S	S	*	*			trans	176.3	103.3	151.9	0	0	0	0	0	112.2
182	T	33.8	Very low	34.6	Very low	135 Å²	135	127.3 Å²	127.3	83%	0.828	76%	0.756	S	S	*	*			trans	42.6	129.4	134.4	62.5	0	0	0	0	122.6
183	G	32.8	Very low	33.4	Very low	66 Å²	66	126.5 Å²	126.5	68%	0.68	76%	0.757	S	S	*	*			trans	147.8	102.5	163.1	0	0	0	0	0	109.9
184	L	36.9	Very low	32.9	Very low	163 Å²	163	126.2 Å²	126.2	85%	0.853	75%	0.749	S	S	*	*				56.7	129.4	58.9	-55.6	178.1	0	0	0	112.8
185	D	29.8	Very low	32.9	Very low	141 Å²	141	128.5 Å²	128.5	75%	0.754	75%	0.747	S	S	*	*			cis	-165.8	-179.7	-21	-143.9	-50	0	0	0	107.9
186	A	41.7	Very low	32.9	Very low	80 Å²	80	134 Å²	134	66%	0.661	75%	0.748	S	S	*	*			trans	64.1	123.6	171.9	0	0	0	0	0	115.9
187	E	31.9	Very low	33.1	Very low	182 Å²	182	135.8 Å²	135.8	85%	0.85	76%	0.757	S	S	*	*				52	116.8	61.8	-63.3	-69.4	94.9	0	0	113.7
188	E	33.8	Very low	33.4	Very low	166 Å²	166	134.7 Å²	134.7	78%	0.776	76%	0.759	S	S	*	*				164.8	120.9	109.6	-177.1	148.1	-167	0	0	114.6
189	N	26.1	Very low	33.6	Very low	123 Å²	123	137.7 Å²	137.7	66%	0.658	77%	0.766	S	S	*	*			trans	48.3	149.2	145.2	-67.2	-33.3	0	0	0	127
190	D	29.8	Very low	33.7	Very low	130 Å²	130	136.2 Å²	136.2	70%	0.695	77%	0.767	S	S	*	*			trans	67.1	88.5	140.4	-66.2	-21.8	0	0	0	124.2
191	I	36.3	Very low	33.6	Very low	152 Å²	152	135.2 Å²	135.2	78%	0.779	77%	0.771	S	S	*	*				20.2	119.9	98.9	-54.4	179.5	0	0	0	114.4
192	P	41	Very low	33.7	Very low	117 Å²	117	135.7 Å²	135.7	76%	0.76	78%	0.775	S	S	*	*				-154.7	160.4	73.3	41.5	-21.7	0	0	0	120.3
193	A	28.7	Very low	33.6	Very low	89 Å²	89	136.8 Å²	136.8	74%	0.736	78%	0.776	S	S	*	*			trans	57.1	108.9	138.3	0	0	0	0	0	122.7
194	N	29.5	Very low	33.6	Very low	126 Å²	126	139.6 Å²	139.6	67%	0.674	79%	0.785	S	S	*	*				71.8	110.1	117.7	-156.2	15.2	0	0	0	119.6
195	H	33.3	Very low	33.5	Very low	162 Å²	162	138 Å²	138	75%	0.75	78%	0.782	S	S	*	*				172	158.9	109.8	-89.1	-59.1	0	0	0	113.9
196	R	31.3	Very low	33.8	Very low	238 Å²	238	137.5 Å²	137.5	90%	0.898	78%	0.784	S	S	*	*			trans	59.6	110.2	162.2	-78.3	-176.6	169.6	-177.8	-3	120.1
197	S	34.1	Very low	33.4	Very low	114 Å²	114	138 Å²	138	80%	0.797	78%	0.782	S	S	*	*			trans	-65.2	157.1	139.8	-34.7	0	0	0	0	110.4
198	P	38.6	Very low	33.6	Very low	127 Å²	127	135.5 Å²	135.5	83%	0.825	78%	0.782	S	S	*	*				-140.9	177.4	76.5	35.8	-17.7	0	0	0	116.3
199	K	33.8	Very low	33.7	Very low	197 Å²	197	135.7 Å²	135.7	86%	0.857	78%	0.782	S	S	*	*			trans	-69.4	176.4	176.6	-50.2	170.3	-179.4	174.1	0	112.4
200	P	40.8	Very low	34.3	Very low	124 Å²	124	134.5 Å²	134.5	81%	0.805	78%	0.784	S	S	*	*			cis	-128	169.3	-23.1	33.2	-16.4	0	0	0	113.7
201	S	29.1	Very low	34.7	Very low	126 Å²	126	138.1 Å²	138.1	88%	0.881	79%	0.793	S	S	*	*			trans	-147.6	154.2	153.5	59.3	0	0	0	0	110.6
202	A	35.3	Very low	35.2	Very low	91 Å²	91	138.7 Å²	138.7	75%	0.752	79%	0.793	S	S	*	*			trans	-103.5	139.4	-173.7	0	0	0	0	0	112
203	N	32	Very low	35.8	Very low	159 Å²	159	143 Å²	143	85%	0.85	80%	0.799	S	S	*	*			trans	-165.2	123.1	133.2	-97.4	-28	0	0	0	109.9	V205	N203-V205 PolarHBondContact O-N 3.27Å
204	S	31.4	Very low	36.9	Very low	124 Å²	124	149 Å²	149	87%	0.867	80%	0.803	S	S	*	*			trans	-84.1	103.3	179.9	-172.5	0	0	0	0	109.9
205	V	36.2	Very low	38.4	Very low	130 Å²	130	150 Å²	150	79%	0.788	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-79.9	125.2	174.9	179.8	0	0	0	0	109.4	N203 S207	N203-V205 PolarHBondContact O-N 3.27Å; V205-S207 PolarHBondContact O-N 3.38Å
206	T	36.1	Very low	39.5	Very low	130 Å²	130	146 Å²	146	80%	0.798	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.7	118.1	-180	38.8	0	0	0	0	111.5
207	S	32.5	Very low	40.6	Very low	91 Å²	91	143 Å²	143	64%	0.636	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75.3	127.4	175.5	52.6	0	0	0	0	110.9	V205 H209	V205-S207 PolarHBondContact O-N 3.38Å; S207-H209 PolarHBondContact O-N 3.43Å
208	P	37	Very low	41.7	Very low	129 Å²	129	147.2 Å²	147.2	84%	0.838	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.5	117.3	174.1	27.5	-32.5	0	0	0	109.7	S210	P208-S210 PolarHBondContact O-N 2.84Å
209	H	35.1	Very low	42.5	Very low	170 Å²	170	148.6 Å²	148.6	79%	0.787	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-62.2	135.6	-177.4	-85.6	-99	0	0	0	112.7	S207	S207-H209 PolarHBondContact O-N 3.43Å
210	S	38.3	Very low	43.4	Very low	98 Å²	98	149.2 Å²	149.2	69%	0.685	79%	0.788	S	S	*	*			trans	34.2	102.5	156	58.6	0	0	0	0	117.5	P208 E212	P208-S210 PolarHBondContact O-N 2.84Å; S210-E212 PolarHBondContact O-N 3.5Å
211	K	39.5	Very low	44.3	Very low	206 Å²	206	148.5 Å²	148.5	90%	0.896	78%	0.781	S	S	*	*			trans	-52.8	115.8	156.3	-64.8	177.8	-178.6	177.1	0	108.7	K213	K211-K213 PolarHBondContact O-N 2.88Å
212	E	45.2	Very low	46.1	Very low	165 Å²	165	149.4 Å²	149.4	77%	0.771	77%	0.771	S	S	*	*			trans	-54.8	127.1	170.9	-73.7	-174.5	153.4	0	0	108.6	S210 R214	S210-E212 PolarHBondContact O-N 3.5Å; E212-R214 PolarHBondContact O-N 3.37Å
213	K	53.9	Low	48.1	Very low	206 Å²	206	151.8 Å²	151.8	90%	0.896	77%	0.767	S	S	*	*			trans	-72	81.6	178.8	-73.1	-178.8	-179.5	173.6	0	109.3	K211 M215	K211-K213 PolarHBondContact O-N 2.88Å; K213-M215 PolarHBondContact O-N 3.47Å
214	R	51.7	Low	50.6	Low	217 Å²	217	149.6 Å²	149.6	82%	0.819	75%	0.754	S	S	*	*			trans	-38.1	112.1	171.5	-150.9	-179.6	-153.6	166.3	7.3	108.4	E212 P216	E212-R214 PolarHBondContact O-N 3.37Å; R214-P216 WeakPolarHBondContact O-CD 3.31Å
215	M	61	Low	53.5	Low	147 Å²	147	146.1 Å²	146.1	72%	0.724	73%	0.729	S	S	*	*			trans	-57	126.3	-172.5	-82.8	-163.3	173.1	0	0	109.4	K213 F217	K213-M215 PolarHBondContact O-N 3.47Å; M215-F217 PolarHBondContact O-N 3.43Å; M215-F217 VanDerWaalsContact O-N 3.09Å
216	P	57.1	Low	56.2	Low	77 Å²	77	141 Å²	141	50%	0.5	70%	0.698	S	S	.	*			trans	-59.8	118.4	178.2	-24.9	34.5	0	0	0	109.8	R214 F218 K219	R214-P216 WeakPolarHBondContact O-CD 3.31Å; P216-F218 PolarHBondContact O-N 2.93Å; P216-K219 HydrophobicContact CB-CD 4.21Å; P216-K219 HydrophobicContact CB-CG 4.2Å; P216-K219 HydrophobicContact CG-CD 4.07Å; P216-K219 PolarHBondContact O-N 2.86Å
217	F	53.4	Low	59.1	Low	176 Å²	176	135.6 Å²	135.6	77%	0.772	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-4.4	-161.9	-82.4	-90.1	0	0	0	117.1	M215	M215-F217 PolarHBondContact O-N 3.43Å; M215-F217 VanDerWaalsContact O-N 3.09Å
218	F	58.1	Low	62.1	Low	201 Å²	201	131.7 Å²	131.7	88%	0.882	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	10.8	178.1	-67.8	-78.7	0	0	0	114.4	P216 K220	P216-F218 PolarHBondContact O-N 2.93Å; F218-K220 PolarHBondContact O-N 3.14Å; F218-K220 VanDerWaalsContact O-N 3.15Å
219	K	56	Low	64.9	Low	156 Å²	156	129.4 Å²	129.4	68%	0.678	62%	0.618	S	S	*	*			trans	-74.9	103.7	169.8	-76.9	-172.6	177.8	-172.1	0	110.1	P216 T221	P216-K219 HydrophobicContact CB-CD 4.21Å; P216-K219 HydrophobicContact CB-CG 4.2Å; P216-K219 HydrophobicContact CG-CD 4.07Å; P216-K219 PolarHBondContact O-N 2.86Å; K219-T221 VanDerWaalsContact C-N 3.33Å; K219-T221 PolarHBondContact O-N 3.05Å
220	K	51.9	Low	67.9	Low	210 Å²	210	121.4 Å²	121.4	91%	0.913	58%	0.582	S	S	*	*			trans	-63.9	94.8	160.1	-67.5	-179.4	-179.6	178.1	0	108.1	F218 E222	F218-K220 PolarHBondContact O-N 3.14Å; F218-K220 VanDerWaalsContact O-N 3.15Å; K220-E222 PolarHBondContact O-N 3.33Å; K220-E222 VanDerWaalsContact O-N 3.08Å
221	T	60	Low	70.7	Confident	110 Å²	110	116.9 Å²	116.9	68%	0.675	55%	0.55	S	S	*	*			trans	-66.8	104.9	172.2	-57.1	0	0	0	0	108.3	K219 H223	K219-T221 VanDerWaalsContact C-N 3.33Å; K219-T221 PolarHBondContact O-N 3.05Å; T221-H223 PolarHBondContact O-N 3.15Å
222	E	66.7	Low	73.5	Confident	144 Å²	144	107.8 Å²	107.8	67%	0.673	51%	0.512	S	S	*	.			trans	-64.1	121.1	174	-172.9	169.2	-163.3	0	0	108.8	K220 I224	K220-E222 PolarHBondContact O-N 3.33Å; K220-E222 VanDerWaalsContact O-N 3.08Å; E222-I224 PolarHBondContact O-N 3.06Å
223	H	77.7	Confident	76	Confident	141 Å²	141	99.9 Å²	99.9	65%	0.653	48%	0.475	S	S	*	.			trans	-76.4	92.5	-178.3	-179.9	-70.2	0	0	0	109.8	T221 P225	T221-H223 PolarHBondContact O-N 3.15Å; H223-P225 WeakPolarHBondContact O-CD 3.42Å
224	I	83.8	Confident	78.1	Confident	113 Å²	113	91.5 Å²	91.5	58%	0.579	44%	0.438	S	S	*	.			trans	-64.9	120.6	174.9	-60.2	171.6	0	0	0	108.4	N74 E222	N74-I224 HydrophobicContact CB-CG2 3.8Å; E222-I224 PolarHBondContact O-N 3.06Å
225	P	91.6	Very high	80.3	Confident	52 Å²	52	81.1 Å²	81.1	34%	0.338	40%	0.399	S	S	.	.			trans	-68.8	150.3	176	30.4	-35	0	0	0	110.3	N74 H223 Y227	N74-P225 WeakPolarHBondContact CB-O 3.16Å; N74-P225 PolarHBondContact ND2-O 2.86Å; H223-P225 WeakPolarHBondContact O-CD 3.42Å; P225-Y227 PolarHBondContact O-N 3.5Å; P225-Y227 VanDerWaalsContact O-N 3.13Å
226	P	94.3	Very high	82.1	Confident	23 Å²	23	74.2 Å²	74.2	15%	0.149	37%	0.365	C	S	.	.	S	Bend	trans	-62.6	-23.1	-179.5	24.9	-34	0	0	0	113.2	N74 V75 P128 L131	N74-P226 PolarHBondContact N-O 3.05Å; V75-P226 HydrophobicContact CG2-CB 3.69Å; P128-P226 HydrophobicContact CB-CG 3.87Å; P128-P226 HydrophobicContact CG-CG 4.4Å; L131-P226 HydrophobicContact CD1-CB 3.61Å; L131-P226 HydrophobicContact CD1-CG 4.12Å
227	Y	96.8	Very high	84.1	Confident	15 Å²	15	70.5 Å²	70.5	6%	0.059	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	131.2	177	-59.7	-39.9	0	0	0	110.2	V71 R72 T73 F94 L100 W111 I125 P126 P128 L131 P225	V71-Y227 HydrophobicContact CB-CG 4.31Å; V71-Y227 HydrophobicContact CG2-CD1 4.07Å; V71-Y227 HydrophobicContact CG2-CG 4.05Å; R72-Y227 WeakPolarHBondContact O-CA 3.46Å; T73-Y227 HydrophobicContact CG2-CD1 4.13Å; T73-Y227 HydrophobicContact CG2-CE1 3.99Å; F94-Y227 HydrophobicContact CE2-CE1 4.11Å; F94-Y227 AromaticContact CZ-CE1 3.81Å; F94-Y227 HydrophobicContact CZ-CE1 3.81Å; F94-Y227 AromaticContact CZ-CZ 3.99Å; F94-Y227 VanDerWaalsContact CZ-OH 3.24Å; F94-Y227 WeakPolarHBondContact CZ-OH 3.36Å; L100-Y227 HydrophobicContact CD1-CE1 4.05Å; W111-Y227 HydrophobicContact CE3-CE2 4.25Å; W111-Y227 AromaticContact CH2-CD2 3.86Å; W111-Y227 HydrophobicContact CH2-CD2 3.86Å; W111-Y227 HydrophobicContact CH2-CE2 4.23Å; W111-Y227 AromaticContact CZ3-CD2 3.6Å; W111-Y227 HydrophobicContact CZ3-CD2 3.6Å; W111-Y227 AromaticContact CZ3-CE2 3.72Å; W111-Y227 HydrophobicContact CZ3-CE2 3.72Å; I125-Y227 HydrophobicContact CG2-CE2 4.48Å; I125-Y227 VanDerWaalsContact CG2-OH 3.32Å; I125-Y227 WeakPolarHBondContact CG2-OH 3.36Å; P126-Y227 WeakPolarHBondContact O-CE2 3.24Å; P126-Y227 PolarHBondContact O-OH 2.92Å; P128-Y227 HydrophobicContact CG-CD2 3.81Å; P128-Y227 HydrophobicContact CG-CE2 4.24Å; L131-Y227 HydrophobicContact CD1-CE1 4.13Å; L131-Y227 HydrophobicContact CD1-CE2 4.12Å; P225-Y227 PolarHBondContact O-N 3.5Å; P225-Y227 VanDerWaalsContact O-N 3.13Å
228	D	95.3	Very high	86.2	Confident	10 Å²	10	62.1 Å²	62.1	5%	0.053	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	133.8	159.9	-71.4	-52.1	0	0	0	108.3	V71 R72 N74 R282	V71-D228 CarbonylContact C-O 3.54Å; V71-D228 WeakPolarHBondContact CA-O 3.47Å; V71-D228 WeakPolarHBondContact CB-O 3.48Å; R72-D228 IonicContact CZ-OD2 3.62Å; R72-D228 PolarHBondContact N-O 3.28Å; R72-D228 IonicContact NE-OD2 3.64Å; R72-D228 IonicContact NH2-OD2 2.75Å; R72-D228 PolarHBondContact NH2-OD2 2.64Å; R72-D228 PolarHBondContact O-N 2.85Å; N74-D228 VanDerWaalsContact ND2-CG 3.28Å; N74-D228 PolarHBondContact ND2-OD2 2.92Å; N74-D228 PolarHBondContact OD1-OD2 3.49Å; D228-R282 VanDerWaalsContact OD1-CD 3.32Å; D228-R282 WeakPolarHBondContact OD1-CD 3.2Å; D228-R282 IonicContact OD1-CZ 3.81Å; D228-R282 IonicContact OD1-NE 3.7Å; D228-R282 PolarHBondContact OD1-NE 2.86Å; D228-R282 IonicContact OD2-CZ 3.45Å; D228-R282 VanDerWaalsContact OD2-CZ 3.3Å; D228-R282 IonicContact OD2-NE 3.38Å; D228-R282 PolarHBondContact OD2-NE 3.29Å; D228-R282 IonicContact OD2-NH2 2.7Å; D228-R282 PolarHBondContact OD2-NH2 3.45Å; D228-R282 VanDerWaalsContact OD2-NH2 3.17Å
229	V	96.3	Very high	88.1	Confident	80 Å²	80	52.6 Å²	52.6	49%	0.485	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	133.2	171.3	-180	0	0	0	0	109.3	V71 F314 S340	V71-V229 HydrophobicContact CG1-CG2 4.3Å; V229-F314 HydrophobicContact CG1-CE1 4.22Å; V229-S340 WeakPolarHBondContact O-CB 3.46Å
230	V	97.5	Very high	90	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	161.8	-174.4	-55.9	0	0	0	0	111.2	A70 R72 F99 F314 S340 A342	A70-V230 HydrophobicContact CB-CG2 4.02Å; A70-V230 PolarHBondContact O-N 2.92Å; R72-V230 HydrophobicContact CB-CG1 3.77Å; F99-V230 HydrophobicContact CD1-CG2 4.18Å; F99-V230 HydrophobicContact CE1-CG2 4.34Å; V230-F314 WeakPolarHBondContact O-CE1 3.48Å; V230-S340 WeakPolarHBondContact CA-O 3.49Å; V230-S340 WeakPolarHBondContact CG1-O 3.34Å; V230-A342 HydrophobicContact CB-CB 4.27Å; V230-A342 HydrophobicContact CG1-CB 3.86Å
231	P	98	Very high	92.2	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.019	19%	0.188	C	C	.	.			trans	-57.3	141	173.7	-24.5	35.2	0	0	0	112	M233 I313 F314 A317 S340 L341	P231-M233 WeakPolarHBondContact CB-O 3.1Å; P231-M233 PolarHBondContact O-N 3.33Å; P231-I313 HydrophobicContact CG-CG2 4.49Å; P231-F314 HydrophobicContact CG-CD1 4.28Å; P231-F314 HydrophobicContact CG-CD2 3.87Å; P231-F314 HydrophobicContact CG-CE1 4.17Å; P231-F314 HydrophobicContact CG-CE2 3.75Å; P231-F314 HydrophobicContact CG-CG 4.15Å; P231-F314 HydrophobicContact CG-CZ 3.92Å; P231-A317 HydrophobicContact CB-CB 3.6Å; P231-S340 WeakPolarHBondContact CD-O 3.36Å; P231-L341 WeakPolarHBondContact CD-O 3.32Å; P231-L341 HydrophobicContact CG-CD2 4.13Å
232	S	97	Very high	94	Very high	14 Å²	14	30.1 Å²	30.1	10%	0.098	16%	0.156	C	C	.	.	S	Bend	trans	-63.7	-25.4	-176.2	-59.9	0	0	0	0	114.1	H101	H101-S232 PolarHBondContact NE2-O 3.18Å
233	M	98	Very high	95.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-117.9	128.4	164	-64.7	-65.8	-75.8	0	0	108.2	P231 P235 A317 L320 Q321 L322 Y412 W413 T416	P231-M233 WeakPolarHBondContact CB-O 3.1Å; P231-M233 PolarHBondContact O-N 3.33Å; M233-P235 WeakPolarHBondContact O-CD 3.33Å; M233-A317 HydrophobicContact CB-CB 4.24Å; M233-L320 WeakPolarHBondContact CE-O 3.39Å; M233-L320 VanDerWaalsContact CG-CA 3.46Å; M233-L320 HydrophobicContact CG-CB 4.25Å; M233-L320 HydrophobicContact CG-CD2 4.04Å; M233-L320 HydrophobicContact SD-CB 4.26Å; M233-L320 HydrophobicContact SD-CD2 4.07Å; M233-Q321 WeakPolarHBondContact CB-O 3.33Å; M233-Q321 WeakPolarHBondContact CG-O 3.21Å; M233-L322 HydrophobicContact CE-CD2 3.93Å; M233-Y412 HydrophobicContact CE-CD1 4.31Å; M233-Y412 HydrophobicContact CE-CE1 3.77Å; M233-Y412 HydrophobicContact SD-CE1 4.4Å; M233-W413 HydrophobicContact CE-CE3 4.33Å; M233-W413 HydrophobicContact CE-CZ3 4.49Å; M233-T416 HydrophobicContact CE-CG2 4.1Å; M233-T416 HydrophobicContact SD-CG2 3.55Å; M233-T416 VanDerWaalsContact SD-CG2 3.55Å
234	R	98.2	Very high	96.3	Very high	29 Å²	29	19.4 Å²	19.4	11%	0.109	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-65.3	123.9	178.4	-65.2	174.6	67.5	-163.2	1.8	109	F99 V236 A342 P343 I344 D390 Y412	F99-R234 HydrophobicContact CD1-CG 4.25Å; F99-R234 HydrophobicContact CE1-CG 3.84Å; F99-R234 HydrophobicContact CZ-CG 4.17Å; F99-R234 VanDerWaalsContact CZ-NE 3.34Å; R234-V236 PolarHBondContact O-N 3.16Å; R234-A342 WeakPolarHBondContact CG-O 3.22Å; R234-A342 PolarHBondContact NE-O 2.95Å; R234-P343 PolarHBondContact NH2-O 2.71Å; R234-I344 HydrophobicContact CB-CD1 3.94Å; R234-I344 HydrophobicContact CB-CG1 3.77Å; R234-D390 IonicContact CZ-OD1 2.64Å; R234-D390 IonicContact CZ-OD2 3.79Å; R234-D390 IonicContact NH1-OD1 2.68Å; R234-D390 PolarHBondContact NH1-OD1 3.38Å; R234-D390 IonicContact NH2-OD1 2.62Å; R234-D390 PolarHBondContact NH2-OD1 2.97Å; R234-D390 IonicContact NH2-OD2 3.26Å; R234-D390 PolarHBondContact NH2-OD2 3.15Å; R234-Y412 WeakPolarHBondContact CG-OH 3.45Å; R234-Y412 PolarHBondContact N-OH 3.08Å
235	P	98.3	Very high	96.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.109	C	C	.	.	P	Polyproline II helix	trans	-67.7	131.5	177.2	24.4	-30.9	0	0	0	110.9	M233 I313 V323 L325 L341 P343 I344	M233-P235 WeakPolarHBondContact O-CD 3.33Å; P235-I313 HydrophobicContact CB-CG2 4.16Å; P235-I313 HydrophobicContact CG-CG2 4.07Å; P235-V323 CarbonylContact C-O 3.56Å; P235-V323 WeakPolarHBondContact CA-O 3.25Å; P235-V323 HydrophobicContact CB-CB 4.44Å; P235-V323 HydrophobicContact CB-CG1 4.27Å; P235-L325 HydrophobicContact CB-CD1 3.67Å; P235-L325 HydrophobicContact CB-CD2 4.4Å; P235-L325 HydrophobicContact CB-CG 3.82Å; P235-L325 HydrophobicContact CG-CD1 4.22Å; P235-L341 WeakPolarHBondContact CD-O 3.31Å; P235-L341 HydrophobicContact CG-CB 4.25Å; P235-P343 HydrophobicContact CG-CB 4.19Å; P235-P343 CarbonylContact O-C 3.42Å; P235-P343 WeakPolarHBondContact O-CA 3.46Å; P235-P343 WeakPolarHBondContact O-CB 3.36Å; P235-I344 PolarHBondContact O-N 3.17Å
236	V	98.6	Very high	97.1	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.006	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	131.9	176.1	-170.9	0	0	0	0	109.7	R234 V323 V324 L325 I344 V346 L409	R234-V236 PolarHBondContact O-N 3.16Å; V236-V323 PolarHBondContact N-O 3.21Å; V236-V324 HydrophobicContact CB-CB 4.46Å; V236-V324 HydrophobicContact CB-CG1 4.34Å; V236-V324 HydrophobicContact CB-CG2 4.02Å; V236-V324 HydrophobicContact CG2-CG2 4.15Å; V236-L325 PolarHBondContact O-N 3.25Å; V236-I344 WeakPolarHBondContact CA-O 3.32Å; V236-I344 HydrophobicContact CG1-CG2 4.36Å; V236-I344 HydrophobicContact CG2-CB 4.34Å; V236-I344 HydrophobicContact CG2-CD1 4.31Å; V236-V346 HydrophobicContact CG1-CG2 3.68Å; V236-L409 HydrophobicContact CG2-CD2 3.75Å
237	V	98.4	Very high	97.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	121.7	179.4	-175.9	0	0	0	0	109.6	L325 I330 L336 P343 I344 I345 V346	V237-L325 HydrophobicContact CG2-CB 4.29Å; V237-L325 HydrophobicContact CG2-CD1 4.23Å; V237-I330 HydrophobicContact CG1-CB 4.37Å; V237-I330 HydrophobicContact CG1-CG2 4Å; V237-L336 HydrophobicContact CG1-CD1 4.3Å; V237-L336 HydrophobicContact CG2-CD1 4.07Å; V237-P343 HydrophobicContact CB-CB 4.49Å; V237-P343 HydrophobicContact CG2-CB 3.75Å; V237-I344 PolarHBondContact N-O 2.56Å; V237-I345 HydrophobicContact CB-CD1 4.24Å; V237-V346 PolarHBondContact O-N 3.24Å
238	L	98.3	Very high	97.3	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	132.5	175.1	-69.6	88.9	0	0	0	111.5	K244 Q253 L256 F257 V346 V348	L238-K244 VanDerWaalsContact O-CE 3.22Å; L238-K244 WeakPolarHBondContact O-CE 3.48Å; L238-K244 PolarHBondContact O-NZ 3.03Å; L238-Q253 HydrophobicContact CB-CG 4.2Å; L238-Q253 HydrophobicContact CD2-CG 4.45Å; L238-Q253 PolarHBondContact O-NE2 3.46Å; L238-Q253 PolarHBondContact O-OE1 3.13Å; L238-L256 HydrophobicContact CD2-CB 3.81Å; L238-L256 HydrophobicContact CD2-CD1 3.47Å; L238-L256 VanDerWaalsContact CD2-CD1 3.47Å; L238-L256 HydrophobicContact CD2-CG 4.29Å; L238-F257 HydrophobicContact CD1-CD1 4.12Å; L238-F257 HydrophobicContact CD1-CE1 3.47Å; L238-F257 VanDerWaalsContact CD1-CE1 3.47Å; L238-F257 HydrophobicContact CD1-CZ 3.9Å; L238-V346 WeakPolarHBondContact CA-O 3.17Å; L238-V346 HydrophobicContact CG-CB 4.18Å; L238-V346 HydrophobicContact CG-CG1 4.35Å; L238-V348 HydrophobicContact CD2-CG2 4.1Å
239	V	98	Very high	97.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153	172.9	-62.3	0	0	0	0	110.6	I330 I345 V346 Y347 V348 L381 F389	V239-I330 HydrophobicContact CG1-CG2 4.1Å; V239-I345 HydrophobicContact CG1-CG2 4.47Å; V239-I345 HydrophobicContact CG2-CG2 3.63Å; V239-V346 PolarHBondContact N-O 2.67Å; V239-Y347 WeakPolarHBondContact O-CA 3.3Å; V239-V348 PolarHBondContact O-N 3.05Å; V239-L381 HydrophobicContact CG2-CD2 4.31Å; V239-F389 HydrophobicContact CG2-CD1 4.45Å; V239-F389 HydrophobicContact CG2-CE1 4.1Å
240	G	96.6	Very high	97.5	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.01	10%	0.098	C	C	.	.			trans	75.4	175.5	-175.6	0	0	0	0	0	113.9	S242 Q253 V348 L381	G240-S242 VanDerWaalsContact C-N 3.32Å; G240-Q253 PolarHBondContact O-NE2 3.46Å; G240-V348 CarbonylContact C-O 3.57Å; G240-L381 VanDerWaalsContact CA-CD1 3.5Å
241	P	97	Very high	97.5	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.013	12%	0.121	C	C	.	.	S	Bend	cis	-79.9	-5.5	5.5	32.8	-36.8	0	0	0	114.8	M252 V348 I350 A378	P241-M252 HydrophobicContact CG-CE 4.08Å; P241-M252 HydrophobicContact CG-SD 3.8Å; P241-V348 WeakPolarHBondContact CA-O 3.35Å; P241-V348 WeakPolarHBondContact CB-O 3.41Å; P241-V348 HydrophobicContact CG-CG1 4.48Å; P241-I350 HydrophobicContact CB-CB 4.22Å; P241-I350 HydrophobicContact CB-CD1 3.68Å; P241-I350 HydrophobicContact CB-CG1 3.65Å; P241-I350 HydrophobicContact CG-CD1 3.59Å; P241-I350 HydrophobicContact CG-CG1 4.01Å; P241-A378 WeakPolarHBondContact O-CB 3.31Å
242	S	97.7	Very high	97.4	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.007	14%	0.136	C	C	.	.	S	Bend	trans	-143.8	-155.9	171.9	-169.9	0	0	0	0	109.6	G240 Q374	G240-S242 VanDerWaalsContact C-N 3.32Å; S242-Q374 WeakPolarHBondContact OG-CA 3.49Å; S242-Q374 WeakPolarHBondContact OG-CB 3.4Å; S242-Q374 PolarHBondContact OG-O 2.78Å
243	L	96.6	Very high	97.5	Very high	40 Å²	40	24 Å²	24	21%	0.209	13%	0.132	C	C	.	.			trans	-67.9	141.9	172	-66.5	178.5	0	0	0	111.5	Y246 T249 N331 V373 A377	L243-Y246 HydrophobicContact CB-CD2 3.66Å; L243-Y246 HydrophobicContact CB-CE2 3.68Å; L243-Y246 HydrophobicContact CD1-CE2 3.86Å; L243-Y246 HydrophobicContact CG-CE2 4.41Å; L243-T249 WeakPolarHBondContact O-CB 3.43Å; L243-T249 PolarHBondContact O-OG1 2.97Å; L243-N331 VanDerWaalsContact CA-OD1 3.26Å; L243-N331 WeakPolarHBondContact CA-OD1 3.47Å; L243-N331 HydrophobicContact CD2-CB 4.08Å; L243-V373 HydrophobicContact CD1-CG2 3.88Å; L243-A377 HydrophobicContact CD1-CB 4.22Å; L243-A377 HydrophobicContact CD2-CB 3.48Å; L243-A377 VanDerWaalsContact CD2-CB 3.48Å; L243-A377 HydrophobicContact CG-CB 3.42Å; L243-A377 VanDerWaalsContact CG-CB 3.42Å
244	K	96.4	Very high	97.4	Very high	20 Å²	20	29.4 Å²	29.4	9%	0.087	16%	0.155	C	C	.	.	S	Bend	trans	-68.1	162.2	163.2	-59.5	-168	179.7	-157.6	0	111.4	L238 Y246 T249 D250 A327 I330 N331	L238-K244 VanDerWaalsContact O-CE 3.22Å; L238-K244 WeakPolarHBondContact O-CE 3.48Å; L238-K244 PolarHBondContact O-NZ 3.03Å; K244-Y246 VanDerWaalsContact C-N 3.33Å; K244-T249 HydrophobicContact CG-CG2 4.15Å; K244-D250 VanDerWaalsContact CA-OD1 3.32Å; K244-D250 WeakPolarHBondContact CA-OD1 3.41Å; K244-A327 WeakPolarHBondContact CD-O 3.04Å; K244-A327 WeakPolarHBondContact CE-O 3.38Å; K244-A327 PolarHBondContact NZ-O 3.05Å; K244-I330 VanDerWaalsContact CE-O 3.24Å; K244-I330 WeakPolarHBondContact CE-O 3.37Å; K244-N331 PolarHBondContact N-OD1 3.02Å
245	G	95.5	Very high	97.4	Very high	61 Å²	61	29.5 Å²	29.5	63%	0.629	16%	0.162	S	C	*	.	S	Bend	trans	79	19.3	-172.9	0	0	0	0	0	112.9	D250	G245-D250 VanDerWaalsContact C-OD2 3.23Å; G245-D250 WeakPolarHBondContact CA-OD2 3.48Å; G245-D250 PolarHBondContact N-OD1 3.15Å; G245-D250 PolarHBondContact N-OD2 2.98Å; G245-D250 VanDerWaalsContact N-OD2 3.15Å
246	Y	97.5	Very high	97.4	Very high	43 Å²	43	29.8 Å²	29.8	17%	0.169	16%	0.164	C	C	.	.	S	Bend	trans	-137.3	135.9	176.1	-63.7	-77.7	0	0	0	109.8	L243 K244 V248 T249 D250 H370 Q374	L243-Y246 HydrophobicContact CB-CD2 3.66Å; L243-Y246 HydrophobicContact CB-CE2 3.68Å; L243-Y246 HydrophobicContact CD1-CE2 3.86Å; L243-Y246 HydrophobicContact CG-CE2 4.41Å; K244-Y246 VanDerWaalsContact C-N 3.33Å; Y246-V248 PolarHBondContact O-N 3.1Å; Y246-T249 PolarHBondContact O-N 3.45Å; Y246-T249 VanDerWaalsContact O-N 3.07Å; Y246-D250 PolarHBondContact N-OD2 3Å; Y246-D250 VanDerWaalsContact O-CG 3.25Å; Y246-D250 PolarHBondContact O-N 3.48Å; Y246-H370 HydrophobicContact CD1-CB 4.27Å; Y246-H370 HydrophobicContact CE1-CB 3.49Å; Y246-H370 VanDerWaalsContact CE1-CB 3.49Å; Y246-H370 AromaticContact CE1-CD2 3.79Å; Y246-H370 AromaticContact CE1-CG 3.68Å; Y246-Q374 HydrophobicContact CD1-CG 4.28Å; Y246-Q374 HydrophobicContact CD2-CG 3.86Å; Y246-Q374 HydrophobicContact CE1-CG 4.48Å; Y246-Q374 HydrophobicContact CE2-CG 4.09Å; Y246-Q374 HydrophobicContact CG-CG 3.93Å; Y246-Q374 VanDerWaalsContact CG-NE2 3.29Å
247	E	97.6	Very high	97.4	Very high	60 Å²	60	30.5 Å²	30.5	28%	0.28	17%	0.167	S	C	.	.	H	α-helix	trans	-51.4	-35.5	-168.5	-69.1	165.9	-126.8	0	0	114.8	M251 R363 Q367	E247-M251 WeakPolarHBondContact O-CB 3.49Å; E247-M251 WeakPolarHBondContact O-CG 3.36Å; E247-M251 PolarHBondContact O-N 2.9Å; E247-R363 HydrophobicContact CB-CG 4.35Å; E247-R363 IonicContact OE2-CZ 2.62Å; E247-R363 IonicContact OE2-NE 2.71Å; E247-R363 PolarHBondContact OE2-NE 3.09Å; E247-R363 IonicContact OE2-NH2 3.17Å; E247-R363 PolarHBondContact OE2-NH2 2.94Å; E247-Q367 HydrophobicContact CB-CG 4.32Å; E247-Q367 HydrophobicContact CG-CG 4.33Å; E247-Q367 WeakPolarHBondContact OE1-CG 3.2Å; E247-Q367 PolarHBondContact OE1-NE2 3.31Å
248	V	97.3	Very high	97.4	Very high	10 Å²	10	33.7 Å²	33.7	6%	0.061	18%	0.184	C	C	.	.	H	α-helix	trans	-66.8	-50.9	-179.5	-179	0	0	0	0	111.1	Y246 M252 L356 L359 I360 R363	Y246-V248 PolarHBondContact O-N 3.1Å; V248-M252 HydrophobicContact CG1-SD 4.16Å; V248-M252 WeakPolarHBondContact O-CB 3.09Å; V248-M252 VanDerWaalsContact O-CG 3.23Å; V248-M252 WeakPolarHBondContact O-CG 3.09Å; V248-M252 PolarHBondContact O-N 3.37Å; V248-L356 HydrophobicContact CG1-CD1 4.12Å; V248-L359 HydrophobicContact CG1-CB 4.15Å; V248-L359 HydrophobicContact CG2-CB 4.41Å; V248-I360 HydrophobicContact CG2-CG1 4Å; V248-R363 HydrophobicContact CG2-CG 3.77Å
249	T	97.5	Very high	97.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-48.7	178.9	-51.6	0	0	0	0	110.7	L243 K244 Y246 M251 M252 Q253	L243-T249 WeakPolarHBondContact O-CB 3.43Å; L243-T249 PolarHBondContact O-OG1 2.97Å; K244-T249 HydrophobicContact CG-CG2 4.15Å; Y246-T249 PolarHBondContact O-N 3.45Å; Y246-T249 VanDerWaalsContact O-N 3.07Å; T249-M251 PolarHBondContact O-N 3.39Å; T249-M252 PolarHBondContact O-N 3.49Å; T249-Q253 HydrophobicContact CG2-CG 4.45Å; T249-Q253 WeakPolarHBondContact O-CG 3.33Å; T249-Q253 PolarHBondContact O-N 3.18Å
250	D	97.2	Very high	97.3	Very high	62 Å²	62	36.5 Å²	36.5	33%	0.332	20%	0.196	S	C	.	.	H	α-helix	trans	-67.8	-39.7	-170.6	-57.2	-13.3	0	0	0	111.2	K244 G245 Y246 K254	K244-D250 VanDerWaalsContact CA-OD1 3.32Å; K244-D250 WeakPolarHBondContact CA-OD1 3.41Å; G245-D250 VanDerWaalsContact C-OD2 3.23Å; G245-D250 WeakPolarHBondContact CA-OD2 3.48Å; G245-D250 PolarHBondContact N-OD1 3.15Å; G245-D250 PolarHBondContact N-OD2 2.98Å; G245-D250 VanDerWaalsContact N-OD2 3.15Å; Y246-D250 PolarHBondContact N-OD2 3Å; Y246-D250 VanDerWaalsContact O-CG 3.25Å; Y246-D250 PolarHBondContact O-N 3.48Å; D250-K254 VanDerWaalsContact O-CB 3.28Å; D250-K254 WeakPolarHBondContact O-CB 3.28Å; D250-K254 PolarHBondContact O-N 3.36Å
251	M	96.9	Very high	97.4	Very high	105 Å²	105	42.2 Å²	42.2	52%	0.517	22%	0.221	S	C	.	.	H	α-helix	trans	-69	-38.4	175.4	-69.6	-178.3	66.3	0	0	112.6	E247 T249 K254 A255 R363	E247-M251 WeakPolarHBondContact O-CB 3.49Å; E247-M251 WeakPolarHBondContact O-CG 3.36Å; E247-M251 PolarHBondContact O-N 2.9Å; T249-M251 PolarHBondContact O-N 3.39Å; M251-K254 PolarHBondContact O-N 3.39Å; M251-A255 PolarHBondContact O-N 3.27Å; M251-A255 VanDerWaalsContact O-N 3.1Å; M251-R363 VanDerWaalsContact SD-CZ 3.57Å; M251-R363 PolarHBondContact SD-NH1 3.47Å; M251-R363 PolarHBondContact SD-NH2 3.26Å
252	M	97.3	Very high	97.4	Very high	65 Å²	65	48 Å²	48	32%	0.32	25%	0.247	S	C	.	.	H	α-helix	trans	-66.9	-43.9	177.3	-72.7	178.2	71.2	0	0	111.6	P241 V248 T249 A255 L256 V348 I350	P241-M252 HydrophobicContact CG-CE 4.08Å; P241-M252 HydrophobicContact CG-SD 3.8Å; V248-M252 HydrophobicContact CG1-SD 4.16Å; V248-M252 WeakPolarHBondContact O-CB 3.09Å; V248-M252 VanDerWaalsContact O-CG 3.23Å; V248-M252 WeakPolarHBondContact O-CG 3.09Å; V248-M252 PolarHBondContact O-N 3.37Å; T249-M252 PolarHBondContact O-N 3.49Å; M252-A255 PolarHBondContact O-N 3.35Å; M252-L256 PolarHBondContact O-N 3.11Å; M252-V348 HydrophobicContact CE-CG1 4Å; M252-I350 HydrophobicContact CE-CD1 4.13Å; M252-I350 HydrophobicContact CE-CG1 4.25Å; M252-I350 HydrophobicContact SD-CD1 4.07Å
253	Q	97.9	Very high	97.3	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.019	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-37.3	174.8	-66.4	-162.7	4.5	0	0	112.1	L238 G240 T249 A255 L256 F257	L238-Q253 HydrophobicContact CB-CG 4.2Å; L238-Q253 HydrophobicContact CD2-CG 4.45Å; L238-Q253 PolarHBondContact O-NE2 3.46Å; L238-Q253 PolarHBondContact O-OE1 3.13Å; G240-Q253 PolarHBondContact O-NE2 3.46Å; T249-Q253 HydrophobicContact CG2-CG 4.45Å; T249-Q253 WeakPolarHBondContact O-CG 3.33Å; T249-Q253 PolarHBondContact O-N 3.18Å; Q253-A255 VanDerWaalsContact C-N 3.34Å; Q253-A255 PolarHBondContact O-N 3.05Å; Q253-L256 PolarHBondContact O-N 2.86Å; Q253-F257 HydrophobicContact CB-CD2 4.45Å; Q253-F257 HydrophobicContact CB-CE2 4.09Å; Q253-F257 WeakPolarHBondContact O-CD2 3.45Å; Q253-F257 WeakPolarHBondContact O-CG 3.18Å; Q253-F257 PolarHBondContact O-N 3.13Å
254	K	97.5	Very high	97.4	Very high	114 Å²	114	51 Å²	51	50%	0.496	26%	0.256	S	S	.	.	H	α-helix	trans	-59.4	-42.4	175.3	-164.2	-161.3	-178.3	-57.5	0	112.2	D250 M251 L256 F257 D258	D250-K254 VanDerWaalsContact O-CB 3.28Å; D250-K254 WeakPolarHBondContact O-CB 3.28Å; D250-K254 PolarHBondContact O-N 3.36Å; M251-K254 PolarHBondContact O-N 3.39Å; K254-L256 VanDerWaalsContact C-N 3.3Å; K254-L256 PolarHBondContact O-N 2.89Å; K254-F257 PolarHBondContact O-N 2.7Å; K254-D258 IonicContact NZ-OD1 3.98Å; K254-D258 PolarHBondContact NZ-OD1 3.21Å; K254-D258 IonicContact NZ-OD2 2.72Å; K254-D258 PolarHBondContact NZ-OD2 3.22Å; K254-D258 WeakPolarHBondContact O-CB 3.35Å; K254-D258 VanDerWaalsContact O-CG 3.24Å; K254-D258 PolarHBondContact O-N 3.22Å
255	A	98	Very high	97.3	Very high	30 Å²	30	57.3 Å²	57.3	25%	0.248	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-41.7	177.3	0	0	0	0	0	112.1	M251 M252 Q253 D258 F259 L398	M251-A255 PolarHBondContact O-N 3.27Å; M251-A255 VanDerWaalsContact O-N 3.1Å; M252-A255 PolarHBondContact O-N 3.35Å; Q253-A255 VanDerWaalsContact C-N 3.34Å; Q253-A255 PolarHBondContact O-N 3.05Å; A255-D258 PolarHBondContact O-N 2.92Å; A255-F259 PolarHBondContact O-N 2.95Å; A255-L398 HydrophobicContact CB-CD1 3.9Å; A255-L398 HydrophobicContact CB-CD2 3.95Å
256	L	98.3	Very high	97.3	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-41	175.5	-63.9	170.4	0	0	0	112.1	L238 M252 Q253 K254 F259 L260 V348 L393 L398	L238-L256 HydrophobicContact CD2-CB 3.81Å; L238-L256 HydrophobicContact CD2-CD1 3.47Å; L238-L256 VanDerWaalsContact CD2-CD1 3.47Å; L238-L256 HydrophobicContact CD2-CG 4.29Å; M252-L256 PolarHBondContact O-N 3.11Å; Q253-L256 PolarHBondContact O-N 2.86Å; K254-L256 VanDerWaalsContact C-N 3.3Å; K254-L256 PolarHBondContact O-N 2.89Å; L256-F259 PolarHBondContact O-N 3.12Å; L256-L260 WeakPolarHBondContact O-CB 3.45Å; L256-L260 VanDerWaalsContact O-CG 3.3Å; L256-L260 WeakPolarHBondContact O-CG 3.28Å; L256-L260 PolarHBondContact O-N 2.86Å; L256-V348 HydrophobicContact CD1-CG2 3.54Å; L256-L393 HydrophobicContact CD1-CD1 4.23Å; L256-L398 HydrophobicContact CD2-CD1 4Å; L256-L398 HydrophobicContact CG-CD1 4.48Å
257	F	97.9	Very high	97.2	Very high	16 Å²	16	58.4 Å²	58.4	7%	0.07	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-43	173.4	-69.1	-52.7	0	0	0	112.3	L238 Q253 K254 L260 K261 I270 V324 D326	L238-F257 HydrophobicContact CD1-CD1 4.12Å; L238-F257 HydrophobicContact CD1-CE1 3.47Å; L238-F257 VanDerWaalsContact CD1-CE1 3.47Å; L238-F257 HydrophobicContact CD1-CZ 3.9Å; Q253-F257 HydrophobicContact CB-CD2 4.45Å; Q253-F257 HydrophobicContact CB-CE2 4.09Å; Q253-F257 WeakPolarHBondContact O-CD2 3.45Å; Q253-F257 WeakPolarHBondContact O-CG 3.18Å; Q253-F257 PolarHBondContact O-N 3.13Å; K254-F257 PolarHBondContact O-N 2.7Å; F257-L260 PolarHBondContact O-N 3.23Å; F257-K261 WeakPolarHBondContact O-CB 3.37Å; F257-K261 PolarHBondContact O-N 2.97Å; F257-I270 HydrophobicContact CD1-CG2 4.38Å; F257-I270 WeakPolarHBondContact O-CD1 3.38Å; F257-V324 HydrophobicContact CD1-CG1 3.84Å; F257-V324 HydrophobicContact CE1-CG1 3.6Å; F257-D326 HydrophobicContact CE1-CB 4.35Å; F257-D326 HydrophobicContact CE2-CB 3.87Å; F257-D326 WeakPolarHBondContact CE2-OD1 3.48Å; F257-D326 HydrophobicContact CZ-CB 3.74Å
258	D	97.8	Very high	97.2	Very high	68 Å²	68	56.9 Å²	56.9	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-62.7	-41.6	177.6	-70.6	-20.9	0	0	0	110.9	K254 A255 H262	K254-D258 IonicContact NZ-OD1 3.98Å; K254-D258 PolarHBondContact NZ-OD1 3.21Å; K254-D258 IonicContact NZ-OD2 2.72Å; K254-D258 PolarHBondContact NZ-OD2 3.22Å; K254-D258 WeakPolarHBondContact O-CB 3.35Å; K254-D258 VanDerWaalsContact O-CG 3.24Å; K254-D258 PolarHBondContact O-N 3.22Å; A255-D258 PolarHBondContact O-N 2.92Å; D258-H262 PolarHBondContact O-ND1 2.89Å
259	F	98	Very high	97.2	Very high	58 Å²	58	57.9 Å²	57.9	25%	0.254	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-53.9	173	166.9	-100.3	0	0	0	112.1	A255 L256 K261 H262 R263 C402 A406	A255-F259 PolarHBondContact O-N 2.95Å; L256-F259 PolarHBondContact O-N 3.12Å; F259-K261 PolarHBondContact O-N 3.05Å; F259-H262 PolarHBondContact O-N 2.88Å; F259-H262 VanDerWaalsContact O-N 3.11Å; F259-R263 HydrophobicContact CD1-CB 4.44Å; F259-R263 HydrophobicContact CD2-CB 4.38Å; F259-R263 HydrophobicContact CE1-CB 4.02Å; F259-R263 HydrophobicContact CE1-CG 4.01Å; F259-R263 HydrophobicContact CE2-CB 3.95Å; F259-R263 HydrophobicContact CE2-CG 4.12Å; F259-R263 HydrophobicContact CZ-CB 3.76Å; F259-R263 HydrophobicContact CZ-CG 3.57Å; F259-R263 WeakPolarHBondContact O-CB 3.47Å; F259-R263 PolarHBondContact O-N 2.88Å; F259-C402 HydrophobicContact CD1-CB 3.65Å; F259-C402 HydrophobicContact CD2-CB 3.82Å; F259-C402 HydrophobicContact CE1-CB 3.58Å; F259-C402 WeakPolarHBondContact CE1-O 3.39Å; F259-C402 HydrophobicContact CE2-CB 3.75Å; F259-C402 HydrophobicContact CG-CB 3.76Å; F259-C402 WeakPolarHBondContact CG-SG 3.48Å; F259-C402 HydrophobicContact CZ-CB 3.62Å; F259-C402 WeakPolarHBondContact CZ-O 3.24Å; F259-A406 HydrophobicContact CE1-CB 4.04Å; F259-A406 HydrophobicContact CZ-CB 4Å
260	L	97.9	Very high	97.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-56.7	-38.3	-177.8	-75	177.7	0	0	0	112.3	L256 F257 H262 F264 I268 L405 L409	L256-L260 WeakPolarHBondContact O-CB 3.45Å; L256-L260 VanDerWaalsContact O-CG 3.3Å; L256-L260 WeakPolarHBondContact O-CG 3.28Å; L256-L260 PolarHBondContact O-N 2.86Å; F257-L260 PolarHBondContact O-N 3.23Å; L260-H262 VanDerWaalsContact C-N 3.3Å; L260-H262 PolarHBondContact O-N 2.74Å; L260-F264 HydrophobicContact CD2-CD2 3.9Å; L260-F264 HydrophobicContact CD2-CE2 3.8Å; L260-F264 PolarHBondContact O-N 2.99Å; L260-F264 VanDerWaalsContact O-N 3.11Å; L260-I268 HydrophobicContact CB-CD1 3.89Å; L260-L405 HydrophobicContact CD1-CD2 4.05Å; L260-L405 HydrophobicContact CD2-CD2 4.12Å; L260-L405 HydrophobicContact CD2-CG 4.25Å; L260-L405 HydrophobicContact CG-CD2 4.25Å; L260-L409 HydrophobicContact CD2-CD1 3.59Å
261	K	96.8	Very high	97.1	Very high	122 Å²	122	59 Å²	59	53%	0.53	30%	0.298	S	S	.	.	H	α-helix	trans	-55.3	-43.9	178.2	-169.7	-169.5	173.3	-163	0	112.4	F257 F259 E265 I270	F257-K261 WeakPolarHBondContact O-CB 3.37Å; F257-K261 PolarHBondContact O-N 2.97Å; F259-K261 PolarHBondContact O-N 3.05Å; K261-E265 PolarHBondContact O-N 3.37Å; K261-I270 HydrophobicContact CB-CD1 3.71Å; K261-I270 HydrophobicContact CG-CD1 4.25Å
262	H	96.9	Very high	97	Very high	124 Å²	124	61 Å²	61	57%	0.574	30%	0.299	S	S	*	.	H	α-helix	trans	-85.8	-41.8	-178.6	-57.3	97.8	0	0	0	111.4	D258 F259 L260 F264 E265	D258-H262 PolarHBondContact O-ND1 2.89Å; F259-H262 PolarHBondContact O-N 2.88Å; F259-H262 VanDerWaalsContact O-N 3.11Å; L260-H262 VanDerWaalsContact C-N 3.3Å; L260-H262 PolarHBondContact O-N 2.74Å; H262-F264 PolarHBondContact O-N 3.16Å; H262-E265 PolarHBondContact O-N 2.91Å
263	R	97.2	Very high	96.9	Very high	100 Å²	100	57.9 Å²	57.9	38%	0.377	28%	0.284	S	S	.	.	H	α-helix	trans	-64.8	-23.1	-177.7	-179	58	178.8	73.5	3.6	114.1	F259 A406 E410	F259-R263 HydrophobicContact CD1-CB 4.44Å; F259-R263 HydrophobicContact CD2-CB 4.38Å; F259-R263 HydrophobicContact CE1-CB 4.02Å; F259-R263 HydrophobicContact CE1-CG 4.01Å; F259-R263 HydrophobicContact CE2-CB 3.95Å; F259-R263 HydrophobicContact CE2-CG 4.12Å; F259-R263 HydrophobicContact CZ-CB 3.76Å; F259-R263 HydrophobicContact CZ-CG 3.57Å; F259-R263 WeakPolarHBondContact O-CB 3.47Å; F259-R263 PolarHBondContact O-N 2.88Å; R263-A406 HydrophobicContact CG-CB 4.15Å; R263-E410 IonicContact NH1-OE2 2.78Å; R263-E410 PolarHBondContact NH1-OE2 2.86Å
264	F	97.4	Very high	96.5	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.009	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	26.5	179.1	-63.9	-84	0	0	0	113.1	L260 H262 G266 R267 I268 L322 A406 L409	L260-F264 HydrophobicContact CD2-CD2 3.9Å; L260-F264 HydrophobicContact CD2-CE2 3.8Å; L260-F264 PolarHBondContact O-N 2.99Å; L260-F264 VanDerWaalsContact O-N 3.11Å; H262-F264 PolarHBondContact O-N 3.16Å; F264-G266 PolarHBondContact O-N 2.88Å; F264-R267 CarbonylContact O-C 3.6Å; F264-R267 WeakPolarHBondContact O-CA 3.35Å; F264-R267 PolarHBondContact O-N 3.29Å; F264-I268 HydrophobicContact CB-CB 3.85Å; F264-I268 HydrophobicContact CB-CD1 4.15Å; F264-I268 HydrophobicContact CB-CG2 4.1Å; F264-I268 WeakPolarHBondContact O-CB 3.25Å; F264-I268 WeakPolarHBondContact O-CG2 3.49Å; F264-I268 PolarHBondContact O-N 3.04Å; F264-I268 VanDerWaalsContact O-N 3.12Å; F264-L322 HydrophobicContact CB-CD1 4.21Å; F264-L322 HydrophobicContact CD1-CD1 3.57Å; F264-L322 HydrophobicContact CE1-CD1 4.04Å; F264-L322 HydrophobicContact CG-CD1 3.86Å; F264-A406 HydrophobicContact CE2-CB 4.16Å; F264-A406 HydrophobicContact CZ-CB 4.13Å; F264-L409 HydrophobicContact CE1-CB 4.37Å; F264-L409 HydrophobicContact CE2-CB 4.32Å; F264-L409 HydrophobicContact CE2-CD1 4.33Å; F264-L409 HydrophobicContact CZ-CB 3.83Å
265	E	95.5	Very high	96.3	Very high	154 Å²	154	57 Å²	57	72%	0.72	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	138.5	178.1	-173.6	164.6	-151.7	0	0	112.1	K261 H262 R267	K261-E265 PolarHBondContact O-N 3.37Å; H262-E265 PolarHBondContact O-N 2.91Å; E265-R267 PolarHBondContact O-N 3.4Å
266	G	94	Very high	96	Very high	64 Å²	64	57.3 Å²	57.3	66%	0.66	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	-18.1	-172.8	0	0	0	0	0	115.9	F264 Q321	F264-G266 PolarHBondContact O-N 2.88Å; G266-Q321 PolarHBondContact O-NE2 3Å
267	R	96.6	Very high	95.8	Very high	63 Å²	63	57 Å²	57	24%	0.238	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-7.6	178.1	-61.6	-167.4	-68.6	158.4	-3.9	114.3	F264 E265 L322 E410 W413	F264-R267 CarbonylContact O-C 3.6Å; F264-R267 WeakPolarHBondContact O-CA 3.35Å; F264-R267 PolarHBondContact O-N 3.29Å; E265-R267 PolarHBondContact O-N 3.4Å; R267-L322 PolarHBondContact O-N 2.9Å; R267-E410 IonicContact CZ-OE1 3.35Å; R267-E410 IonicContact CZ-OE2 2.87Å; R267-E410 IonicContact NH1-OE1 3.61Å; R267-E410 PolarHBondContact NH1-OE1 2.89Å; R267-E410 IonicContact NH1-OE2 2.69Å; R267-E410 IonicContact NH2-OE1 3.72Å; R267-E410 PolarHBondContact NH2-OE1 3.23Å; R267-E410 IonicContact NH2-OE2 3.61Å; R267-E410 PolarHBondContact NH2-OE2 3.03Å; R267-W413 HydrophobicContact CB-CH2 3.92Å; R267-W413 HydrophobicContact CB-CZ2 4.42Å; R267-W413 HydrophobicContact CB-CZ3 4.04Å; R267-W413 HydrophobicContact CG-CH2 4.03Å; R267-W413 HydrophobicContact CG-CZ2 4.09Å; R267-W413 VanDerWaalsContact NH1-CD1 3.29Å
268	I	97	Very high	95.6	Very high	27 Å²	27	57.1 Å²	57.1	14%	0.138	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.8	-171.3	-162.7	171	0	0	0	113.2	L260 F264 I270 L322 V324	L260-I268 HydrophobicContact CB-CD1 3.89Å; F264-I268 HydrophobicContact CB-CB 3.85Å; F264-I268 HydrophobicContact CB-CD1 4.15Å; F264-I268 HydrophobicContact CB-CG2 4.1Å; F264-I268 WeakPolarHBondContact O-CB 3.25Å; F264-I268 WeakPolarHBondContact O-CG2 3.49Å; F264-I268 PolarHBondContact O-N 3.04Å; F264-I268 VanDerWaalsContact O-N 3.12Å; I268-I270 HydrophobicContact CD1-CD1 4.11Å; I268-I270 HydrophobicContact CD1-CG1 3.88Å; I268-I270 HydrophobicContact CG1-CG1 3.98Å; I268-L322 CarbonylContact C-O 3.59Å; I268-L322 WeakPolarHBondContact CA-O 3.22Å; I268-L322 HydrophobicContact CB-CB 4.38Å; I268-L322 HydrophobicContact CG1-CB 4.09Å; I268-V324 HydrophobicContact CD1-CG2 3.77Å; I268-V324 HydrophobicContact CG1-CG2 3.95Å
269	S	96.8	Very high	95.2	Very high	31 Å²	31	55.8 Å²	55.8	22%	0.217	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	104.7	168.4	-172.2	0	0	0	0	109	L322 V324	S269-L322 PolarHBondContact N-O 3.19Å; S269-V324 PolarHBondContact O-N 3.34Å
270	I	96.6	Very high	94.7	Very high	60 Å²	60	53.1 Å²	53.1	31%	0.308	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127	174.4	-50.7	-177	0	0	0	108.1	F257 K261 I268 V324	F257-I270 HydrophobicContact CD1-CG2 4.38Å; F257-I270 WeakPolarHBondContact O-CD1 3.38Å; K261-I270 HydrophobicContact CB-CD1 3.71Å; K261-I270 HydrophobicContact CG-CD1 4.25Å; I268-I270 HydrophobicContact CD1-CD1 4.11Å; I268-I270 HydrophobicContact CD1-CG1 3.88Å; I268-I270 HydrophobicContact CG1-CG1 3.98Å; I270-V324 WeakPolarHBondContact CA-O 3.45Å; I270-V324 HydrophobicContact CG1-CB 4.18Å; I270-V324 HydrophobicContact CG2-CB 4.45Å; I270-V324 HydrophobicContact CG2-CG1 4.45Å
271	T	96.4	Very high	94.2	Very high	26 Å²	26	57.2 Å²	57.2	16%	0.16	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.4	-179.9	-170.6	0	0	0	0	111.5	R312 L316 V324 L325 D326	T271-R312 PolarHBondContact OG1-NH1 2.78Å; T271-R312 PolarHBondContact OG1-NH2 3.13Å; T271-L316 HydrophobicContact CG2-CD1 3.97Å; T271-V324 PolarHBondContact N-O 3.28Å; T271-L325 HydrophobicContact CG2-CD2 3.57Å; T271-L325 WeakPolarHBondContact O-CA 3.49Å; T271-D326 PolarHBondContact O-N 3.35Å
272	R	95.8	Very high	93.5	Very high	147 Å²	147	54.1 Å²	54.1	56%	0.555	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	143	173	-169.6	172	169.8	-150.7	-1.8	110.2	R312 D326 D328	R272-R312 PolarHBondContact O-NH2 3.11Å; R272-D326 CarbonylContact C-O 3.5Å; R272-D326 VanDerWaalsContact CA-O 3.32Å; R272-D326 WeakPolarHBondContact CA-O 3.38Å; R272-D326 HydrophobicContact CB-CB 4.28Å; R272-D326 HydrophobicContact CG-CB 4.27Å; R272-D326 VanDerWaalsContact CG-O 3.32Å; R272-D326 WeakPolarHBondContact CG-O 3.45Å; R272-D328 IonicContact CZ-OD1 2.71Å; R272-D328 IonicContact CZ-OD2 3.43Å; R272-D328 IonicContact NE-OD1 3.3Å; R272-D328 PolarHBondContact NE-OD1 3.25Å; R272-D328 IonicContact NE-OD2 3.54Å; R272-D328 IonicContact NH2-OD1 3.17Å; R272-D328 PolarHBondContact NH2-OD1 3.49Å; R272-D328 IonicContact NH2-OD2 3.07Å; R272-D328 PolarHBondContact NH2-OD2 3.4Å
273	V	95.3	Very high	92.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	104.5	-178.1	179.3	0	0	0	0	108.2	I277 L325 D326 A327 D328	V273-I277 HydrophobicContact CG1-CD1 4.28Å; V273-I277 HydrophobicContact CG1-CG1 4.28Å; V273-I277 HydrophobicContact CG1-CG2 3.73Å; V273-L325 HydrophobicContact CG2-CB 4.24Å; V273-L325 HydrophobicContact CG2-CD2 4.07Å; V273-D326 PolarHBondContact N-O 3.28Å; V273-A327 HydrophobicContact CB-CB 4.22Å; V273-D328 PolarHBondContact O-N 2.82Å
274	T	89.5	Confident	91.5	Very high	93 Å²	93	46.6 Å²	46.6	57%	0.571	25%	0.247	S	C	*	.			trans	-91	-18.4	-179.2	52.5	0	0	0	0	113.2
275	A	92.1	Very high	90.4	Very high	5 Å²	5	48 Å²	48	4%	0.041	25%	0.254	C	S	.	.	S	Bend	trans	-77.5	145.2	175.5	0	0	0	0	0	111.5	I277 S301 E305 V306 E309	A275-I277 VanDerWaalsContact C-N 3.32Å; A275-I277 PolarHBondContact O-N 3.21Å; A275-S301 WeakPolarHBondContact CA-OG 3.38Å; A275-E305 HydrophobicContact CB-CB 4.41Å; A275-V306 HydrophobicContact CB-CG2 4.2Å; A275-E309 HydrophobicContact CB-CG 3.97Å
276	D	92.5	Very high	89.5	Confident	38 Å²	38	46 Å²	46	20%	0.203	25%	0.249	C	C	.	.			trans	-76.2	81.1	179	-169.8	10.9	0	0	0	112.6	S278 L279 S301 T329	D276-S278 PolarHBondContact O-N 3.45Å; D276-S278 VanDerWaalsContact OD1-CB 3.31Å; D276-S278 WeakPolarHBondContact OD1-CB 3.4Å; D276-S278 PolarHBondContact OD1-N 3.38Å; D276-S278 PolarHBondContact OD1-OG 3.2Å; D276-S278 PolarHBondContact OD2-OG 3.41Å; D276-S278 VanDerWaalsContact OD2-OG 3.13Å; D276-L279 HydrophobicContact CB-CD1 4.25Å; D276-L279 HydrophobicContact CB-CG 4.28Å; D276-L279 WeakPolarHBondContact O-CB 3.48Å; D276-L279 WeakPolarHBondContact O-CG 3.39Å; D276-L279 PolarHBondContact O-N 2.97Å; D276-S301 PolarHBondContact N-OG 2.99Å; D276-S301 VanDerWaalsContact N-OG 3.13Å; D276-T329 HydrophobicContact CB-CG2 4.07Å; D276-T329 PolarHBondContact OD1-OG1 3.3Å
277	I	93.9	Very high	88.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-60.7	-7.2	176.5	54.3	164.3	0	0	0	114.3	V273 A275 L279 A280 E309 I310 L325 A327 I330 L336 L341	V273-I277 HydrophobicContact CG1-CD1 4.28Å; V273-I277 HydrophobicContact CG1-CG1 4.28Å; V273-I277 HydrophobicContact CG1-CG2 3.73Å; A275-I277 VanDerWaalsContact C-N 3.32Å; A275-I277 PolarHBondContact O-N 3.21Å; I277-L279 PolarHBondContact O-N 3.31Å; I277-A280 WeakPolarHBondContact O-CB 3.48Å; I277-A280 PolarHBondContact O-N 2.72Å; I277-E309 HydrophobicContact CG2-CB 4.29Å; I277-I310 HydrophobicContact CB-CD1 4.45Å; I277-I310 HydrophobicContact CG2-CD1 4.27Å; I277-L325 HydrophobicContact CD1-CD1 4.29Å; I277-A327 HydrophobicContact CD1-CB 4.33Å; I277-I330 HydrophobicContact CD1-CG1 4.38Å; I277-I330 HydrophobicContact CG1-CD1 4.18Å; I277-I330 HydrophobicContact CG1-CG1 4.2Å; I277-L336 HydrophobicContact CD1-CD2 4.04Å; I277-L336 HydrophobicContact CG1-CD2 4.06Å; I277-L341 HydrophobicContact CD1-CD1 3.9Å
278	S	93.2	Very high	87.1	Confident	18 Å²	18	45.9 Å²	45.9	13%	0.126	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-69	-15	168.4	79.8	0	0	0	0	113.4	D276 A280	D276-S278 PolarHBondContact O-N 3.45Å; D276-S278 VanDerWaalsContact OD1-CB 3.31Å; D276-S278 WeakPolarHBondContact OD1-CB 3.4Å; D276-S278 PolarHBondContact OD1-N 3.38Å; D276-S278 PolarHBondContact OD1-OG 3.2Å; D276-S278 PolarHBondContact OD2-OG 3.41Å; D276-S278 VanDerWaalsContact OD2-OG 3.13Å; S278-A280 VanDerWaalsContact C-N 3.33Å
279	L	90.2	Very high	85.7	Confident	40 Å²	40	49.7 Å²	49.7	21%	0.209	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-77.4	-15.9	172.7	-58.3	179.1	0	0	0	113	D276 I277 K281 T299 V306	D276-L279 HydrophobicContact CB-CD1 4.25Å; D276-L279 HydrophobicContact CB-CG 4.28Å; D276-L279 WeakPolarHBondContact O-CB 3.48Å; D276-L279 WeakPolarHBondContact O-CG 3.39Å; D276-L279 PolarHBondContact O-N 2.97Å; I277-L279 PolarHBondContact O-N 3.31Å; L279-K281 PolarHBondContact O-N 2.93Å; L279-T299 HydrophobicContact CD1-CG2 3.94Å; L279-T299 HydrophobicContact CD2-CG2 4.38Å; L279-V306 HydrophobicContact CB-CG1 4.4Å; L279-V306 HydrophobicContact CB-CG2 4.44Å; L279-V306 HydrophobicContact CD1-CG2 4.48Å
280	A	87.9	Confident	84.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	29%	0.292	C	S	.	.			trans	-71.5	45.7	-177.4	0	0	0	0	0	114.6	I277 S278 L285 V306 I310 T339	I277-A280 WeakPolarHBondContact O-CB 3.48Å; I277-A280 PolarHBondContact O-N 2.72Å; S278-A280 VanDerWaalsContact C-N 3.33Å; A280-L285 HydrophobicContact CB-CD1 3.85Å; A280-V306 HydrophobicContact CB-CG1 3.85Å; A280-I310 HydrophobicContact CB-CD1 3.57Å; A280-I310 HydrophobicContact CB-CG1 3.67Å; A280-T339 HydrophobicContact CB-CG2 4.06Å; A280-T339 VanDerWaalsContact O-CA 3.28Å; A280-T339 WeakPolarHBondContact O-CA 3.34Å; A280-T339 WeakPolarHBondContact O-CB 3.34Å
281	K	87.6	Confident	82.4	Confident	87 Å²	87	56.2 Å²	56.2	38%	0.378	29%	0.294	S	S	.	.			trans	-70.3	134.7	-174.8	-65.8	160.1	-171.1	159	0	110.5	L279 S283 V284 L285 K338	L279-K281 PolarHBondContact O-N 2.93Å; K281-S283 VanDerWaalsContact C-N 3.29Å; K281-S283 PolarHBondContact O-N 3.4Å; K281-S283 VanDerWaalsContact O-N 3.16Å; K281-V284 HydrophobicContact CB-CB 4.36Å; K281-V284 HydrophobicContact CB-CG2 3.95Å; K281-V284 WeakPolarHBondContact O-CA 3.5Å; K281-V284 WeakPolarHBondContact O-CB 3.43Å; K281-V284 PolarHBondContact O-N 2.89Å; K281-L285 PolarHBondContact O-N 3.12Å; K281-K338 CarbonylContact C-O 3.59Å; K281-K338 VanDerWaalsContact CA-O 3.3Å; K281-K338 WeakPolarHBondContact CA-O 3.45Å; K281-K338 HydrophobicContact CG-CB 4.24Å
282	R	82	Confident	80.6	Confident	57 Å²	57	58.6 Å²	58.6	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-53.3	-41.2	-172.7	-60.4	-159.9	-68.9	-74	5.4	113.8	R72 D228 N286 S337 K338 T339 S340	R72-R282 VanDerWaalsContact NH2-CZ 3.34Å; D228-R282 VanDerWaalsContact OD1-CD 3.32Å; D228-R282 WeakPolarHBondContact OD1-CD 3.2Å; D228-R282 IonicContact OD1-CZ 3.81Å; D228-R282 IonicContact OD1-NE 3.7Å; D228-R282 PolarHBondContact OD1-NE 2.86Å; D228-R282 IonicContact OD2-CZ 3.45Å; D228-R282 VanDerWaalsContact OD2-CZ 3.3Å; D228-R282 IonicContact OD2-NE 3.38Å; D228-R282 PolarHBondContact OD2-NE 3.29Å; D228-R282 IonicContact OD2-NH2 2.7Å; D228-R282 PolarHBondContact OD2-NH2 3.45Å; D228-R282 VanDerWaalsContact OD2-NH2 3.17Å; R282-N286 VanDerWaalsContact O-CB 3.23Å; R282-N286 WeakPolarHBondContact O-CB 3.39Å; R282-N286 PolarHBondContact O-N 3.48Å; R282-N286 PolarHBondContact O-ND2 2.9Å; R282-N286 PolarHBondContact O-OD1 2.92Å; R282-S337 PolarHBondContact NH1-O 3.26Å; R282-S337 VanDerWaalsContact NH1-O 3.13Å; R282-K338 WeakPolarHBondContact CG-O 3.38Å; R282-K338 PolarHBondContact N-O 3.46Å; R282-T339 WeakPolarHBondContact CD-O 3.23Å; R282-T339 VanDerWaalsContact CG-C 3.48Å; R282-T339 WeakPolarHBondContact CG-O 3.3Å; R282-T339 PolarHBondContact NH1-O 3.15Å; R282-S340 WeakPolarHBondContact CD-OG 3.45Å; R282-S340 WeakPolarHBondContact CG-OG 3.37Å
283	S	75.2	Confident	78.8	Confident	44 Å²	44	56.6 Å²	56.6	31%	0.308	32%	0.315	S	S	.	.	H	α-helix	trans	-66.5	-36.1	176.6	48.1	0	0	0	0	113.7	K281 N287 H291	K281-S283 VanDerWaalsContact C-N 3.29Å; K281-S283 PolarHBondContact O-N 3.4Å; K281-S283 VanDerWaalsContact O-N 3.16Å; S283-N287 PolarHBondContact O-N 2.98Å; S283-H291 PolarHBondContact O-CD2 2.74Å; S283-H291 VanDerWaalsContact O-CD2 3.27Å
284	V	75.4	Confident	77	Confident	21 Å²	21	65.1 Å²	65.1	13%	0.127	36%	0.359	C	S	.	.	H	α-helix	trans	-71.6	-48.9	178.9	-177.9	0	0	0	0	110.5	K281 N287 P288 H291 L303	K281-V284 HydrophobicContact CB-CB 4.36Å; K281-V284 HydrophobicContact CB-CG2 3.95Å; K281-V284 WeakPolarHBondContact O-CA 3.5Å; K281-V284 WeakPolarHBondContact O-CB 3.43Å; K281-V284 PolarHBondContact O-N 2.89Å; V284-N287 CarbonylContact O-C 3.54Å; V284-N287 PolarHBondContact O-N 3.46Å; V284-P288 VanDerWaalsContact O-CA 3.3Å; V284-P288 WeakPolarHBondContact O-CA 3.43Å; V284-P288 VanDerWaalsContact O-N 3.09Å; V284-H291 HydrophobicContact CB-CB 4.24Å; V284-H291 HydrophobicContact CG1-CB 3.99Å; V284-H291 HydrophobicContact CG2-CB 4Å; V284-L303 HydrophobicContact CG1-CD1 3.83Å
285	L	74.8	Confident	75.1	Confident	31 Å²	31	67.2 Å²	67.2	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-68.8	-36.2	-179.1	-59	-167.9	0	0	0	112.5	A280 K281 N287 P288 I310	A280-L285 HydrophobicContact CB-CD1 3.85Å; K281-L285 PolarHBondContact O-N 3.12Å; L285-N287 VanDerWaalsContact C-N 3.29Å; L285-N287 PolarHBondContact O-N 2.87Å; L285-P288 WeakPolarHBondContact O-CD 3.18Å; L285-I310 HydrophobicContact CD1-CG1 4.43Å; L285-I310 HydrophobicContact CD1-CG2 4.49Å
286	N	77.5	Confident	72.9	Confident	113 Å²	113	79.3 Å²	79.3	60%	0.604	41%	0.407	S	S	*	.	H	α-helix	trans	-71.9	-20.2	177.1	-69.5	-2.5	0	0	0	113.3	R282	R282-N286 VanDerWaalsContact O-CB 3.23Å; R282-N286 WeakPolarHBondContact O-CB 3.39Å; R282-N286 PolarHBondContact O-N 3.48Å; R282-N286 PolarHBondContact O-ND2 2.9Å; R282-N286 PolarHBondContact O-OD1 2.92Å
287	N	73	Confident	71.2	Confident	60 Å²	60	80.8 Å²	80.8	32%	0.321	42%	0.42	S	S	.	.			trans	-145.5	69.3	178	-73.9	-101.7	0	0	0	112.1	S283 V284 L285 S289 K290 H291	S283-N287 PolarHBondContact O-N 2.98Å; V284-N287 CarbonylContact O-C 3.54Å; V284-N287 PolarHBondContact O-N 3.46Å; L285-N287 VanDerWaalsContact C-N 3.29Å; L285-N287 PolarHBondContact O-N 2.87Å; N287-S289 VanDerWaalsContact C-N 3.28Å; N287-S289 PolarHBondContact O-N 2.99Å; N287-K290 HydrophobicContact CB-CB 4.16Å; N287-K290 HydrophobicContact CB-CD 4.02Å; N287-K290 HydrophobicContact CB-CG 4.27Å; N287-K290 PolarHBondContact O-N 3.21Å; N287-K290 WeakPolarHBondContact OD1-CE 3.23Å; N287-K290 PolarHBondContact OD1-NZ 3.31Å; N287-H291 PolarHBondContact O-N 3.1Å
288	P	67.4	Low	69.3	Low	64 Å²	64	88.7 Å²	88.7	42%	0.416	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-59	-39	-173.5	-25.6	36.1	0	0	0	112.9	V284 L285 K290 H291 A292 L303	V284-P288 VanDerWaalsContact O-CA 3.3Å; V284-P288 WeakPolarHBondContact O-CA 3.43Å; V284-P288 VanDerWaalsContact O-N 3.09Å; L285-P288 WeakPolarHBondContact O-CD 3.18Å; P288-K290 VanDerWaalsContact C-N 3.26Å; P288-K290 PolarHBondContact O-N 3.32Å; P288-H291 CarbonylContact O-C 3.55Å; P288-H291 PolarHBondContact O-N 3.45Å; P288-H291 VanDerWaalsContact O-N 3.12Å; P288-A292 PolarHBondContact O-N 2.98Å; P288-A292 VanDerWaalsContact O-N 3.07Å; P288-L303 HydrophobicContact CB-CD2 4.28Å
289	S	66.7	Low	67.9	Low	108 Å²	108	91.4 Å²	91.4	76%	0.755	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-65.4	-20.8	179.2	55.5	0	0	0	0	115	N287	N287-S289 VanDerWaalsContact C-N 3.28Å; N287-S289 PolarHBondContact O-N 2.99Å
290	K	63.3	Low	66.9	Low	152 Å²	152	101.2 Å²	101.2	66%	0.661	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-91.9	-14.5	175.6	-63.4	177.9	-172.6	151.6	0	112.9	N287 P288	N287-K290 HydrophobicContact CB-CB 4.16Å; N287-K290 HydrophobicContact CB-CD 4.02Å; N287-K290 HydrophobicContact CB-CG 4.27Å; N287-K290 PolarHBondContact O-N 3.21Å; N287-K290 WeakPolarHBondContact OD1-CE 3.23Å; N287-K290 PolarHBondContact OD1-NZ 3.31Å; P288-K290 VanDerWaalsContact C-N 3.26Å; P288-K290 PolarHBondContact O-N 3.32Å
291	H	60.6	Low	66.6	Low	75 Å²	75	101.8 Å²	101.8	35%	0.347	52%	0.516	S	S	.	.			trans	-120.5	23.8	-178.3	-66.4	-65.6	0	0	0	112.5	S283 V284 N287 P288 I293	S283-H291 PolarHBondContact O-CD2 2.74Å; S283-H291 VanDerWaalsContact O-CD2 3.27Å; V284-H291 HydrophobicContact CB-CB 4.24Å; V284-H291 HydrophobicContact CG1-CB 3.99Å; V284-H291 HydrophobicContact CG2-CB 4Å; N287-H291 PolarHBondContact O-N 3.1Å; P288-H291 CarbonylContact O-C 3.55Å; P288-H291 PolarHBondContact O-N 3.45Å; P288-H291 VanDerWaalsContact O-N 3.12Å; H291-I293 PolarHBondContact O-N 2.82Å
292	A	58.4	Low	66.6	Low	76 Å²	76	100 Å²	100	63%	0.628	52%	0.515	S	S	*	.			trans	-68.9	68.4	163	0	0	0	0	0	110.1	P288 I294	P288-A292 PolarHBondContact O-N 2.98Å; P288-A292 VanDerWaalsContact O-N 3.07Å; A292-I294 PolarHBondContact O-N 3.19Å
293	I	57.8	Low	66.8	Low	106 Å²	106	101 Å²	101	54%	0.544	52%	0.524	S	S	.	.			trans	-72.8	111.4	-178.2	-64.4	174.6	0	0	0	108.5	H291 E295	H291-I293 PolarHBondContact O-N 2.82Å; I293-E295 HydrophobicContact CG2-CB 3.74Å; I293-E295 HydrophobicContact CG2-CG 3.45Å; I293-E295 VanDerWaalsContact CG2-CG 3.45Å; I293-E295 PolarHBondContact O-N 3.4Å
294	I	57.3	Low	67.4	Low	178 Å²	178	102.3 Å²	102.3	91%	0.913	54%	0.537	S	S	*	.			trans	-79.1	59	174.1	-46	178.7	0	0	0	109.5	A292	A292-I294 PolarHBondContact O-N 3.19Å
295	E	49.8	Very low	68.2	Low	138 Å²	138	105.7 Å²	105.7	65%	0.645	55%	0.552	S	S	*	*			trans	-99.6	141.6	168.9	-79.4	175.3	167.8	0	0	109.6	I293 S297	I293-E295 HydrophobicContact CG2-CB 3.74Å; I293-E295 HydrophobicContact CG2-CG 3.45Å; I293-E295 VanDerWaalsContact CG2-CG 3.45Å; I293-E295 PolarHBondContact O-N 3.4Å; E295-S297 PolarHBondContact O-N 3.19Å
296	R	47.2	Very low	69	Low	259 Å²	259	104.2 Å²	104.2	98%	0.977	54%	0.544	S	S	*	.			trans	-76.9	56	175.4	-63.2	-175.8	179.7	95	-2.8	110.9
297	S	55.2	Low	69.6	Low	69 Å²	69	101.8 Å²	101.8	48%	0.483	53%	0.529	S	S	.	.			trans	-71.8	125.7	176.2	-66.8	0	0	0	0	109.6	E295 T299	E295-S297 PolarHBondContact O-N 3.19Å; S297-T299 PolarHBondContact O-N 2.71Å; S297-T299 PolarHBondContact O-OG1 2.94Å
298	N	55.7	Low	70.6	Confident	166 Å²	166	102.3 Å²	102.3	89%	0.888	54%	0.537	S	S	*	.			trans	-80.3	50.4	176.3	-163.2	13.5	0	0	0	111.2
299	T	63.8	Low	72	Confident	74 Å²	74	100.7 Å²	100.7	45%	0.454	53%	0.525	S	S	.	.			trans	-78.6	124.6	179.9	39.9	0	0	0	0	110.1	L279 S297 S301	L279-T299 HydrophobicContact CD1-CG2 3.94Å; L279-T299 HydrophobicContact CD2-CG2 4.38Å; S297-T299 PolarHBondContact O-N 2.71Å; S297-T299 PolarHBondContact O-OG1 2.94Å; T299-S301 PolarHBondContact O-N 3.1Å
300	R	68.8	Low	73.3	Confident	247 Å²	247	96.1 Å²	96.1	93%	0.932	49%	0.491	S	S	*	.	S	Bend	trans	-69.1	-10.7	-179.1	-83.8	-176.8	161.5	-163.9	-6.1	115.3
301	S	80.5	Confident	74.8	Confident	12 Å²	12	94.2 Å²	94.2	8%	0.084	49%	0.485	C	S	.	.	S	Bend	trans	-128.6	139.7	-174	-47.4	0	0	0	0	110.7	A275 D276 T299 E305	A275-S301 WeakPolarHBondContact CA-OG 3.38Å; D276-S301 PolarHBondContact N-OG 2.99Å; D276-S301 VanDerWaalsContact N-OG 3.13Å; T299-S301 PolarHBondContact O-N 3.1Å; S301-E305 WeakPolarHBondContact CA-OE2 3.41Å
302	S	87.4	Confident	76.5	Confident	49 Å²	49	94.2 Å²	94.2	34%	0.343	48%	0.482	S	S	.	.			trans	-74.6	158.5	170.3	74.3	0	0	0	0	111.6	A304 E305 V306	S302-A304 PolarHBondContact O-N 2.74Å; S302-A304 PolarHBondContact OG-N 3.28Å; S302-E305 WeakPolarHBondContact CB-OE1 3.35Å; S302-E305 VanDerWaalsContact N-CD 3.31Å; S302-E305 PolarHBondContact N-OE1 2.94Å; S302-E305 VanDerWaalsContact N-OE1 3.16Å; S302-E305 PolarHBondContact N-OE2 3.25Å; S302-E305 VanDerWaalsContact N-OE2 3.08Å; S302-E305 PolarHBondContact O-N 3.08Å; S302-E305 WeakPolarHBondContact OG-CG 3.19Å; S302-E305 PolarHBondContact OG-N 3.41Å; S302-E305 PolarHBondContact OG-OE1 2.85Å; S302-V306 WeakPolarHBondContact O-CG2 3.49Å; S302-V306 PolarHBondContact O-N 2.77Å; S302-V306 VanDerWaalsContact O-N 3.12Å
303	L	86.6	Confident	78.3	Confident	78 Å²	78	90.6 Å²	90.6	41%	0.408	45%	0.452	S	S	.	.	H	α-helix	trans	-60.6	-29.3	173.3	-163.6	85.7	0	0	0	111.6	V284 P288 Q307	V284-L303 HydrophobicContact CG1-CD1 3.83Å; P288-L303 HydrophobicContact CB-CD2 4.28Å; L303-Q307 WeakPolarHBondContact O-CB 3.28Å; L303-Q307 PolarHBondContact O-N 2.89Å
304	A	88.6	Confident	80.2	Confident	72 Å²	72	88.4 Å²	88.4	60%	0.595	44%	0.439	S	S	*	.	H	α-helix	trans	-71.4	-42.7	179.2	0	0	0	0	0	112.1	S302 Q307 S308	S302-A304 PolarHBondContact O-N 2.74Å; S302-A304 PolarHBondContact OG-N 3.28Å; A304-Q307 PolarHBondContact O-N 3.24Å; A304-S308 WeakPolarHBondContact O-CB 3.41Å; A304-S308 PolarHBondContact O-N 2.93Å
305	E	91	Very high	82	Confident	93 Å²	93	84.7 Å²	84.7	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-59.5	-47.1	170.9	-70.2	142.7	-122.8	0	0	111.1	A275 S301 S302 Q307 S308 E309	A275-E305 HydrophobicContact CB-CB 4.41Å; S301-E305 WeakPolarHBondContact CA-OE2 3.41Å; S302-E305 WeakPolarHBondContact CB-OE1 3.35Å; S302-E305 VanDerWaalsContact N-CD 3.31Å; S302-E305 PolarHBondContact N-OE1 2.94Å; S302-E305 VanDerWaalsContact N-OE1 3.16Å; S302-E305 PolarHBondContact N-OE2 3.25Å; S302-E305 VanDerWaalsContact N-OE2 3.08Å; S302-E305 PolarHBondContact O-N 3.08Å; S302-E305 WeakPolarHBondContact OG-CG 3.19Å; S302-E305 PolarHBondContact OG-N 3.41Å; S302-E305 PolarHBondContact OG-OE1 2.85Å; E305-Q307 PolarHBondContact O-N 3.12Å; E305-S308 PolarHBondContact O-N 3.28Å; E305-E309 WeakPolarHBondContact O-CG 3.33Å; E305-E309 PolarHBondContact O-N 3.28Å
306	V	92.2	Very high	84.2	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-61.5	-43.5	179.1	172	0	0	0	0	111	A275 L279 A280 S302 E309 I310	A275-V306 HydrophobicContact CB-CG2 4.2Å; L279-V306 HydrophobicContact CB-CG1 4.4Å; L279-V306 HydrophobicContact CB-CG2 4.44Å; L279-V306 HydrophobicContact CD1-CG2 4.48Å; A280-V306 HydrophobicContact CB-CG1 3.85Å; S302-V306 WeakPolarHBondContact O-CG2 3.49Å; S302-V306 PolarHBondContact O-N 2.77Å; S302-V306 VanDerWaalsContact O-N 3.12Å; V306-E309 PolarHBondContact O-N 2.97Å; V306-I310 VanDerWaalsContact O-CG1 3.24Å; V306-I310 WeakPolarHBondContact O-CG1 3.46Å; V306-I310 PolarHBondContact O-N 3.1Å
307	Q	91.3	Very high	86.6	Confident	62 Å²	62	67.9 Å²	67.9	29%	0.29	35%	0.351	S	S	.	.	H	α-helix	trans	-63.1	-44.8	176.1	179.9	61.9	19.8	0	0	112	L303 A304 E305 E309 I310 E311	L303-Q307 WeakPolarHBondContact O-CB 3.28Å; L303-Q307 PolarHBondContact O-N 2.89Å; A304-Q307 PolarHBondContact O-N 3.24Å; E305-Q307 PolarHBondContact O-N 3.12Å; Q307-E309 PolarHBondContact O-N 3.32Å; Q307-I310 PolarHBondContact O-N 3.05Å; Q307-E311 WeakPolarHBondContact CG-OE1 3.27Å; Q307-E311 PolarHBondContact NE2-OE1 2.91Å; Q307-E311 WeakPolarHBondContact O-CG 3.48Å; Q307-E311 PolarHBondContact O-N 3.22Å
308	S	93.6	Very high	88.4	Confident	70 Å²	70	71 Å²	71	49%	0.49	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-42.4	177.9	-173.3	0	0	0	0	112	A304 E305 I310 E311 R312	A304-S308 WeakPolarHBondContact O-CB 3.41Å; A304-S308 PolarHBondContact O-N 2.93Å; E305-S308 PolarHBondContact O-N 3.28Å; S308-I310 PolarHBondContact O-N 2.74Å; S308-E311 PolarHBondContact O-N 2.74Å; S308-R312 VanDerWaalsContact O-CB 3.31Å; S308-R312 WeakPolarHBondContact O-CB 3.19Å; S308-R312 PolarHBondContact O-N 2.69Å
309	E	95.3	Very high	90.2	Very high	31 Å²	31	66.4 Å²	66.4	15%	0.145	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-38.7	174.5	-74.6	-68.6	92	0	0	112.3	A275 I277 E305 V306 Q307 R312 I313	A275-E309 HydrophobicContact CB-CG 3.97Å; I277-E309 HydrophobicContact CG2-CB 4.29Å; E305-E309 WeakPolarHBondContact O-CG 3.33Å; E305-E309 PolarHBondContact O-N 3.28Å; V306-E309 PolarHBondContact O-N 2.97Å; Q307-E309 PolarHBondContact O-N 3.32Å; E309-R312 VanDerWaalsContact CD-NH2 3.33Å; E309-R312 PolarHBondContact O-N 2.65Å; E309-R312 IonicContact OE1-CZ 3.55Å; E309-R312 IonicContact OE1-NE 3.75Å; E309-R312 PolarHBondContact OE1-NE 3.16Å; E309-R312 IonicContact OE1-NH2 3.64Å; E309-R312 PolarHBondContact OE1-NH2 2.97Å; E309-R312 IonicContact OE2-CZ 3.43Å; E309-R312 IonicContact OE2-NE 2.7Å; E309-R312 IonicContact OE2-NH2 2.74Å; E309-R312 PolarHBondContact OE2-NH2 3.1Å; E309-I313 WeakPolarHBondContact O-CD1 3.31Å; E309-I313 WeakPolarHBondContact O-CG1 3.3Å; E309-I313 PolarHBondContact O-N 3.3Å
310	I	94.6	Very high	91.7	Very high	11 Å²	11	64.2 Å²	64.2	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-48.5	174.2	-65.5	-67.5	0	0	0	110.8	I277 A280 L285 V306 Q307 S308 R312 I313 F314 L341	I277-I310 HydrophobicContact CB-CD1 4.45Å; I277-I310 HydrophobicContact CG2-CD1 4.27Å; A280-I310 HydrophobicContact CB-CD1 3.57Å; A280-I310 HydrophobicContact CB-CG1 3.67Å; L285-I310 HydrophobicContact CD1-CG1 4.43Å; L285-I310 HydrophobicContact CD1-CG2 4.49Å; V306-I310 VanDerWaalsContact O-CG1 3.24Å; V306-I310 WeakPolarHBondContact O-CG1 3.46Å; V306-I310 PolarHBondContact O-N 3.1Å; Q307-I310 PolarHBondContact O-N 3.05Å; S308-I310 PolarHBondContact O-N 2.74Å; I310-R312 VanDerWaalsContact C-N 3.3Å; I310-R312 PolarHBondContact O-N 3.5Å; I310-I313 PolarHBondContact O-N 3.16Å; I310-I313 VanDerWaalsContact O-N 3.15Å; I310-F314 HydrophobicContact CG2-CD2 3.9Å; I310-F314 HydrophobicContact CG2-CE2 3.94Å; I310-F314 WeakPolarHBondContact O-CD2 3.44Å; I310-F314 PolarHBondContact O-N 3.11Å; I310-L341 HydrophobicContact CD1-CD1 3.66Å; I310-L341 HydrophobicContact CD1-CD2 3.63Å; I310-L341 HydrophobicContact CD1-CG 3.62Å; I310-L341 HydrophobicContact CG2-CD2 4.5Å
311	E	94.9	Very high	93	Very high	113 Å²	113	55.9 Å²	55.9	53%	0.528	29%	0.287	S	S	.	.	H	α-helix	trans	-59.4	-41.5	177.8	-72.8	173.8	-169.9	0	0	111.7	Q307 S308 I313 F314 E315	Q307-E311 WeakPolarHBondContact CG-OE1 3.27Å; Q307-E311 PolarHBondContact NE2-OE1 2.91Å; Q307-E311 WeakPolarHBondContact O-CG 3.48Å; Q307-E311 PolarHBondContact O-N 3.22Å; S308-E311 PolarHBondContact O-N 2.74Å; E311-I313 PolarHBondContact O-N 2.84Å; E311-F314 PolarHBondContact O-N 2.82Å; E311-E315 PolarHBondContact O-N 2.9Å
312	R	96.3	Very high	93.9	Very high	75 Å²	75	55.4 Å²	55.4	28%	0.283	28%	0.284	S	S	.	.	H	α-helix	trans	-62	-40.4	174.4	-170.2	178.6	67.7	81.6	-9.6	112.8	T271 R272 S308 E309 I310 E315 L316	T271-R312 PolarHBondContact OG1-NH1 2.78Å; T271-R312 PolarHBondContact OG1-NH2 3.13Å; R272-R312 PolarHBondContact O-NH2 3.11Å; S308-R312 VanDerWaalsContact O-CB 3.31Å; S308-R312 WeakPolarHBondContact O-CB 3.19Å; S308-R312 PolarHBondContact O-N 2.69Å; E309-R312 VanDerWaalsContact CD-NH2 3.33Å; E309-R312 PolarHBondContact O-N 2.65Å; E309-R312 IonicContact OE1-CZ 3.55Å; E309-R312 IonicContact OE1-NE 3.75Å; E309-R312 PolarHBondContact OE1-NE 3.16Å; E309-R312 IonicContact OE1-NH2 3.64Å; E309-R312 PolarHBondContact OE1-NH2 2.97Å; E309-R312 IonicContact OE2-CZ 3.43Å; E309-R312 IonicContact OE2-NE 2.7Å; E309-R312 IonicContact OE2-NH2 2.74Å; E309-R312 PolarHBondContact OE2-NH2 3.1Å; I310-R312 VanDerWaalsContact C-N 3.3Å; I310-R312 PolarHBondContact O-N 3.5Å; R312-E315 PolarHBondContact O-N 3.06Å; R312-L316 WeakPolarHBondContact O-CG 3.4Å; R312-L316 PolarHBondContact O-N 2.95Å
313	I	96.9	Very high	94.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.3	-40.1	175.6	-67.1	159.6	0	0	0	111	P231 P235 E309 I310 E311 A317 L325 L341	P231-I313 HydrophobicContact CG-CG2 4.49Å; P235-I313 HydrophobicContact CB-CG2 4.16Å; P235-I313 HydrophobicContact CG-CG2 4.07Å; E309-I313 WeakPolarHBondContact O-CD1 3.31Å; E309-I313 WeakPolarHBondContact O-CG1 3.3Å; E309-I313 PolarHBondContact O-N 3.3Å; I310-I313 PolarHBondContact O-N 3.16Å; I310-I313 VanDerWaalsContact O-N 3.15Å; E311-I313 PolarHBondContact O-N 2.84Å; I313-A317 WeakPolarHBondContact O-CB 3.44Å; I313-A317 PolarHBondContact O-N 3.13Å; I313-A317 VanDerWaalsContact O-N 3.11Å; I313-L325 HydrophobicContact CD1-CD1 3.71Å; I313-L325 HydrophobicContact CD1-CD2 4.16Å; I313-L325 HydrophobicContact CG1-CD1 4.26Å; I313-L325 HydrophobicContact CG1-CD2 3.91Å; I313-L341 HydrophobicContact CB-CD2 4.24Å; I313-L341 HydrophobicContact CD1-CD1 4.27Å; I313-L341 HydrophobicContact CD1-CD2 4.26Å; I313-L341 HydrophobicContact CG2-CD2 3.76Å
314	F	96.6	Very high	94.9	Very high	60 Å²	60	49.4 Å²	49.4	26%	0.263	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-42	175.1	-94	-98.3	0	0	0	112.3	V229 V230 P231 I310 E311 A317 R318 L341	V229-F314 HydrophobicContact CG1-CE1 4.22Å; V230-F314 WeakPolarHBondContact O-CE1 3.48Å; P231-F314 HydrophobicContact CG-CD1 4.28Å; P231-F314 HydrophobicContact CG-CD2 3.87Å; P231-F314 HydrophobicContact CG-CE1 4.17Å; P231-F314 HydrophobicContact CG-CE2 3.75Å; P231-F314 HydrophobicContact CG-CG 4.15Å; P231-F314 HydrophobicContact CG-CZ 3.92Å; I310-F314 HydrophobicContact CG2-CD2 3.9Å; I310-F314 HydrophobicContact CG2-CE2 3.94Å; I310-F314 WeakPolarHBondContact O-CD2 3.44Å; I310-F314 PolarHBondContact O-N 3.11Å; E311-F314 PolarHBondContact O-N 2.82Å; F314-A317 PolarHBondContact O-N 2.78Å; F314-R318 PolarHBondContact O-N 2.78Å; F314-L341 HydrophobicContact CE2-CD2 4.42Å
315	E	96.1	Very high	95.4	Very high	99 Å²	99	46 Å²	46	46%	0.463	22%	0.22	S	C	.	.	H	α-helix	trans	-68.8	-41.5	177.8	177.6	55.5	-161.6	0	0	112.4	E311 R312 A317 R318	E311-E315 PolarHBondContact O-N 2.9Å; R312-E315 PolarHBondContact O-N 3.06Å; E315-A317 PolarHBondContact O-N 2.85Å; E315-R318 VanDerWaalsContact CD-NE 3.27Å; E315-R318 WeakPolarHBondContact O-CB 3.41Å; E315-R318 PolarHBondContact O-N 2.99Å; E315-R318 VanDerWaalsContact O-N 3.1Å; E315-R318 IonicContact OE1-CZ 3.35Å; E315-R318 VanDerWaalsContact OE1-CZ 3.26Å; E315-R318 IonicContact OE1-NE 3.18Å; E315-R318 PolarHBondContact OE1-NE 2.85Å; E315-R318 IonicContact OE1-NH2 2.71Å; E315-R318 PolarHBondContact OE1-NH2 3.07Å; E315-R318 WeakPolarHBondContact OE2-CD 3.2Å; E315-R318 IonicContact OE2-CZ 3.66Å; E315-R318 IonicContact OE2-NE 2.74Å; E315-R318 PolarHBondContact OE2-NE 2.88Å; E315-R318 IonicContact OE2-NH2 3.79Å
316	L	96.1	Very high	95.7	Very high	45 Å²	45	43.8 Å²	43.8	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-36.8	172.7	-74.5	176.6	0	0	0	112.3	T271 R312 R318 T319 V323	T271-L316 HydrophobicContact CG2-CD1 3.97Å; R312-L316 WeakPolarHBondContact O-CG 3.4Å; R312-L316 PolarHBondContact O-N 2.95Å; L316-R318 VanDerWaalsContact C-N 3.31Å; L316-R318 PolarHBondContact O-N 2.81Å; L316-T319 PolarHBondContact O-OG1 2.89Å; L316-V323 HydrophobicContact CB-CG1 4.35Å; L316-V323 HydrophobicContact CB-CG2 3.89Å; L316-V323 HydrophobicContact CD1-CG1 4.45Å
317	A	96.8	Very high	95.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-75.9	-15.5	178.7	0	0	0	0	0	113.9	P231 M233 I313 F314 E315 T319 L320 V323	P231-A317 HydrophobicContact CB-CB 3.6Å; M233-A317 HydrophobicContact CB-CB 4.24Å; I313-A317 WeakPolarHBondContact O-CB 3.44Å; I313-A317 PolarHBondContact O-N 3.13Å; I313-A317 VanDerWaalsContact O-N 3.11Å; F314-A317 PolarHBondContact O-N 2.78Å; E315-A317 PolarHBondContact O-N 2.85Å; A317-T319 VanDerWaalsContact C-N 3.29Å; A317-T319 PolarHBondContact O-N 2.86Å; A317-L320 PolarHBondContact O-N 3.11Å; A317-V323 HydrophobicContact CB-CG2 4.11Å
318	R	94.3	Very high	95.8	Very high	135 Å²	135	43.7 Å²	43.7	51%	0.509	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-27.7	-176.1	-169.4	-173.8	54.9	63.3	3.7	113.1	F314 E315 L316 L320	F314-R318 PolarHBondContact O-N 2.78Å; E315-R318 VanDerWaalsContact CD-NE 3.27Å; E315-R318 WeakPolarHBondContact O-CB 3.41Å; E315-R318 PolarHBondContact O-N 2.99Å; E315-R318 VanDerWaalsContact O-N 3.1Å; E315-R318 IonicContact OE1-CZ 3.35Å; E315-R318 VanDerWaalsContact OE1-CZ 3.26Å; E315-R318 IonicContact OE1-NE 3.18Å; E315-R318 PolarHBondContact OE1-NE 2.85Å; E315-R318 IonicContact OE1-NH2 2.71Å; E315-R318 PolarHBondContact OE1-NH2 3.07Å; E315-R318 WeakPolarHBondContact OE2-CD 3.2Å; E315-R318 IonicContact OE2-CZ 3.66Å; E315-R318 IonicContact OE2-NE 2.74Å; E315-R318 PolarHBondContact OE2-NE 2.88Å; E315-R318 IonicContact OE2-NH2 3.79Å; L316-R318 VanDerWaalsContact C-N 3.31Å; L316-R318 PolarHBondContact O-N 2.81Å; R318-L320 PolarHBondContact O-N 2.96Å
319	T	93.3	Very high	95.7	Very high	69 Å²	69	42.3 Å²	42.3	42%	0.423	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-2.6	179.3	59.1	0	0	0	0	113.9	L316 A317 Q321	L316-T319 PolarHBondContact O-OG1 2.89Å; A317-T319 VanDerWaalsContact C-N 3.29Å; A317-T319 PolarHBondContact O-N 2.86Å; T319-Q321 PolarHBondContact O-N 2.9Å; T319-Q321 PolarHBondContact OG1-N 2.87Å; T319-Q321 PolarHBondContact OG1-OE1 3.12Å
320	L	95.4	Very high	95.8	Very high	28 Å²	28	40.9 Å²	40.9	15%	0.147	20%	0.195	C	C	.	.			trans	62.1	16.3	-168.5	-56.2	-178.7	0	0	0	115.6	V67 M233 A317 R318 W413 H417	V67-L320 HydrophobicContact CG2-CD1 4.04Å; V67-L320 HydrophobicContact CG2-CD2 4.37Å; M233-L320 WeakPolarHBondContact CE-O 3.39Å; M233-L320 VanDerWaalsContact CG-CA 3.46Å; M233-L320 HydrophobicContact CG-CB 4.25Å; M233-L320 HydrophobicContact CG-CD2 4.04Å; M233-L320 HydrophobicContact SD-CB 4.26Å; M233-L320 HydrophobicContact SD-CD2 4.07Å; A317-L320 PolarHBondContact O-N 3.11Å; R318-L320 PolarHBondContact O-N 2.96Å; L320-W413 WeakPolarHBondContact O-CZ3 3.24Å; L320-H417 WeakPolarHBondContact CB-NE2 3.32Å; L320-H417 PolarHBondContact O-CE1 3.49Å; L320-H417 PolarHBondContact O-NE2 2.78Å
321	Q	95.9	Very high	95.9	Very high	72 Å²	72	41.9 Å²	41.9	34%	0.336	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-73.7	153.5	169.4	-71.8	174	-42.4	0	0	112.1	M233 G266 T319 V323	M233-Q321 WeakPolarHBondContact CB-O 3.33Å; M233-Q321 WeakPolarHBondContact CG-O 3.21Å; G266-Q321 PolarHBondContact O-NE2 3Å; T319-Q321 PolarHBondContact O-N 2.9Å; T319-Q321 PolarHBondContact OG1-N 2.87Å; T319-Q321 PolarHBondContact OG1-OE1 3.12Å; Q321-V323 PolarHBondContact O-N 3.43Å
322	L	98	Very high	96	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	118.1	172.6	-68.4	172.6	0	0	0	109.3	M233 F264 R267 I268 S269 Y412 W413	M233-L322 HydrophobicContact CE-CD2 3.93Å; F264-L322 HydrophobicContact CB-CD1 4.21Å; F264-L322 HydrophobicContact CD1-CD1 3.57Å; F264-L322 HydrophobicContact CE1-CD1 4.04Å; F264-L322 HydrophobicContact CG-CD1 3.86Å; R267-L322 PolarHBondContact O-N 2.9Å; I268-L322 CarbonylContact C-O 3.59Å; I268-L322 WeakPolarHBondContact CA-O 3.22Å; I268-L322 HydrophobicContact CB-CB 4.38Å; I268-L322 HydrophobicContact CG1-CB 4.09Å; S269-L322 PolarHBondContact N-O 3.19Å; L322-Y412 HydrophobicContact CD2-CD1 4.1Å; L322-W413 HydrophobicContact CD1-CE3 4.33Å; L322-W413 HydrophobicContact CD2-CE3 4.21Å; L322-W413 HydrophobicContact CG-CE3 3.84Å; L322-W413 HydrophobicContact CG-CZ3 4.1Å
323	V	98.3	Very high	96	Very high	1 Å²	1	36 Å²	36	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.7	175.4	-176.5	0	0	0	0	109.1	P235 V236 L316 A317 Q321 L325	P235-V323 CarbonylContact C-O 3.56Å; P235-V323 WeakPolarHBondContact CA-O 3.25Å; P235-V323 HydrophobicContact CB-CB 4.44Å; P235-V323 HydrophobicContact CB-CG1 4.27Å; V236-V323 PolarHBondContact N-O 3.21Å; L316-V323 HydrophobicContact CB-CG1 4.35Å; L316-V323 HydrophobicContact CB-CG2 3.89Å; L316-V323 HydrophobicContact CD1-CG1 4.45Å; A317-V323 HydrophobicContact CB-CG2 4.11Å; Q321-V323 PolarHBondContact O-N 3.43Å; V323-L325 HydrophobicContact CG1-CD2 3.85Å
324	V	98.3	Very high	96	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.2	179.4	-177.8	0	0	0	0	109.7	V236 F257 I268 S269 I270 T271	V236-V324 HydrophobicContact CB-CB 4.46Å; V236-V324 HydrophobicContact CB-CG1 4.34Å; V236-V324 HydrophobicContact CB-CG2 4.02Å; V236-V324 HydrophobicContact CG2-CG2 4.15Å; F257-V324 HydrophobicContact CD1-CG1 3.84Å; F257-V324 HydrophobicContact CE1-CG1 3.6Å; I268-V324 HydrophobicContact CD1-CG2 3.77Å; I268-V324 HydrophobicContact CG1-CG2 3.95Å; S269-V324 PolarHBondContact O-N 3.34Å; I270-V324 WeakPolarHBondContact CA-O 3.45Å; I270-V324 HydrophobicContact CG1-CB 4.18Å; I270-V324 HydrophobicContact CG2-CB 4.45Å; I270-V324 HydrophobicContact CG2-CG1 4.45Å; T271-V324 PolarHBondContact N-O 3.28Å
325	L	97.9	Very high	95.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.1	-174.7	-49	-178.6	0	0	0	111.2	P235 V236 V237 T271 V273 I277 I313 V323 A327	P235-L325 HydrophobicContact CB-CD1 3.67Å; P235-L325 HydrophobicContact CB-CD2 4.4Å; P235-L325 HydrophobicContact CB-CG 3.82Å; P235-L325 HydrophobicContact CG-CD1 4.22Å; V236-L325 PolarHBondContact O-N 3.25Å; V237-L325 HydrophobicContact CG2-CB 4.29Å; V237-L325 HydrophobicContact CG2-CD1 4.23Å; T271-L325 HydrophobicContact CG2-CD2 3.57Å; T271-L325 WeakPolarHBondContact O-CA 3.49Å; V273-L325 HydrophobicContact CG2-CB 4.24Å; V273-L325 HydrophobicContact CG2-CD2 4.07Å; I277-L325 HydrophobicContact CD1-CD1 4.29Å; I313-L325 HydrophobicContact CD1-CD1 3.71Å; I313-L325 HydrophobicContact CD1-CD2 4.16Å; I313-L325 HydrophobicContact CG1-CD1 4.26Å; I313-L325 HydrophobicContact CG1-CD2 3.91Å; V323-L325 HydrophobicContact CG1-CD2 3.85Å; L325-A327 PolarHBondContact O-N 3.07Å
326	D	96.8	Very high	95.9	Very high	46 Å²	46	33.2 Å²	33.2	25%	0.246	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	81.3	161.4	-177.3	28.4	0	0	0	108.6	F257 T271 R272 V273	F257-D326 HydrophobicContact CE1-CB 4.35Å; F257-D326 HydrophobicContact CE2-CB 3.87Å; F257-D326 WeakPolarHBondContact CE2-OD1 3.48Å; F257-D326 HydrophobicContact CZ-CB 3.74Å; T271-D326 PolarHBondContact O-N 3.35Å; R272-D326 CarbonylContact C-O 3.5Å; R272-D326 VanDerWaalsContact CA-O 3.32Å; R272-D326 WeakPolarHBondContact CA-O 3.38Å; R272-D326 HydrophobicContact CB-CB 4.28Å; R272-D326 HydrophobicContact CG-CB 4.27Å; R272-D326 VanDerWaalsContact CG-O 3.32Å; R272-D326 WeakPolarHBondContact CG-O 3.45Å; V273-D326 PolarHBondContact N-O 3.28Å
327	A	95	Very high	95.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	111.1	-177.8	0	0	0	0	0	110.8	K244 V273 I277 L325 T329 I330	K244-A327 WeakPolarHBondContact CD-O 3.04Å; K244-A327 WeakPolarHBondContact CE-O 3.38Å; K244-A327 PolarHBondContact NZ-O 3.05Å; V273-A327 HydrophobicContact CB-CB 4.22Å; I277-A327 HydrophobicContact CD1-CB 4.33Å; L325-A327 PolarHBondContact O-N 3.07Å; A327-T329 VanDerWaalsContact C-N 3.34Å; A327-T329 PolarHBondContact O-N 3.31Å; A327-I330 HydrophobicContact CB-CB 4.27Å; A327-I330 HydrophobicContact CB-CG1 3.85Å
328	D	91	Very high	95.4	Very high	61 Å²	61	41.1 Å²	41.1	33%	0.326	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-38.8	-175.5	-72.5	30.8	0	0	0	112.9	R272 V273	R272-D328 IonicContact CZ-OD1 2.71Å; R272-D328 IonicContact CZ-OD2 3.43Å; R272-D328 IonicContact NE-OD1 3.3Å; R272-D328 PolarHBondContact NE-OD1 3.25Å; R272-D328 IonicContact NE-OD2 3.54Å; R272-D328 IonicContact NH2-OD1 3.17Å; R272-D328 PolarHBondContact NH2-OD1 3.49Å; R272-D328 IonicContact NH2-OD2 3.07Å; R272-D328 PolarHBondContact NH2-OD2 3.4Å; V273-D328 PolarHBondContact O-N 2.82Å
329	T	92.1	Very high	95.4	Very high	41 Å²	41	34.7 Å²	34.7	25%	0.252	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-14.5	-170.8	71.2	0	0	0	0	114.2	D276 A327 N331 Q335	D276-T329 HydrophobicContact CB-CG2 4.07Å; D276-T329 PolarHBondContact OD1-OG1 3.3Å; A327-T329 VanDerWaalsContact C-N 3.34Å; A327-T329 PolarHBondContact O-N 3.31Å; T329-N331 VanDerWaalsContact C-ND2 3.33Å; T329-N331 PolarHBondContact O-ND2 3.04Å; T329-Q335 PolarHBondContact O-NE2 2.96Å
330	I	96.3	Very high	95.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.			trans	-92.3	114.3	-169	-53.9	-56.6	0	0	0	110.8	V237 V239 K244 I277 A327 Q335 L336	V237-I330 HydrophobicContact CG1-CB 4.37Å; V237-I330 HydrophobicContact CG1-CG2 4Å; V239-I330 HydrophobicContact CG1-CG2 4.1Å; K244-I330 VanDerWaalsContact CE-O 3.24Å; K244-I330 WeakPolarHBondContact CE-O 3.37Å; I277-I330 HydrophobicContact CD1-CG1 4.38Å; I277-I330 HydrophobicContact CG1-CD1 4.18Å; I277-I330 HydrophobicContact CG1-CG1 4.2Å; A327-I330 HydrophobicContact CB-CB 4.27Å; A327-I330 HydrophobicContact CB-CG1 3.85Å; I330-Q335 HydrophobicContact CD1-CB 4.1Å; I330-L336 HydrophobicContact CD1-CD2 3.71Å; I330-L336 HydrophobicContact CD1-CG 4.09Å; I330-L336 HydrophobicContact CG1-CD1 4.27Å; I330-L336 HydrophobicContact CG1-CD2 4.23Å; I330-L336 HydrophobicContact CG1-CG 4.38Å; I330-L336 HydrophobicContact CG2-CD1 3.9Å; I330-L336 HydrophobicContact CG2-CG 4.11Å
331	N	96.9	Very high	95.4	Very high	32 Å²	32	31.2 Å²	31.2	17%	0.171	17%	0.17	C	C	.	.			trans	-127	-5.9	-173.6	-69.7	-93.3	0	0	0	112.5	L243 K244 T329	L243-N331 VanDerWaalsContact CA-OD1 3.26Å; L243-N331 WeakPolarHBondContact CA-OD1 3.47Å; L243-N331 HydrophobicContact CD2-CB 4.08Å; K244-N331 PolarHBondContact N-OD1 3.02Å; T329-N331 VanDerWaalsContact C-ND2 3.33Å; T329-N331 PolarHBondContact O-ND2 3.04Å
332	H	97.3	Very high	95.4	Very high	57 Å²	57	28.1 Å²	28.1	26%	0.264	16%	0.157	S	C	.	.	S	Bend	trans	-156.6	135	-173.5	-173.9	-83.1	0	0	0	111.6	A334 Q335 C384	H332-A334 VanDerWaalsContact C-N 3.29Å; H332-A334 WeakPolarHBondContact ND1-CB 3.29Å; H332-A334 PolarHBondContact ND1-N 3.04Å; H332-A334 PolarHBondContact O-N 3.27Å; H332-A334 VanDerWaalsContact O-N 3.16Å; H332-Q335 WeakPolarHBondContact O-CB 3.45Å; H332-Q335 PolarHBondContact O-N 2.91Å; H332-C384 PolarHBondContact NE2-SG 2.87Å
333	P	96.8	Very high	95.4	Very high	8 Å²	8	28.6 Å²	28.6	5%	0.052	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-57.9	-36.1	-172.8	20.7	-33.3	0	0	0	113.9	Q335 L336 S337 I345 M388 F389	P333-Q335 PolarHBondContact O-N 2.85Å; P333-Q335 VanDerWaalsContact O-N 3.08Å; P333-L336 PolarHBondContact O-N 3.37Å; P333-S337 PolarHBondContact O-N 2.91Å; P333-I345 HydrophobicContact CB-CG1 4.28Å; P333-I345 HydrophobicContact CB-CG2 4.31Å; P333-M388 HydrophobicContact CB-CB 4.23Å; P333-M388 WeakPolarHBondContact CB-O 3.28Å; P333-M388 HydrophobicContact CG-CB 3.96Å; P333-M388 HydrophobicContact CG-CE 4.08Å; P333-F389 HydrophobicContact CG-CD1 4.25Å; P333-F389 HydrophobicContact CG-CE1 3.72Å; P333-F389 HydrophobicContact CG-CZ 4.24Å
334	A	96.1	Very high	95.4	Very high	48 Å²	48	28.5 Å²	28.5	40%	0.397	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-65.1	-9.3	178.1	0	0	0	0	0	115.1	H332 L336 S337	H332-A334 VanDerWaalsContact C-N 3.29Å; H332-A334 WeakPolarHBondContact ND1-CB 3.29Å; H332-A334 PolarHBondContact ND1-N 3.04Å; H332-A334 PolarHBondContact O-N 3.27Å; H332-A334 VanDerWaalsContact O-N 3.16Å; A334-L336 VanDerWaalsContact C-N 3.34Å; A334-S337 PolarHBondContact O-OG 3.46Å
335	Q	95.3	Very high	95.4	Very high	51 Å²	51	28.9 Å²	28.9	24%	0.238	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-67.8	-34.3	168.1	-73.3	176.4	-94.4	0	0	111.8	T329 I330 H332 P333	T329-Q335 PolarHBondContact O-NE2 2.96Å; I330-Q335 HydrophobicContact CD1-CB 4.1Å; H332-Q335 WeakPolarHBondContact O-CB 3.45Å; H332-Q335 PolarHBondContact O-N 2.91Å; P333-Q335 PolarHBondContact O-N 2.85Å; P333-Q335 VanDerWaalsContact O-N 3.08Å
336	L	95.4	Very high	95.4	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-15.5	-174.8	-62.6	-176.5	0	0	0	114.1	V237 I277 I330 P333 A334 K338 T339 P343 I345	V237-L336 HydrophobicContact CG1-CD1 4.3Å; V237-L336 HydrophobicContact CG2-CD1 4.07Å; I277-L336 HydrophobicContact CD1-CD2 4.04Å; I277-L336 HydrophobicContact CG1-CD2 4.06Å; I330-L336 HydrophobicContact CD1-CD2 3.71Å; I330-L336 HydrophobicContact CD1-CG 4.09Å; I330-L336 HydrophobicContact CG1-CD1 4.27Å; I330-L336 HydrophobicContact CG1-CD2 4.23Å; I330-L336 HydrophobicContact CG1-CG 4.38Å; I330-L336 HydrophobicContact CG2-CD1 3.9Å; I330-L336 HydrophobicContact CG2-CG 4.11Å; P333-L336 PolarHBondContact O-N 3.37Å; A334-L336 VanDerWaalsContact C-N 3.34Å; L336-K338 PolarHBondContact O-N 3.28Å; L336-K338 VanDerWaalsContact O-N 3.1Å; L336-T339 HydrophobicContact CD2-CG2 4.14Å; L336-T339 WeakPolarHBondContact O-CB 3.41Å; L336-T339 WeakPolarHBondContact O-CG2 3.42Å; L336-T339 PolarHBondContact O-N 3.35Å; L336-T339 PolarHBondContact O-OG1 2.84Å; L336-P343 HydrophobicContact CB-CG 4.05Å; L336-P343 HydrophobicContact CD1-CB 4.47Å; L336-P343 HydrophobicContact CD1-CG 3.84Å; L336-I345 HydrophobicContact CD1-CD1 4.37Å
337	S	92.3	Very high	95.5	Very high	68 Å²	68	27.3 Å²	27.3	48%	0.476	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.9	-178.3	66.9	0	0	0	0	114.8	R282 P333 A334	R282-S337 PolarHBondContact NH1-O 3.26Å; R282-S337 VanDerWaalsContact NH1-O 3.13Å; P333-S337 PolarHBondContact O-N 2.91Å; A334-S337 PolarHBondContact O-OG 3.46Å
338	K	90.9	Very high	95.7	Very high	142 Å²	142	27.8 Å²	27.8	62%	0.617	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	1.9	176.7	-65.9	-172.4	178.9	-176.1	0	114.3	K281 R282 L336	K281-K338 CarbonylContact C-O 3.59Å; K281-K338 VanDerWaalsContact CA-O 3.3Å; K281-K338 WeakPolarHBondContact CA-O 3.45Å; K281-K338 HydrophobicContact CG-CB 4.24Å; R282-K338 WeakPolarHBondContact CG-O 3.38Å; R282-K338 PolarHBondContact N-O 3.46Å; L336-K338 PolarHBondContact O-N 3.28Å; L336-K338 VanDerWaalsContact O-N 3.1Å
339	T	93.4	Very high	96	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	15%	0.154	C	C	.	.	S	Bend	trans	-91.4	177	175.7	74.4	0	0	0	0	111.9	A280 R282 L336 L341	A280-T339 HydrophobicContact CB-CG2 4.06Å; A280-T339 VanDerWaalsContact O-CA 3.28Å; A280-T339 WeakPolarHBondContact O-CA 3.34Å; A280-T339 WeakPolarHBondContact O-CB 3.34Å; R282-T339 WeakPolarHBondContact CD-O 3.23Å; R282-T339 VanDerWaalsContact CG-C 3.48Å; R282-T339 WeakPolarHBondContact CG-O 3.3Å; R282-T339 PolarHBondContact NH1-O 3.15Å; L336-T339 HydrophobicContact CD2-CG2 4.14Å; L336-T339 WeakPolarHBondContact O-CB 3.41Å; L336-T339 WeakPolarHBondContact O-CG2 3.42Å; L336-T339 PolarHBondContact O-N 3.35Å; L336-T339 PolarHBondContact O-OG1 2.84Å; T339-L341 PolarHBondContact OG1-N 2.86Å
340	S	93.3	Very high	96.2	Very high	22 Å²	22	28 Å²	28	15%	0.154	15%	0.151	C	C	.	.	S	Bend	trans	-94.1	2.2	167.4	-71.7	0	0	0	0	113.9	V229 V230 P231 R282 A342	V229-S340 WeakPolarHBondContact O-CB 3.46Å; V230-S340 WeakPolarHBondContact CA-O 3.49Å; V230-S340 WeakPolarHBondContact CG1-O 3.34Å; P231-S340 WeakPolarHBondContact CD-O 3.36Å; R282-S340 WeakPolarHBondContact CD-OG 3.45Å; R282-S340 WeakPolarHBondContact CG-OG 3.37Å; S340-A342 VanDerWaalsContact C-N 3.32Å; S340-A342 PolarHBondContact O-N 3.29Å
341	L	95.8	Very high	96.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.175	C	C	.	.			trans	-69	-29.5	-177.1	-70.1	-178.7	0	0	0	113.6	P231 P235 I277 I310 I313 F314 T339 P343	P231-L341 WeakPolarHBondContact CD-O 3.32Å; P231-L341 HydrophobicContact CG-CD2 4.13Å; P235-L341 WeakPolarHBondContact CD-O 3.31Å; P235-L341 HydrophobicContact CG-CB 4.25Å; I277-L341 HydrophobicContact CD1-CD1 3.9Å; I310-L341 HydrophobicContact CD1-CD1 3.66Å; I310-L341 HydrophobicContact CD1-CD2 3.63Å; I310-L341 HydrophobicContact CD1-CG 3.62Å; I310-L341 HydrophobicContact CG2-CD2 4.5Å; I313-L341 HydrophobicContact CB-CD2 4.24Å; I313-L341 HydrophobicContact CD1-CD1 4.27Å; I313-L341 HydrophobicContact CD1-CD2 4.26Å; I313-L341 HydrophobicContact CG2-CD2 3.76Å; F314-L341 HydrophobicContact CE2-CD2 4.42Å; T339-L341 PolarHBondContact OG1-N 2.86Å; L341-P343 VanDerWaalsContact C-N 3.28Å
342	A	96.1	Very high	96.1	Very high	8 Å²	8	32.1 Å²	32.1	7%	0.066	18%	0.182	C	C	.	.			trans	41.5	49.6	-175.2	0	0	0	0	0	113.9	F99 V230 R234 S340	F99-A342 HydrophobicContact CE1-CB 3.66Å; F99-A342 HydrophobicContact CZ-CB 3.94Å; V230-A342 HydrophobicContact CB-CB 4.27Å; V230-A342 HydrophobicContact CG1-CB 3.86Å; R234-A342 WeakPolarHBondContact CG-O 3.22Å; R234-A342 PolarHBondContact NE-O 2.95Å; S340-A342 VanDerWaalsContact C-N 3.32Å; S340-A342 PolarHBondContact O-N 3.29Å
343	P	97.7	Very high	96.1	Very high	10 Å²	10	32.8 Å²	32.8	7%	0.065	19%	0.192	C	C	.	.			trans	-61	159.7	-171.3	30.3	-40.2	0	0	0	112.8	R234 P235 V237 L336 L341 I345	R234-P343 PolarHBondContact NH2-O 2.71Å; P235-P343 HydrophobicContact CG-CB 4.19Å; P235-P343 CarbonylContact O-C 3.42Å; P235-P343 WeakPolarHBondContact O-CA 3.46Å; P235-P343 WeakPolarHBondContact O-CB 3.36Å; V237-P343 HydrophobicContact CB-CB 4.49Å; V237-P343 HydrophobicContact CG2-CB 3.75Å; L336-P343 HydrophobicContact CB-CG 4.05Å; L336-P343 HydrophobicContact CD1-CB 4.47Å; L336-P343 HydrophobicContact CD1-CG 3.84Å; L341-P343 VanDerWaalsContact C-N 3.28Å; P343-I345 HydrophobicContact CB-CD1 4.07Å; P343-I345 HydrophobicContact CG-CD1 3.52Å; P343-I345 HydrophobicContact CG-CG1 4.26Å
344	I	98.5	Very high	96.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	112.2	160.4	-70.4	162.1	0	0	0	106.8	R234 P235 V236 V237 V346 D390 Y408 L409 Y412	R234-I344 HydrophobicContact CB-CD1 3.94Å; R234-I344 HydrophobicContact CB-CG1 3.77Å; P235-I344 PolarHBondContact O-N 3.17Å; V236-I344 WeakPolarHBondContact CA-O 3.32Å; V236-I344 HydrophobicContact CG1-CG2 4.36Å; V236-I344 HydrophobicContact CG2-CB 4.34Å; V236-I344 HydrophobicContact CG2-CD1 4.31Å; V237-I344 PolarHBondContact N-O 2.56Å; I344-V346 HydrophobicContact CG2-CG2 4.16Å; I344-D390 WeakPolarHBondContact CA-OD2 3.47Å; I344-D390 HydrophobicContact CG2-CB 3.83Å; I344-Y408 HydrophobicContact CD1-CE1 4.34Å; I344-Y408 HydrophobicContact CG2-CE1 3.92Å; I344-L409 HydrophobicContact CD1-CD2 4.42Å; I344-Y412 HydrophobicContact CD1-CD1 3.63Å; I344-Y412 HydrophobicContact CD1-CD2 4.37Å; I344-Y412 HydrophobicContact CD1-CE1 3.69Å; I344-Y412 HydrophobicContact CD1-CE2 4.45Å; I344-Y412 HydrophobicContact CD1-CG 4Å
345	I	98.3	Very high	96.2	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.041	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	115.3	176.5	-52.9	-63.4	0	0	0	109.7	V237 V239 P333 L336 P343 F389 D390 V391	V237-I345 HydrophobicContact CB-CD1 4.24Å; V239-I345 HydrophobicContact CG1-CG2 4.47Å; V239-I345 HydrophobicContact CG2-CG2 3.63Å; P333-I345 HydrophobicContact CB-CG1 4.28Å; P333-I345 HydrophobicContact CB-CG2 4.31Å; L336-I345 HydrophobicContact CD1-CD1 4.37Å; P343-I345 HydrophobicContact CB-CD1 4.07Å; P343-I345 HydrophobicContact CG-CD1 3.52Å; P343-I345 HydrophobicContact CG-CG1 4.26Å; I345-F389 HydrophobicContact CG2-CD1 3.77Å; I345-F389 HydrophobicContact CG2-CE1 4.41Å; I345-D390 PolarHBondContact N-OD2 3.07Å; I345-D390 PolarHBondContact O-N 2.7Å; I345-V391 PolarHBondContact O-N 2.94Å
346	V	98.6	Very high	96.3	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.6	173.5	-179.4	0	0	0	0	108.5	V236 V237 L238 V239 I344 V391 L393 L405	V236-V346 HydrophobicContact CG1-CG2 3.68Å; V237-V346 PolarHBondContact O-N 3.24Å; L238-V346 WeakPolarHBondContact CA-O 3.17Å; L238-V346 HydrophobicContact CG-CB 4.18Å; L238-V346 HydrophobicContact CG-CG1 4.35Å; V239-V346 PolarHBondContact N-O 2.67Å; I344-V346 HydrophobicContact CG2-CG2 4.16Å; V346-V391 HydrophobicContact CG1-CB 4.31Å; V346-V391 HydrophobicContact CG2-CB 4.22Å; V346-V391 HydrophobicContact CG2-CG2 4.33Å; V346-L393 HydrophobicContact CG1-CD1 3.67Å; V346-L393 HydrophobicContact CG1-CG 4.04Å; V346-L405 HydrophobicContact CG1-CD1 3.99Å; V346-L405 HydrophobicContact CG2-CD1 3.72Å
347	Y	98.5	Very high	96.4	Very high	13 Å²	13	41.4 Å²	41.4	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	110.1	176.5	176.8	-156.3	0	0	0	110.7	V239 K349 L381 F389 V391 I392 L393	V239-Y347 WeakPolarHBondContact O-CA 3.3Å; Y347-K349 HydrophobicContact CD1-CB 4.13Å; Y347-K349 HydrophobicContact CD2-CB 4.27Å; Y347-K349 HydrophobicContact CE1-CB 3.84Å; Y347-K349 HydrophobicContact CE1-CD 4Å; Y347-K349 HydrophobicContact CE1-CG 3.95Å; Y347-K349 HydrophobicContact CE2-CB 3.96Å; Y347-K349 HydrophobicContact CG-CB 4.33Å; Y347-K349 PolarHBondContact O-N 2.86Å; Y347-L381 HydrophobicContact CD2-CD1 4.49Å; Y347-L381 HydrophobicContact CE2-CB 3.78Å; Y347-L381 HydrophobicContact CE2-CD1 4.04Å; Y347-L381 HydrophobicContact CE2-CG 4.38Å; Y347-F389 HydrophobicContact CD1-CD1 4.33Å; Y347-F389 AromaticContact CD1-CD2 3.91Å; Y347-F389 HydrophobicContact CD1-CD2 3.91Å; Y347-F389 HydrophobicContact CD1-CE1 4.01Å; Y347-F389 AromaticContact CD1-CE2 3.57Å; Y347-F389 HydrophobicContact CD1-CE2 3.57Å; Y347-F389 HydrophobicContact CD1-CG 4.26Å; Y347-F389 AromaticContact CD1-CZ 3.62Å; Y347-F389 HydrophobicContact CD1-CZ 3.62Å; Y347-F389 HydrophobicContact CE1-CE2 4.06Å; Y347-F389 HydrophobicContact CE1-CZ 4.09Å; Y347-F389 HydrophobicContact CG-CD1 4.19Å; Y347-F389 AromaticContact CG-CE1 3.92Å; Y347-F389 HydrophobicContact CG-CE1 3.92Å; Y347-F389 HydrophobicContact CG-CE2 4.32Å; Y347-F389 HydrophobicContact CG-CG 4.47Å; Y347-F389 AromaticContact CG-CZ 3.98Å; Y347-F389 HydrophobicContact CG-CZ 3.98Å; Y347-V391 PolarHBondContact N-O 2.9Å; Y347-I392 HydrophobicContact CD1-CG1 4.4Å; Y347-I392 HydrophobicContact CD1-CG2 4.11Å; Y347-L393 PolarHBondContact O-N 3.4Å
348	V	98.2	Very high	96.7	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.067	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	113.4	168	-173.4	0	0	0	0	107.8	L238 V239 G240 P241 M252 L256	L238-V348 HydrophobicContact CD2-CG2 4.1Å; V239-V348 PolarHBondContact O-N 3.05Å; G240-V348 CarbonylContact C-O 3.57Å; P241-V348 WeakPolarHBondContact CA-O 3.35Å; P241-V348 WeakPolarHBondContact CB-O 3.41Å; P241-V348 HydrophobicContact CG-CG1 4.48Å; M252-V348 HydrophobicContact CE-CG1 4Å; L256-V348 HydrophobicContact CD1-CG2 3.54Å
349	K	97.5	Very high	97	Very high	68 Å²	68	42.1 Å²	42.1	30%	0.296	22%	0.218	S	C	.	.			trans	-120.3	113.3	-167.1	172.4	-176.2	158.8	-143.5	0	111.2	Y347 S351 I392 L393 D394	Y347-K349 HydrophobicContact CD1-CB 4.13Å; Y347-K349 HydrophobicContact CD2-CB 4.27Å; Y347-K349 HydrophobicContact CE1-CB 3.84Å; Y347-K349 HydrophobicContact CE1-CD 4Å; Y347-K349 HydrophobicContact CE1-CG 3.95Å; Y347-K349 HydrophobicContact CE2-CB 3.96Å; Y347-K349 HydrophobicContact CG-CB 4.33Å; Y347-K349 PolarHBondContact O-N 2.86Å; K349-S351 VanDerWaalsContact CE-OG 3.24Å; K349-S351 WeakPolarHBondContact CE-OG 3.3Å; K349-S351 PolarHBondContact NZ-OG 2.88Å; K349-S351 PolarHBondContact O-N 2.82Å; K349-I392 HydrophobicContact CB-CG2 4.08Å; K349-I392 HydrophobicContact CD-CG2 3.64Å; K349-L393 PolarHBondContact N-O 2.79Å; K349-D394 HydrophobicContact CB-CB 3.92Å; K349-D394 HydrophobicContact CD-CB 3.77Å; K349-D394 HydrophobicContact CG-CB 3.92Å; K349-D394 IonicContact NZ-OD2 2.94Å; K349-D394 PolarHBondContact NZ-OD2 3.28Å; K349-D394 WeakPolarHBondContact O-CA 3.43Å
350	I	97.3	Very high	97.3	Very high	37 Å²	37	42 Å²	42	19%	0.19	22%	0.218	C	C	.	.			trans	-84.7	100	167.9	-64.7	170.5	0	0	0	108.7	P241 M252 S352 V355 L356 L359	P241-I350 HydrophobicContact CB-CB 4.22Å; P241-I350 HydrophobicContact CB-CD1 3.68Å; P241-I350 HydrophobicContact CB-CG1 3.65Å; P241-I350 HydrophobicContact CG-CD1 3.59Å; P241-I350 HydrophobicContact CG-CG1 4.01Å; M252-I350 HydrophobicContact CE-CD1 4.13Å; M252-I350 HydrophobicContact CE-CG1 4.25Å; M252-I350 HydrophobicContact SD-CD1 4.07Å; I350-S352 WeakPolarHBondContact CG2-O 3.32Å; I350-S352 PolarHBondContact O-N 2.82Å; I350-V355 HydrophobicContact CG2-CB 3.99Å; I350-V355 HydrophobicContact CG2-CG1 4.07Å; I350-L356 HydrophobicContact CD1-CB 4.3Å; I350-L356 HydrophobicContact CD1-CD1 4.06Å; I350-L356 HydrophobicContact CG2-CB 4.23Å; I350-L359 HydrophobicContact CD1-CD1 3.82Å
351	S	94.5	Very high	97.5	Very high	72 Å²	72	45.8 Å²	45.8	50%	0.503	23%	0.231	S	C	.	.	S	Bend	trans	-60.7	-7.1	-176.4	-74.9	0	0	0	0	116	K349 D394	K349-S351 VanDerWaalsContact CE-OG 3.24Å; K349-S351 WeakPolarHBondContact CE-OG 3.3Å; K349-S351 PolarHBondContact NZ-OG 2.88Å; K349-S351 PolarHBondContact O-N 2.82Å; S351-D394 PolarHBondContact OG-OD2 3.41Å
352	S	96.6	Very high	97.6	Very high	47 Å²	47	50 Å²	50	33%	0.329	26%	0.26	S	S	.	.			trans	-124.8	111.2	172.2	-169.8	0	0	0	0	112.3	I350 K354 V355 L356	I350-S352 WeakPolarHBondContact CG2-O 3.32Å; I350-S352 PolarHBondContact O-N 2.82Å; S352-K354 PolarHBondContact O-N 2.87Å; S352-K354 VanDerWaalsContact O-N 3.07Å; S352-V355 WeakPolarHBondContact O-CA 3.31Å; S352-V355 WeakPolarHBondContact O-CB 3.35Å; S352-V355 PolarHBondContact O-N 2.61Å; S352-L356 PolarHBondContact O-N 3.01Å
353	P	96.3	Very high	97.6	Very high	71 Å²	71	54.2 Å²	54.2	46%	0.461	28%	0.275	S	S	.	.	H	α-helix	trans	-54.9	-28.8	173.4	-29.4	36.7	0	0	0	113.4	V355 Q357 M375	P353-V355 VanDerWaalsContact C-N 3.31Å; P353-V355 PolarHBondContact O-N 2.89Å; P353-Q357 WeakPolarHBondContact O-CB 3.26Å; P353-Q357 PolarHBondContact O-N 2.78Å; P353-M375 HydrophobicContact CB-CE 3.71Å
354	K	97.6	Very high	97.6	Very high	149 Å²	149	55.1 Å²	55.1	65%	0.648	29%	0.286	S	S	*	.	H	α-helix	trans	-71.4	-20.5	174.8	-64.9	179.9	-178.4	174.5	0	113.3	S352 R358	S352-K354 PolarHBondContact O-N 2.87Å; S352-K354 VanDerWaalsContact O-N 3.07Å; K354-R358 WeakPolarHBondContact O-CG 3.46Å; K354-R358 PolarHBondContact O-NH1 2.62Å
355	V	97.9	Very high	97.4	Very high	64 Å²	64	64.3 Å²	64.3	39%	0.388	33%	0.326	S	S	.	.	H	α-helix	trans	-80.8	-49.6	172.5	172.7	0	0	0	0	109.5	I350 S352 P353 Q357 R358 L359	I350-V355 HydrophobicContact CG2-CB 3.99Å; I350-V355 HydrophobicContact CG2-CG1 4.07Å; S352-V355 WeakPolarHBondContact O-CA 3.31Å; S352-V355 WeakPolarHBondContact O-CB 3.35Å; S352-V355 PolarHBondContact O-N 2.61Å; P353-V355 VanDerWaalsContact C-N 3.31Å; P353-V355 PolarHBondContact O-N 2.89Å; V355-Q357 VanDerWaalsContact C-N 3.28Å; V355-Q357 PolarHBondContact O-N 2.82Å; V355-R358 WeakPolarHBondContact O-CA 3.26Å; V355-R358 WeakPolarHBondContact O-CB 3.41Å; V355-R358 PolarHBondContact O-N 3Å; V355-L359 HydrophobicContact CG1-CD1 3.99Å; V355-L359 HydrophobicContact CG1-CG 4.38Å; V355-L359 WeakPolarHBondContact O-CG 3.33Å; V355-L359 PolarHBondContact O-N 2.68Å
356	L	97.8	Very high	97.3	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-53.5	-45.1	173	177.4	60.2	0	0	0	111.6	V248 I350 S352 R358 L359 I360 M375 A378	V248-L356 HydrophobicContact CG1-CD1 4.12Å; I350-L356 HydrophobicContact CD1-CB 4.3Å; I350-L356 HydrophobicContact CD1-CD1 4.06Å; I350-L356 HydrophobicContact CG2-CB 4.23Å; S352-L356 PolarHBondContact O-N 3.01Å; L356-R358 PolarHBondContact O-N 2.79Å; L356-L359 PolarHBondContact O-N 2.87Å; L356-I360 HydrophobicContact CD1-CD1 3.71Å; L356-I360 HydrophobicContact CD1-CG1 3.93Å; L356-I360 HydrophobicContact CD2-CD1 4.49Å; L356-I360 HydrophobicContact CG-CD1 3.76Å; L356-I360 HydrophobicContact CG-CG1 4.39Å; L356-I360 WeakPolarHBondContact O-CG1 3.43Å; L356-I360 PolarHBondContact O-N 3.35Å; L356-M375 HydrophobicContact CB-SD 4.42Å; L356-M375 HydrophobicContact CD2-CE 4.14Å; L356-M375 HydrophobicContact CD2-SD 3.95Å; L356-M375 HydrophobicContact CG-SD 3.96Å; L356-A378 HydrophobicContact CD2-CB 3.41Å; L356-A378 VanDerWaalsContact CD2-CB 3.41Å
357	Q	97.9	Very high	97.2	Very high	75 Å²	75	67.8 Å²	67.8	35%	0.35	35%	0.349	S	S	.	.	H	α-helix	trans	-60.1	-30.6	177.2	-154.9	-151.1	53.4	0	0	113.5	P353 V355 K361 L371 M375	P353-Q357 WeakPolarHBondContact O-CB 3.26Å; P353-Q357 PolarHBondContact O-N 2.78Å; V355-Q357 VanDerWaalsContact C-N 3.28Å; V355-Q357 PolarHBondContact O-N 2.82Å; Q357-K361 VanDerWaalsContact CD-NZ 3.3Å; Q357-K361 VanDerWaalsContact O-CD 3.31Å; Q357-K361 WeakPolarHBondContact O-CD 3.17Å; Q357-K361 VanDerWaalsContact O-CG 3.22Å; Q357-K361 WeakPolarHBondContact O-CG 2.88Å; Q357-K361 PolarHBondContact O-N 3.3Å; Q357-L371 HydrophobicContact CB-CD1 4.46Å; Q357-L371 HydrophobicContact CG-CD1 3.73Å; Q357-L371 HydrophobicContact CG-CD2 3.84Å; Q357-L371 HydrophobicContact CG-CG 4.3Å; Q357-M375 HydrophobicContact CB-SD 4.2Å; Q357-M375 HydrophobicContact CG-SD 4.47Å
358	R	98.1	Very high	97.1	Very high	158 Å²	158	69 Å²	69	60%	0.596	36%	0.362	S	S	*	.	H	α-helix	trans	-79.5	-41.2	175.5	-71.7	178.6	-169.9	110.3	-20.8	111.7	K354 V355 L356 K361 S362	K354-R358 WeakPolarHBondContact O-CG 3.46Å; K354-R358 PolarHBondContact O-NH1 2.62Å; V355-R358 WeakPolarHBondContact O-CA 3.26Å; V355-R358 WeakPolarHBondContact O-CB 3.41Å; V355-R358 PolarHBondContact O-N 3Å; L356-R358 PolarHBondContact O-N 2.79Å; R358-K361 CarbonylContact O-C 3.45Å; R358-K361 PolarHBondContact O-N 2.82Å; R358-S362 PolarHBondContact O-N 2.86Å
359	L	97.9	Very high	97.1	Very high	66 Å²	66	75.6 Å²	75.6	35%	0.346	39%	0.39	S	S	.	.	H	α-helix	trans	-60.3	-45.5	176.4	-68.2	169.6	0	0	0	111.6	V248 I350 V355 L356 K361 S362 R363	V248-L359 HydrophobicContact CG1-CB 4.15Å; V248-L359 HydrophobicContact CG2-CB 4.41Å; I350-L359 HydrophobicContact CD1-CD1 3.82Å; V355-L359 HydrophobicContact CG1-CD1 3.99Å; V355-L359 HydrophobicContact CG1-CG 4.38Å; V355-L359 WeakPolarHBondContact O-CG 3.33Å; V355-L359 PolarHBondContact O-N 2.68Å; L356-L359 PolarHBondContact O-N 2.87Å; L359-K361 VanDerWaalsContact C-N 3.27Å; L359-K361 PolarHBondContact O-N 3.14Å; L359-S362 PolarHBondContact O-N 3.3Å; L359-S362 PolarHBondContact O-OG 2.79Å; L359-R363 PolarHBondContact O-N 2.93Å
360	I	98.2	Very high	97	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-62.3	-36.4	176.3	-62.6	167.8	0	0	0	111.3	V248 L356 Q367 L371 Q374 M375	V248-I360 HydrophobicContact CG2-CG1 4Å; L356-I360 HydrophobicContact CD1-CD1 3.71Å; L356-I360 HydrophobicContact CD1-CG1 3.93Å; L356-I360 HydrophobicContact CD2-CD1 4.49Å; L356-I360 HydrophobicContact CG-CD1 3.76Å; L356-I360 HydrophobicContact CG-CG1 4.39Å; L356-I360 WeakPolarHBondContact O-CG1 3.43Å; L356-I360 PolarHBondContact O-N 3.35Å; I360-Q367 HydrophobicContact CG2-CB 4.26Å; I360-L371 HydrophobicContact CB-CD1 3.87Å; I360-L371 HydrophobicContact CD1-CD1 3.72Å; I360-L371 HydrophobicContact CG1-CD1 4.4Å; I360-L371 HydrophobicContact CG2-CB 4.27Å; I360-L371 HydrophobicContact CG2-CD1 3.8Å; I360-Q374 HydrophobicContact CD1-CB 3.64Å; I360-Q374 HydrophobicContact CD1-CG 4.42Å; I360-Q374 VanDerWaalsContact CD1-OE1 3.31Å; I360-Q374 VanDerWaalsContact CG1-OE1 3.31Å; I360-M375 HydrophobicContact CD1-SD 4.29Å
361	K	97.8	Very high	97.1	Very high	100 Å²	100	74.5 Å²	74.5	44%	0.435	39%	0.385	S	S	.	.	H	α-helix	trans	-73.3	-32.5	176.8	-73.4	171.8	-176.8	173.1	0	113.1	Q357 R358 L359 R363 G364	Q357-K361 VanDerWaalsContact CD-NZ 3.3Å; Q357-K361 VanDerWaalsContact O-CD 3.31Å; Q357-K361 WeakPolarHBondContact O-CD 3.17Å; Q357-K361 VanDerWaalsContact O-CG 3.22Å; Q357-K361 WeakPolarHBondContact O-CG 2.88Å; Q357-K361 PolarHBondContact O-N 3.3Å; R358-K361 CarbonylContact O-C 3.45Å; R358-K361 PolarHBondContact O-N 2.82Å; L359-K361 VanDerWaalsContact C-N 3.27Å; L359-K361 PolarHBondContact O-N 3.14Å; K361-R363 VanDerWaalsContact C-N 3.29Å; K361-R363 PolarHBondContact O-N 3.09Å; K361-G364 PolarHBondContact O-N 3.47Å
362	S	97.8	Very high	97.2	Very high	89 Å²	89	77.2 Å²	77.2	62%	0.622	39%	0.394	S	S	*	.	H	α-helix	trans	-70.7	-25.1	178.9	69.6	0	0	0	0	112.9	R358 L359 G364	R358-S362 PolarHBondContact O-N 2.86Å; L359-S362 PolarHBondContact O-N 3.3Å; L359-S362 PolarHBondContact O-OG 2.79Å; S362-G364 PolarHBondContact O-N 3.13Å
363	R	97.4	Very high	97.3	Very high	97 Å²	97	78.2 Å²	78.2	37%	0.366	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	0.2	167.3	-55.3	-51.1	-61	-164.3	-4	114.3	E247 V248 M251 L359 K361 S366 Q367	E247-R363 HydrophobicContact CB-CG 4.35Å; E247-R363 IonicContact OE2-CZ 2.62Å; E247-R363 IonicContact OE2-NE 2.71Å; E247-R363 PolarHBondContact OE2-NE 3.09Å; E247-R363 IonicContact OE2-NH2 3.17Å; E247-R363 PolarHBondContact OE2-NH2 2.94Å; V248-R363 HydrophobicContact CG2-CG 3.77Å; M251-R363 VanDerWaalsContact SD-CZ 3.57Å; M251-R363 PolarHBondContact SD-NH1 3.47Å; M251-R363 PolarHBondContact SD-NH2 3.26Å; L359-R363 PolarHBondContact O-N 2.93Å; K361-R363 VanDerWaalsContact C-N 3.29Å; K361-R363 PolarHBondContact O-N 3.09Å; R363-S366 PolarHBondContact O-OG 2.88Å; R363-Q367 HydrophobicContact CB-CB 3.76Å; R363-Q367 HydrophobicContact CB-CG 3.52Å; R363-Q367 HydrophobicContact CG-CG 4.32Å
364	G	96.8	Very high	97.4	Very high	30 Å²	30	74.9 Å²	74.9	31%	0.309	38%	0.376	S	S	.	.			trans	83.9	-171.4	171.7	0	0	0	0	0	115.2	K361 S362 S366 Q367 A368	K361-G364 PolarHBondContact O-N 3.47Å; S362-G364 PolarHBondContact O-N 3.13Å; G364-S366 VanDerWaalsContact C-N 3.26Å; G364-S366 PolarHBondContact O-N 2.97Å; G364-Q367 PolarHBondContact O-N 2.93Å; G364-A368 WeakPolarHBondContact O-CB 3.43Å; G364-A368 PolarHBondContact O-N 3.01Å
365	K	95.3	Very high	97.4	Very high	193 Å²	193	69 Å²	69	84%	0.839	35%	0.351	S	S	*	.	H	α-helix	trans	-62.6	-29.8	-169.3	-64.3	-178.9	-177.6	176.4	0	113.6	K369	K365-K369 PolarHBondContact O-N 3.25Å
366	S	95.9	Very high	97.4	Very high	62 Å²	62	69.5 Å²	69.5	43%	0.434	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-39.1	176.9	45.4	0	0	0	0	113.1	R363 G364 K369	R363-S366 PolarHBondContact O-OG 2.88Å; G364-S366 VanDerWaalsContact C-N 3.26Å; G364-S366 PolarHBondContact O-N 2.97Å; S366-K369 WeakPolarHBondContact O-CE 3.36Å; S366-K369 WeakPolarHBondContact O-CG 3.14Å
367	Q	96.6	Very high	97.4	Very high	19 Å²	19	70 Å²	70	9%	0.089	36%	0.359	C	S	.	.	H	α-helix	trans	-91.3	-38.2	177.5	-65.5	-58.7	-30.8	0	0	111.7	E247 I360 R363 G364 K369 H370 L371	E247-Q367 HydrophobicContact CB-CG 4.32Å; E247-Q367 HydrophobicContact CG-CG 4.33Å; E247-Q367 WeakPolarHBondContact OE1-CG 3.2Å; E247-Q367 PolarHBondContact OE1-NE2 3.31Å; I360-Q367 HydrophobicContact CG2-CB 4.26Å; R363-Q367 HydrophobicContact CB-CB 3.76Å; R363-Q367 HydrophobicContact CB-CG 3.52Å; R363-Q367 HydrophobicContact CG-CG 4.32Å; G364-Q367 PolarHBondContact O-N 2.93Å; Q367-K369 PolarHBondContact O-N 3.19Å; Q367-K369 VanDerWaalsContact O-N 3.16Å; Q367-H370 PolarHBondContact O-N 2.68Å; Q367-L371 PolarHBondContact O-N 3.11Å
368	A	96.3	Very high	97.4	Very high	38 Å²	38	67 Å²	67	31%	0.314	35%	0.347	S	S	.	.	H	α-helix	trans	-58.5	-30.4	-179.3	0	0	0	0	0	114.1	G364 H370 L371	G364-A368 WeakPolarHBondContact O-CB 3.43Å; G364-A368 PolarHBondContact O-N 3.01Å; A368-H370 PolarHBondContact O-N 3.43Å; A368-L371 VanDerWaalsContact O-CB 3.25Å; A368-L371 WeakPolarHBondContact O-CB 3.48Å; A368-L371 PolarHBondContact O-N 2.68Å
369	K	97.1	Very high	97.4	Very high	150 Å²	150	62.4 Å²	62.4	65%	0.652	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.7	172.3	56.4	157.4	173.8	149.6	0	114.2	K365 S366 Q367	K365-K369 PolarHBondContact O-N 3.25Å; S366-K369 WeakPolarHBondContact O-CE 3.36Å; S366-K369 WeakPolarHBondContact O-CG 3.14Å; Q367-K369 PolarHBondContact O-N 3.19Å; Q367-K369 VanDerWaalsContact O-N 3.16Å
370	H	97.3	Very high	97.3	Very high	63 Å²	63	65.1 Å²	65.1	29%	0.292	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	12.2	-179.8	-64.3	-58.9	0	0	0	113	Y246 Q367 A368 N372 V373 Q374	Y246-H370 HydrophobicContact CD1-CB 4.27Å; Y246-H370 HydrophobicContact CE1-CB 3.49Å; Y246-H370 VanDerWaalsContact CE1-CB 3.49Å; Y246-H370 AromaticContact CE1-CD2 3.79Å; Y246-H370 AromaticContact CE1-CG 3.68Å; Q367-H370 PolarHBondContact O-N 2.68Å; A368-H370 PolarHBondContact O-N 3.43Å; H370-N372 PolarHBondContact O-N 2.64Å; H370-V373 HydrophobicContact CB-CG1 4.05Å; H370-V373 WeakPolarHBondContact O-CG1 3.4Å; H370-V373 PolarHBondContact O-N 2.97Å; H370-Q374 PolarHBondContact O-N 2.76Å
371	L	97.7	Very high	97.3	Very high	18 Å²	18	65.2 Å²	65.2	9%	0.094	34%	0.344	C	S	.	.	H	α-helix	trans	-52	-49.5	-178.2	176.7	62.4	0	0	0	113	Q357 I360 Q367 A368 V373 Q374 M375	Q357-L371 HydrophobicContact CB-CD1 4.46Å; Q357-L371 HydrophobicContact CG-CD1 3.73Å; Q357-L371 HydrophobicContact CG-CD2 3.84Å; Q357-L371 HydrophobicContact CG-CG 4.3Å; I360-L371 HydrophobicContact CB-CD1 3.87Å; I360-L371 HydrophobicContact CD1-CD1 3.72Å; I360-L371 HydrophobicContact CG1-CD1 4.4Å; I360-L371 HydrophobicContact CG2-CB 4.27Å; I360-L371 HydrophobicContact CG2-CD1 3.8Å; Q367-L371 PolarHBondContact O-N 3.11Å; A368-L371 VanDerWaalsContact O-CB 3.25Å; A368-L371 WeakPolarHBondContact O-CB 3.48Å; A368-L371 PolarHBondContact O-N 2.68Å; L371-V373 PolarHBondContact O-N 3.13Å; L371-Q374 PolarHBondContact O-N 3.27Å; L371-M375 HydrophobicContact CD1-CG 3.91Å; L371-M375 HydrophobicContact CD1-SD 4.09Å; L371-M375 HydrophobicContact CG-CG 4.27Å; L371-M375 WeakPolarHBondContact O-CG 3.34Å; L371-M375 PolarHBondContact O-N 3.03Å
372	N	97.9	Very high	97.2	Very high	130 Å²	130	63.9 Å²	63.9	70%	0.695	35%	0.352	S	S	*	.	H	α-helix	trans	-65.1	-37.8	-173.5	-66.3	-3.2	0	0	0	112.8	H370 M375 V376	H370-N372 PolarHBondContact O-N 2.64Å; N372-M375 PolarHBondContact O-N 2.9Å; N372-V376 VanDerWaalsContact O-CG2 3.31Å; N372-V376 WeakPolarHBondContact O-CG2 3.47Å; N372-V376 PolarHBondContact O-N 3.15Å
373	V	97.9	Very high	97.2	Very high	68 Å²	68	66.7 Å²	66.7	41%	0.412	36%	0.355	S	S	.	.	H	α-helix	trans	-73.7	-33.1	179.1	63.3	0	0	0	0	111.7	L243 H370 L371 A377	L243-V373 HydrophobicContact CD1-CG2 3.88Å; H370-V373 HydrophobicContact CB-CG1 4.05Å; H370-V373 WeakPolarHBondContact O-CG1 3.4Å; H370-V373 PolarHBondContact O-N 2.97Å; L371-V373 PolarHBondContact O-N 3.13Å; V373-A377 PolarHBondContact O-N 2.91Å
374	Q	98	Very high	97.2	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-67.3	-44.1	170.9	-76.5	-178	54.5	0	0	112.2	S242 Y246 I360 H370 L371 A377 A378	S242-Q374 WeakPolarHBondContact OG-CA 3.49Å; S242-Q374 WeakPolarHBondContact OG-CB 3.4Å; S242-Q374 PolarHBondContact OG-O 2.78Å; Y246-Q374 HydrophobicContact CD1-CG 4.28Å; Y246-Q374 HydrophobicContact CD2-CG 3.86Å; Y246-Q374 HydrophobicContact CE1-CG 4.48Å; Y246-Q374 HydrophobicContact CE2-CG 4.09Å; Y246-Q374 HydrophobicContact CG-CG 3.93Å; Y246-Q374 VanDerWaalsContact CG-NE2 3.29Å; I360-Q374 HydrophobicContact CD1-CB 3.64Å; I360-Q374 HydrophobicContact CD1-CG 4.42Å; I360-Q374 VanDerWaalsContact CD1-OE1 3.31Å; I360-Q374 VanDerWaalsContact CG1-OE1 3.31Å; H370-Q374 PolarHBondContact O-N 2.76Å; L371-Q374 PolarHBondContact O-N 3.27Å; Q374-A377 PolarHBondContact O-N 3.31Å; Q374-A378 PolarHBondContact O-N 3.31Å; Q374-A378 VanDerWaalsContact O-N 3.14Å
375	M	98.1	Very high	97.2	Very high	25 Å²	25	63.9 Å²	63.9	12%	0.123	34%	0.344	C	S	.	.	H	α-helix	trans	-60.9	-48.8	176.3	-67.3	-50.3	-49.7	0	0	111.7	P353 L356 Q357 I360 L371 N372 A377 A378 D379	P353-M375 HydrophobicContact CB-CE 3.71Å; L356-M375 HydrophobicContact CB-SD 4.42Å; L356-M375 HydrophobicContact CD2-CE 4.14Å; L356-M375 HydrophobicContact CD2-SD 3.95Å; L356-M375 HydrophobicContact CG-SD 3.96Å; Q357-M375 HydrophobicContact CB-SD 4.2Å; Q357-M375 HydrophobicContact CG-SD 4.47Å; I360-M375 HydrophobicContact CD1-SD 4.29Å; L371-M375 HydrophobicContact CD1-CG 3.91Å; L371-M375 HydrophobicContact CD1-SD 4.09Å; L371-M375 HydrophobicContact CG-CG 4.27Å; L371-M375 WeakPolarHBondContact O-CG 3.34Å; L371-M375 PolarHBondContact O-N 3.03Å; N372-M375 PolarHBondContact O-N 2.9Å; M375-A377 PolarHBondContact O-N 3.15Å; M375-A377 VanDerWaalsContact O-N 3.15Å; M375-A378 WeakPolarHBondContact O-CB 3.24Å; M375-A378 PolarHBondContact O-N 3.08Å; M375-D379 VanDerWaalsContact O-CG 3.27Å; M375-D379 PolarHBondContact O-N 3.39Å
376	V	98	Very high	97.1	Very high	76 Å²	76	58.8 Å²	58.8	46%	0.461	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-28.3	-179.7	167.6	0	0	0	0	112.9	N372 K380	N372-V376 VanDerWaalsContact O-CG2 3.31Å; N372-V376 WeakPolarHBondContact O-CG2 3.47Å; N372-V376 PolarHBondContact O-N 3.15Å; V376-K380 VanDerWaalsContact O-CG 3.28Å; V376-K380 WeakPolarHBondContact O-CG 3.42Å; V376-K380 PolarHBondContact O-N 3.38Å
377	A	97.3	Very high	97	Very high	14 Å²	14	62.4 Å²	62.4	12%	0.116	34%	0.341	C	S	.	.	H	α-helix	trans	-77	-40	174.2	0	0	0	0	0	113	L243 V373 Q374 M375 D379 K380 L381	L243-A377 HydrophobicContact CD1-CB 4.22Å; L243-A377 HydrophobicContact CD2-CB 3.48Å; L243-A377 VanDerWaalsContact CD2-CB 3.48Å; L243-A377 HydrophobicContact CG-CB 3.42Å; L243-A377 VanDerWaalsContact CG-CB 3.42Å; V373-A377 PolarHBondContact O-N 2.91Å; Q374-A377 PolarHBondContact O-N 3.31Å; M375-A377 PolarHBondContact O-N 3.15Å; M375-A377 VanDerWaalsContact O-N 3.15Å; A377-D379 VanDerWaalsContact C-N 3.34Å; A377-K380 PolarHBondContact O-N 2.9Å; A377-L381 PolarHBondContact O-N 2.89Å
378	A	97.9	Very high	97	Very high	12 Å²	12	64.6 Å²	64.6	10%	0.099	35%	0.352	C	S	.	.	H	α-helix	trans	-62	-43	172.6	0	0	0	0	0	111.1	P241 L356 Q374 M375 K380 L381 A382	P241-A378 WeakPolarHBondContact O-CB 3.31Å; L356-A378 HydrophobicContact CD2-CB 3.41Å; L356-A378 VanDerWaalsContact CD2-CB 3.41Å; Q374-A378 PolarHBondContact O-N 3.31Å; Q374-A378 VanDerWaalsContact O-N 3.14Å; M375-A378 WeakPolarHBondContact O-CB 3.24Å; M375-A378 PolarHBondContact O-N 3.08Å; A378-K380 VanDerWaalsContact C-N 3.31Å; A378-K380 PolarHBondContact O-N 3.48Å; A378-L381 PolarHBondContact O-N 2.91Å; A378-A382 WeakPolarHBondContact O-CB 3.17Å; A378-A382 PolarHBondContact O-N 2.86Å
379	D	97.7	Very high	97	Very high	61 Å²	61	63.8 Å²	63.8	33%	0.326	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-37.2	176	-64.3	-31.9	0	0	0	111.7	M375 A377 A382 Q383	M375-D379 VanDerWaalsContact O-CG 3.27Å; M375-D379 PolarHBondContact O-N 3.39Å; A377-D379 VanDerWaalsContact C-N 3.34Å; D379-A382 PolarHBondContact O-N 3.47Å; D379-Q383 WeakPolarHBondContact O-CB 3.47Å; D379-Q383 WeakPolarHBondContact O-CG 3.42Å; D379-Q383 PolarHBondContact O-N 3.38Å; D379-Q383 PolarHBondContact O-NE2 3.37Å
380	K	97.2	Very high	97.1	Very high	122 Å²	122	59 Å²	59	53%	0.53	32%	0.323	S	S	.	.	H	α-helix	trans	-67.6	-38.9	174	-78.2	172.3	179.9	-178.8	0	113.1	V376 A377 A378 Q383 C384	V376-K380 VanDerWaalsContact O-CG 3.28Å; V376-K380 WeakPolarHBondContact O-CG 3.42Å; V376-K380 PolarHBondContact O-N 3.38Å; A377-K380 PolarHBondContact O-N 2.9Å; A378-K380 VanDerWaalsContact C-N 3.31Å; A378-K380 PolarHBondContact O-N 3.48Å; K380-Q383 PolarHBondContact O-N 2.95Å; K380-C384 PolarHBondContact O-N 2.69Å; K380-C384 PolarHBondContact O-SG 3.48Å
381	L	97.7	Very high	97.1	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-67.9	-36.9	173.3	-77	170.1	0	0	0	111.7	V239 G240 Y347 A377 A378 Q383 C384 F389	V239-L381 HydrophobicContact CG2-CD2 4.31Å; G240-L381 VanDerWaalsContact CA-CD1 3.5Å; Y347-L381 HydrophobicContact CD2-CD1 4.49Å; Y347-L381 HydrophobicContact CE2-CB 3.78Å; Y347-L381 HydrophobicContact CE2-CD1 4.04Å; Y347-L381 HydrophobicContact CE2-CG 4.38Å; A377-L381 PolarHBondContact O-N 2.89Å; A378-L381 PolarHBondContact O-N 2.91Å; L381-Q383 VanDerWaalsContact C-N 3.29Å; L381-Q383 PolarHBondContact O-N 3.4Å; L381-C384 VanDerWaalsContact O-CB 3.28Å; L381-C384 WeakPolarHBondContact O-CB 3.31Å; L381-C384 PolarHBondContact O-N 3.29Å; L381-F389 HydrophobicContact CD2-CE1 4.18Å; L381-F389 HydrophobicContact CD2-CZ 4.16Å
382	A	96.2	Very high	97.2	Very high	72 Å²	72	57.8 Å²	57.8	60%	0.595	32%	0.318	S	S	*	.	H	α-helix	trans	-69.8	-23	173.3	0	0	0	0	0	113.8	A378 D379 C384	A378-A382 WeakPolarHBondContact O-CB 3.17Å; A378-A382 PolarHBondContact O-N 2.86Å; D379-A382 PolarHBondContact O-N 3.47Å; A382-C384 VanDerWaalsContact C-N 3.33Å
383	Q	96.4	Very high	97.2	Very high	147 Å²	147	51.8 Å²	51.8	69%	0.687	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-5.7	172.3	-73.5	163.4	36	0	0	113.6	D379 K380 L381 P385	D379-Q383 WeakPolarHBondContact O-CB 3.47Å; D379-Q383 WeakPolarHBondContact O-CG 3.42Å; D379-Q383 PolarHBondContact O-N 3.38Å; D379-Q383 PolarHBondContact O-NE2 3.37Å; K380-Q383 PolarHBondContact O-N 2.95Å; L381-Q383 VanDerWaalsContact C-N 3.29Å; L381-Q383 PolarHBondContact O-N 3.4Å; Q383-P385 WeakPolarHBondContact O-CD 3.33Å
384	C	97.3	Very high	97.1	Very high	15 Å²	15	52.1 Å²	52.1	10%	0.101	29%	0.285	C	S	.	.	S	Bend	trans	-72.3	130.9	176.6	-72	0	0	0	0	110.8	H332 K380 L381 A382 M388 F389	H332-C384 PolarHBondContact NE2-SG 2.87Å; K380-C384 PolarHBondContact O-N 2.69Å; K380-C384 PolarHBondContact O-SG 3.48Å; L381-C384 VanDerWaalsContact O-CB 3.28Å; L381-C384 WeakPolarHBondContact O-CB 3.31Å; L381-C384 PolarHBondContact O-N 3.29Å; A382-C384 VanDerWaalsContact C-N 3.33Å; C384-M388 HydrophobicContact CB-CE 3.44Å; C384-M388 VanDerWaalsContact CB-CE 3.44Å; C384-M388 VanDerWaalsContact SG-CE 3.57Å; C384-F389 HydrophobicContact CB-CE2 3.51Å; C384-F389 HydrophobicContact CB-CZ 3.47Å; C384-F389 VanDerWaalsContact CB-CZ 3.47Å
385	P	96.8	Very high	97.1	Very high	54 Å²	54	54.8 Å²	54.8	35%	0.351	30%	0.298	S	S	.	.			trans	-48.4	134.5	163.1	0.3	-13.6	0	0	0	111.9	Q383 E387 M388	Q383-P385 WeakPolarHBondContact O-CD 3.33Å; P385-E387 HydrophobicContact CB-CG 4.5Å; P385-E387 VanDerWaalsContact CB-OE1 3.23Å; P385-E387 WeakPolarHBondContact CB-OE1 3.26Å; P385-E387 WeakPolarHBondContact CB-OE2 3.46Å; P385-E387 PolarHBondContact O-N 3.32Å; P385-M388 HydrophobicContact CG-CE 3.92Å; P385-M388 HydrophobicContact CG-CG 4.2Å; P385-M388 HydrophobicContact CG-SD 4.25Å; P385-M388 PolarHBondContact O-N 3.38Å; P385-M388 VanDerWaalsContact O-N 3.11Å
386	P	94.8	Very high	97	Very high	85 Å²	85	60.2 Å²	60.2	55%	0.552	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-61.4	-29.1	-175.9	25.4	-34.4	0	0	0	112.5	M388 F389 I392	P386-M388 PolarHBondContact O-N 3.36Å; P386-F389 PolarHBondContact O-N 2.75Å; P386-I392 HydrophobicContact CB-CD1 4.07Å
387	E	94.1	Very high	96.9	Very high	139 Å²	139	61.4 Å²	61.4	65%	0.65	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-71.3	6.5	177	75.7	-80.2	-172.6	0	0	114.9	P385	P385-E387 HydrophobicContact CB-CG 4.5Å; P385-E387 VanDerWaalsContact CB-OE1 3.23Å; P385-E387 WeakPolarHBondContact CB-OE1 3.26Å; P385-E387 WeakPolarHBondContact CB-OE2 3.46Å; P385-E387 PolarHBondContact O-N 3.32Å
388	M	95.3	Very high	96.8	Very high	65 Å²	65	64.4 Å²	64.4	32%	0.32	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-94.9	-2.3	164.6	-62.8	-162.3	-56.3	0	0	113.7	P333 C384 P385 P386	P333-M388 HydrophobicContact CB-CB 4.23Å; P333-M388 WeakPolarHBondContact CB-O 3.28Å; P333-M388 HydrophobicContact CG-CB 3.96Å; P333-M388 HydrophobicContact CG-CE 4.08Å; C384-M388 HydrophobicContact CB-CE 3.44Å; C384-M388 VanDerWaalsContact CB-CE 3.44Å; C384-M388 VanDerWaalsContact SG-CE 3.57Å; P385-M388 HydrophobicContact CG-CE 3.92Å; P385-M388 HydrophobicContact CG-CG 4.2Å; P385-M388 HydrophobicContact CG-SD 4.25Å; P385-M388 PolarHBondContact O-N 3.38Å; P385-M388 VanDerWaalsContact O-N 3.11Å; P386-M388 PolarHBondContact O-N 3.36Å
389	F	97.7	Very high	96.8	Very high	21 Å²	21	69.7 Å²	69.7	9%	0.092	36%	0.364	C	S	.	.			trans	-116.2	145.7	175.9	-51.6	-68.1	0	0	0	109.8	V239 P333 I345 Y347 L381 C384 P386 I392	V239-F389 HydrophobicContact CG2-CD1 4.45Å; V239-F389 HydrophobicContact CG2-CE1 4.1Å; P333-F389 HydrophobicContact CG-CD1 4.25Å; P333-F389 HydrophobicContact CG-CE1 3.72Å; P333-F389 HydrophobicContact CG-CZ 4.24Å; I345-F389 HydrophobicContact CG2-CD1 3.77Å; I345-F389 HydrophobicContact CG2-CE1 4.41Å; Y347-F389 HydrophobicContact CD1-CD1 4.33Å; Y347-F389 AromaticContact CD1-CD2 3.91Å; Y347-F389 HydrophobicContact CD1-CD2 3.91Å; Y347-F389 HydrophobicContact CD1-CE1 4.01Å; Y347-F389 AromaticContact CD1-CE2 3.57Å; Y347-F389 HydrophobicContact CD1-CE2 3.57Å; Y347-F389 HydrophobicContact CD1-CG 4.26Å; Y347-F389 AromaticContact CD1-CZ 3.62Å; Y347-F389 HydrophobicContact CD1-CZ 3.62Å; Y347-F389 HydrophobicContact CE1-CE2 4.06Å; Y347-F389 HydrophobicContact CE1-CZ 4.09Å; Y347-F389 HydrophobicContact CG-CD1 4.19Å; Y347-F389 AromaticContact CG-CE1 3.92Å; Y347-F389 HydrophobicContact CG-CE1 3.92Å; Y347-F389 HydrophobicContact CG-CE2 4.32Å; Y347-F389 HydrophobicContact CG-CG 4.47Å; Y347-F389 AromaticContact CG-CZ 3.98Å; Y347-F389 HydrophobicContact CG-CZ 3.98Å; L381-F389 HydrophobicContact CD2-CE1 4.18Å; L381-F389 HydrophobicContact CD2-CZ 4.16Å; C384-F389 HydrophobicContact CB-CE2 3.51Å; C384-F389 HydrophobicContact CB-CZ 3.47Å; C384-F389 VanDerWaalsContact CB-CZ 3.47Å; P386-F389 PolarHBondContact O-N 2.75Å; F389-I392 HydrophobicContact CB-CD1 4.35Å; F389-I392 HydrophobicContact CB-CG1 3.88Å; F389-I392 HydrophobicContact CD2-CD1 4.02Å; F389-I392 HydrophobicContact CD2-CG1 4.22Å; F389-I392 HydrophobicContact CG-CG1 4.32Å
390	D	97.8	Very high	96.8	Very high	50 Å²	50	70.4 Å²	70.4	27%	0.267	37%	0.368	S	S	.	.	S	Bend	trans	-90.1	-33.9	174.9	-71.5	-90.2	0	0	0	111.7	R234 I344 I345 Y408	R234-D390 IonicContact CZ-OD1 2.64Å; R234-D390 IonicContact CZ-OD2 3.79Å; R234-D390 IonicContact NH1-OD1 2.68Å; R234-D390 PolarHBondContact NH1-OD1 3.38Å; R234-D390 IonicContact NH2-OD1 2.62Å; R234-D390 PolarHBondContact NH2-OD1 2.97Å; R234-D390 IonicContact NH2-OD2 3.26Å; R234-D390 PolarHBondContact NH2-OD2 3.15Å; I344-D390 WeakPolarHBondContact CA-OD2 3.47Å; I344-D390 HydrophobicContact CG2-CB 3.83Å; I345-D390 PolarHBondContact N-OD2 3.07Å; I345-D390 PolarHBondContact O-N 2.7Å; D390-Y408 WeakPolarHBondContact O-CE2 3.41Å
391	V	98.3	Very high	96.9	Very high	5 Å²	5	65.1 Å²	65.1	3%	0.03	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138	176.8	-172.1	0	0	0	0	108.2	I345 V346 Y347 L393 Y408	I345-V391 PolarHBondContact O-N 2.94Å; V346-V391 HydrophobicContact CG1-CB 4.31Å; V346-V391 HydrophobicContact CG2-CB 4.22Å; V346-V391 HydrophobicContact CG2-CG2 4.33Å; Y347-V391 PolarHBondContact N-O 2.9Å; V391-L393 HydrophobicContact CG1-CD2 3.7Å; V391-L393 HydrophobicContact CG1-CG 4.13Å; V391-Y408 HydrophobicContact CG2-CD1 3.47Å; V391-Y408 VanDerWaalsContact CG2-CD1 3.47Å; V391-Y408 HydrophobicContact CG2-CD2 3.61Å; V391-Y408 HydrophobicContact CG2-CE1 3.75Å; V391-Y408 HydrophobicContact CG2-CE2 3.84Å; V391-Y408 HydrophobicContact CG2-CG 3.42Å; V391-Y408 VanDerWaalsContact CG2-CG 3.42Å
392	I	98.4	Very high	96.9	Very high	49 Å²	49	65.2 Å²	65.2	25%	0.251	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	116.7	171.4	-57.2	177.5	0	0	0	106.8	Y347 K349 P386 F389 H404	Y347-I392 HydrophobicContact CD1-CG1 4.4Å; Y347-I392 HydrophobicContact CD1-CG2 4.11Å; K349-I392 HydrophobicContact CB-CG2 4.08Å; K349-I392 HydrophobicContact CD-CG2 3.64Å; P386-I392 HydrophobicContact CB-CD1 4.07Å; F389-I392 HydrophobicContact CB-CD1 4.35Å; F389-I392 HydrophobicContact CB-CG1 3.88Å; F389-I392 HydrophobicContact CD2-CD1 4.02Å; F389-I392 HydrophobicContact CD2-CG1 4.22Å; F389-I392 HydrophobicContact CG-CG1 4.32Å; I392-H404 PolarHBondContact O-CE1 2.95Å; I392-H404 VanDerWaalsContact O-CE1 3.28Å
393	L	98.3	Very high	97	Very high	5 Å²	5	68 Å²	68	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	104.1	177.5	-57.5	178.3	0	0	0	107.8	L256 V346 Y347 K349 V391 E395 A401 H404 L405	L256-L393 HydrophobicContact CD1-CD1 4.23Å; V346-L393 HydrophobicContact CG1-CD1 3.67Å; V346-L393 HydrophobicContact CG1-CG 4.04Å; Y347-L393 PolarHBondContact O-N 3.4Å; K349-L393 PolarHBondContact N-O 2.79Å; V391-L393 HydrophobicContact CG1-CD2 3.7Å; V391-L393 HydrophobicContact CG1-CG 4.13Å; L393-E395 VanDerWaalsContact C-OE2 3.22Å; L393-E395 WeakPolarHBondContact CA-OE2 3.08Å; L393-E395 WeakPolarHBondContact CB-OE2 3.45Å; L393-A401 HydrophobicContact CB-CB 4.42Å; L393-A401 HydrophobicContact CD1-CB 4.49Å; L393-H404 HydrophobicContact CD2-CB 4.1Å; L393-L405 HydrophobicContact CD1-CB 4.18Å; L393-L405 HydrophobicContact CD1-CD2 4.2Å; L393-L405 HydrophobicContact CD2-CB 4.23Å
394	D	97.1	Very high	97.1	Very high	74 Å²	74	64.7 Å²	64.7	40%	0.396	33%	0.333	S	S	.	.			trans	-123.9	18.6	177.8	87.7	-29.3	0	0	0	114.6	K349 S351	K349-D394 HydrophobicContact CB-CB 3.92Å; K349-D394 HydrophobicContact CD-CB 3.77Å; K349-D394 HydrophobicContact CG-CB 3.92Å; K349-D394 IonicContact NZ-OD2 2.94Å; K349-D394 PolarHBondContact NZ-OD2 3.28Å; K349-D394 WeakPolarHBondContact O-CA 3.43Å; S351-D394 PolarHBondContact OG-OD2 3.41Å
395	E	97.6	Very high	97.1	Very high	57 Å²	57	64 Å²	64	27%	0.266	33%	0.328	S	S	.	.			trans	-64.8	162.3	168.5	-47.7	72.3	-156.5	0	0	111	L393 D400 A401 H404	L393-E395 VanDerWaalsContact C-OE2 3.22Å; L393-E395 WeakPolarHBondContact CA-OE2 3.08Å; L393-E395 WeakPolarHBondContact CB-OE2 3.45Å; E395-D400 HydrophobicContact CB-CB 3.77Å; E395-D400 HydrophobicContact CG-CB 3.86Å; E395-A401 HydrophobicContact CB-CB 4.24Å; E395-A401 WeakPolarHBondContact OE2-CB 3.27Å; E395-H404 IonicContact OE1-CE1 3.89Å; E395-H404 IonicContact OE1-CG 3.53Å; E395-H404 IonicContact OE1-ND1 2.75Å; E395-H404 PolarHBondContact OE1-ND1 2.95Å
396	N	94.8	Very high	97.2	Very high	138 Å²	138	61.5 Å²	61.5	74%	0.738	31%	0.312	S	S	*	.	S	Bend	trans	-111.8	-14.8	-175.2	65.8	83.5	0	0	0	114.6
397	Q	96.8	Very high	97.4	Very high	101 Å²	101	62.1 Å²	62.1	47%	0.472	31%	0.311	S	S	.	.	S	Bend	trans	-96	157.2	165.3	-54	-52	-62	0	0	109.9	E399	Q397-E399 VanDerWaalsContact C-N 3.32Å
398	L	95.4	Very high	97.6	Very high	77 Å²	77	58.8 Å²	58.8	40%	0.403	29%	0.293	S	S	.	.	H	α-helix	trans	-72.8	-34.4	176.1	174.7	62.8	0	0	0	110.4	A255 L256 C402	A255-L398 HydrophobicContact CB-CD1 3.9Å; A255-L398 HydrophobicContact CB-CD2 3.95Å; L256-L398 HydrophobicContact CD2-CD1 4Å; L256-L398 HydrophobicContact CG-CD1 4.48Å; L398-C402 VanDerWaalsContact O-CB 3.25Å; L398-C402 WeakPolarHBondContact O-CB 3.47Å; L398-C402 PolarHBondContact O-N 3.49Å; L398-C402 PolarHBondContact O-SG 2.93Å
399	E	97.3	Very high	97.7	Very high	123 Å²	123	55.7 Å²	55.7	58%	0.575	28%	0.278	S	S	*	.	H	α-helix	trans	-64	-53.1	-175.6	-65.8	65.3	-150.3	0	0	110.6	Q397 A401 C402 E403	Q397-E399 VanDerWaalsContact C-N 3.32Å; E399-A401 PolarHBondContact O-N 2.97Å; E399-C402 WeakPolarHBondContact O-CB 3.39Å; E399-C402 PolarHBondContact O-N 3.36Å; E399-C402 VanDerWaalsContact O-N 3.15Å; E399-E403 PolarHBondContact O-N 3.37Å
400	D	98.3	Very high	97.7	Very high	76 Å²	76	56.4 Å²	56.4	41%	0.406	28%	0.281	S	S	.	.	H	α-helix	trans	-56.2	-47.2	176.4	-50	-16.1	0	0	0	111.8	E395 C402 E403 H404	E395-D400 HydrophobicContact CB-CB 3.77Å; E395-D400 HydrophobicContact CG-CB 3.86Å; D400-C402 VanDerWaalsContact C-N 3.33Å; D400-C402 PolarHBondContact O-N 2.88Å; D400-E403 PolarHBondContact O-N 2.9Å; D400-H404 PolarHBondContact O-N 2.95Å
401	A	98.2	Very high	97.7	Very high	11 Å²	11	56 Å²	56	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-66.4	-34.6	179	0	0	0	0	0	112.3	L393 E395 E399 L405	L393-A401 HydrophobicContact CB-CB 4.42Å; L393-A401 HydrophobicContact CD1-CB 4.49Å; E395-A401 HydrophobicContact CB-CB 4.24Å; E395-A401 WeakPolarHBondContact OE2-CB 3.27Å; E399-A401 PolarHBondContact O-N 2.97Å; A401-L405 VanDerWaalsContact O-CB 3.28Å; A401-L405 WeakPolarHBondContact O-CB 3.33Å; A401-L405 PolarHBondContact O-N 3.43Å; A401-L405 VanDerWaalsContact O-N 3.12Å
402	C	98.3	Very high	97.7	Very high	6 Å²	6	56.9 Å²	56.9	4%	0.041	29%	0.288	C	S	.	.	H	α-helix	trans	-68.7	-40.6	173.9	-76	0	0	0	0	111.9	F259 L398 E399 D400 A406	F259-C402 HydrophobicContact CD1-CB 3.65Å; F259-C402 HydrophobicContact CD2-CB 3.82Å; F259-C402 HydrophobicContact CE1-CB 3.58Å; F259-C402 WeakPolarHBondContact CE1-O 3.39Å; F259-C402 HydrophobicContact CE2-CB 3.75Å; F259-C402 HydrophobicContact CG-CB 3.76Å; F259-C402 WeakPolarHBondContact CG-SG 3.48Å; F259-C402 HydrophobicContact CZ-CB 3.62Å; F259-C402 WeakPolarHBondContact CZ-O 3.24Å; L398-C402 VanDerWaalsContact O-CB 3.25Å; L398-C402 WeakPolarHBondContact O-CB 3.47Å; L398-C402 PolarHBondContact O-N 3.49Å; L398-C402 PolarHBondContact O-SG 2.93Å; E399-C402 WeakPolarHBondContact O-CB 3.39Å; E399-C402 PolarHBondContact O-N 3.36Å; E399-C402 VanDerWaalsContact O-N 3.15Å; D400-C402 VanDerWaalsContact C-N 3.33Å; D400-C402 PolarHBondContact O-N 2.88Å; C402-A406 VanDerWaalsContact O-CB 3.27Å; C402-A406 WeakPolarHBondContact O-CB 3.24Å; C402-A406 PolarHBondContact O-N 2.65Å
403	E	98.1	Very high	97.6	Very high	130 Å²	130	56.7 Å²	56.7	61%	0.607	28%	0.284	S	S	*	.	H	α-helix	trans	-66	-50.3	177.3	-173.6	163.5	-130.9	0	0	111.4	E399 D400 L405 A406 D407	E399-E403 PolarHBondContact O-N 3.37Å; D400-E403 PolarHBondContact O-N 2.9Å; E403-L405 VanDerWaalsContact C-N 3.33Å; E403-L405 PolarHBondContact O-N 3.3Å; E403-A406 PolarHBondContact O-N 2.71Å; E403-A406 VanDerWaalsContact O-N 3.07Å; E403-D407 PolarHBondContact O-N 2.99Å
404	H	98.6	Very high	97.4	Very high	78 Å²	78	61.7 Å²	61.7	36%	0.361	31%	0.306	S	S	.	.	H	α-helix	trans	-55.5	-45.4	174.9	179.3	-171.1	0	0	0	112	I392 L393 E395 D400 Y408	I392-H404 PolarHBondContact O-CE1 2.95Å; I392-H404 VanDerWaalsContact O-CE1 3.28Å; L393-H404 HydrophobicContact CD2-CB 4.1Å; E395-H404 IonicContact OE1-CE1 3.89Å; E395-H404 IonicContact OE1-CG 3.53Å; E395-H404 IonicContact OE1-ND1 2.75Å; E395-H404 PolarHBondContact OE1-ND1 2.95Å; D400-H404 PolarHBondContact O-N 2.95Å; H404-Y408 PolarHBondContact O-N 3.48Å; H404-Y408 VanDerWaalsContact O-N 3.16Å
405	L	98.4	Very high	97.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-37.5	176.6	-176.5	57.8	0	0	0	112.6	L260 V346 L393 A401 E403 L409	L260-L405 HydrophobicContact CD1-CD2 4.05Å; L260-L405 HydrophobicContact CD2-CD2 4.12Å; L260-L405 HydrophobicContact CD2-CG 4.25Å; L260-L405 HydrophobicContact CG-CD2 4.25Å; V346-L405 HydrophobicContact CG1-CD1 3.99Å; V346-L405 HydrophobicContact CG2-CD1 3.72Å; L393-L405 HydrophobicContact CD1-CB 4.18Å; L393-L405 HydrophobicContact CD1-CD2 4.2Å; L393-L405 HydrophobicContact CD2-CB 4.23Å; A401-L405 VanDerWaalsContact O-CB 3.28Å; A401-L405 WeakPolarHBondContact O-CB 3.33Å; A401-L405 PolarHBondContact O-N 3.43Å; A401-L405 VanDerWaalsContact O-N 3.12Å; E403-L405 VanDerWaalsContact C-N 3.33Å; E403-L405 PolarHBondContact O-N 3.3Å; L405-L409 HydrophobicContact CD1-CD1 4.09Å; L405-L409 HydrophobicContact CD1-CG 4.34Å; L405-L409 HydrophobicContact CG-CD1 4.13Å; L405-L409 WeakPolarHBondContact O-CB 3.49Å; L405-L409 VanDerWaalsContact O-CG 3.29Å; L405-L409 WeakPolarHBondContact O-CG 3.32Å; L405-L409 PolarHBondContact O-N 2.73Å; L405-L409 VanDerWaalsContact O-N 3.16Å
406	A	98.2	Very high	97.3	Very high	2 Å²	2	56 Å²	56	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-67.4	-43.5	177.6	0	0	0	0	0	112	F259 R263 F264 C402 E403 L409 E410	F259-A406 HydrophobicContact CE1-CB 4.04Å; F259-A406 HydrophobicContact CZ-CB 4Å; R263-A406 HydrophobicContact CG-CB 4.15Å; F264-A406 HydrophobicContact CE2-CB 4.16Å; F264-A406 HydrophobicContact CZ-CB 4.13Å; C402-A406 VanDerWaalsContact O-CB 3.27Å; C402-A406 WeakPolarHBondContact O-CB 3.24Å; C402-A406 PolarHBondContact O-N 2.65Å; E403-A406 PolarHBondContact O-N 2.71Å; E403-A406 VanDerWaalsContact O-N 3.07Å; A406-L409 PolarHBondContact O-N 2.89Å; A406-E410 WeakPolarHBondContact O-CB 3.49Å; A406-E410 PolarHBondContact O-N 2.79Å
407	D	98.3	Very high	97.3	Very high	97 Å²	97	51.1 Å²	51.1	52%	0.519	25%	0.251	S	S	.	.	H	α-helix	trans	-65.4	-41.2	179.9	-88.1	1.4	0	0	0	112	E403 L409 E410 A411	E403-D407 PolarHBondContact O-N 2.99Å; D407-L409 VanDerWaalsContact C-N 3.35Å; D407-L409 PolarHBondContact O-N 3.45Å; D407-E410 PolarHBondContact O-N 3Å; D407-A411 WeakPolarHBondContact O-CB 3.32Å; D407-A411 PolarHBondContact O-N 3.35Å
408	Y	98.5	Very high	96.8	Very high	69 Å²	69	47.1 Å²	47.1	27%	0.271	23%	0.234	S	C	.	.	H	α-helix	trans	-59.3	-45.6	172.1	-177.1	-83.8	0	0	0	111.7	I344 D390 V391 H404 A411 Y412	I344-Y408 HydrophobicContact CD1-CE1 4.34Å; I344-Y408 HydrophobicContact CG2-CE1 3.92Å; D390-Y408 WeakPolarHBondContact O-CE2 3.41Å; V391-Y408 HydrophobicContact CG2-CD1 3.47Å; V391-Y408 VanDerWaalsContact CG2-CD1 3.47Å; V391-Y408 HydrophobicContact CG2-CD2 3.61Å; V391-Y408 HydrophobicContact CG2-CE1 3.75Å; V391-Y408 HydrophobicContact CG2-CE2 3.84Å; V391-Y408 HydrophobicContact CG2-CG 3.42Å; V391-Y408 VanDerWaalsContact CG2-CG 3.42Å; H404-Y408 PolarHBondContact O-N 3.48Å; H404-Y408 VanDerWaalsContact O-N 3.16Å; Y408-A411 PolarHBondContact O-N 3.19Å; Y408-Y412 WeakPolarHBondContact O-CB 3.37Å; Y408-Y412 PolarHBondContact O-N 3.33Å
409	L	98.3	Very high	96	Very high	1 Å²	1	49 Å²	49	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-72.1	-28.8	-179.1	-69	174.4	0	0	0	113	V236 L260 F264 I344 L405 A406 D407 Y412 W413	V236-L409 HydrophobicContact CG2-CD2 3.75Å; L260-L409 HydrophobicContact CD2-CD1 3.59Å; F264-L409 HydrophobicContact CE1-CB 4.37Å; F264-L409 HydrophobicContact CE2-CB 4.32Å; F264-L409 HydrophobicContact CE2-CD1 4.33Å; F264-L409 HydrophobicContact CZ-CB 3.83Å; I344-L409 HydrophobicContact CD1-CD2 4.42Å; L405-L409 HydrophobicContact CD1-CD1 4.09Å; L405-L409 HydrophobicContact CD1-CG 4.34Å; L405-L409 HydrophobicContact CG-CD1 4.13Å; L405-L409 WeakPolarHBondContact O-CB 3.49Å; L405-L409 VanDerWaalsContact O-CG 3.29Å; L405-L409 WeakPolarHBondContact O-CG 3.32Å; L405-L409 PolarHBondContact O-N 2.73Å; L405-L409 VanDerWaalsContact O-N 3.16Å; A406-L409 PolarHBondContact O-N 2.89Å; D407-L409 VanDerWaalsContact C-N 3.35Å; D407-L409 PolarHBondContact O-N 3.45Å; L409-Y412 PolarHBondContact O-N 2.94Å; L409-W413 WeakPolarHBondContact O-CB 3.42Å; L409-W413 PolarHBondContact O-N 3.39Å
410	E	97.6	Very high	94.5	Very high	36 Å²	36	45.8 Å²	45.8	17%	0.168	24%	0.242	C	C	.	.	H	α-helix	trans	-75.4	-35.2	173.9	-161.3	70	-110.5	0	0	111.5	R263 R267 A406 D407 W413 K414	R263-E410 IonicContact NH1-OE2 2.78Å; R263-E410 PolarHBondContact NH1-OE2 2.86Å; R267-E410 IonicContact CZ-OE1 3.35Å; R267-E410 IonicContact CZ-OE2 2.87Å; R267-E410 IonicContact NH1-OE1 3.61Å; R267-E410 PolarHBondContact NH1-OE1 2.89Å; R267-E410 IonicContact NH1-OE2 2.69Å; R267-E410 IonicContact NH2-OE1 3.72Å; R267-E410 PolarHBondContact NH2-OE1 3.23Å; R267-E410 IonicContact NH2-OE2 3.61Å; R267-E410 PolarHBondContact NH2-OE2 3.03Å; A406-E410 WeakPolarHBondContact O-CB 3.49Å; A406-E410 PolarHBondContact O-N 2.79Å; D407-E410 PolarHBondContact O-N 3Å; E410-W413 WeakPolarHBondContact O-CB 3.43Å; E410-W413 PolarHBondContact O-N 2.59Å; E410-K414 VanDerWaalsContact O-CG 3.3Å; E410-K414 WeakPolarHBondContact O-CG 3.46Å; E410-K414 PolarHBondContact O-N 2.82Å
411	A	97	Very high	92.6	Very high	41 Å²	41	43.8 Å²	43.8	34%	0.339	23%	0.234	S	C	.	.	H	α-helix	trans	-64.7	-42.6	167.5	0	0	0	0	0	111.6	D407 Y408 W413 K414 A415	D407-A411 WeakPolarHBondContact O-CB 3.32Å; D407-A411 PolarHBondContact O-N 3.35Å; Y408-A411 PolarHBondContact O-N 3.19Å; A411-W413 VanDerWaalsContact C-N 3.31Å; A411-W413 PolarHBondContact O-N 3.09Å; A411-K414 PolarHBondContact O-N 2.88Å; A411-A415 WeakPolarHBondContact O-CB 3.23Å; A411-A415 PolarHBondContact O-N 3.42Å
412	Y	97.8	Very high	90.2	Very high	23 Å²	23	48.7 Å²	48.7	9%	0.09	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-36.3	173.1	-177	-116.8	0	0	0	112.4	V116 M233 R234 L322 I344 Y408 L409 A415 T416	V116-Y412 HydrophobicContact CG1-CE2 4.27Å; M233-Y412 HydrophobicContact CE-CD1 4.31Å; M233-Y412 HydrophobicContact CE-CE1 3.77Å; M233-Y412 HydrophobicContact SD-CE1 4.4Å; R234-Y412 WeakPolarHBondContact CG-OH 3.45Å; R234-Y412 PolarHBondContact N-OH 3.08Å; L322-Y412 HydrophobicContact CD2-CD1 4.1Å; I344-Y412 HydrophobicContact CD1-CD1 3.63Å; I344-Y412 HydrophobicContact CD1-CD2 4.37Å; I344-Y412 HydrophobicContact CD1-CE1 3.69Å; I344-Y412 HydrophobicContact CD1-CE2 4.45Å; I344-Y412 HydrophobicContact CD1-CG 4Å; Y408-Y412 WeakPolarHBondContact O-CB 3.37Å; Y408-Y412 PolarHBondContact O-N 3.33Å; L409-Y412 PolarHBondContact O-N 2.94Å; Y412-A415 PolarHBondContact O-N 3.07Å; Y412-T416 HydrophobicContact CD2-CG2 4.24Å; Y412-T416 HydrophobicContact CE1-CG2 4.15Å; Y412-T416 HydrophobicContact CE2-CG2 3.67Å; Y412-T416 WeakPolarHBondContact O-CB 3.44Å; Y412-T416 WeakPolarHBondContact O-CG2 3.32Å; Y412-T416 PolarHBondContact O-N 2.88Å; Y412-T416 PolarHBondContact O-OG1 2.78Å
413	W	96.7	Very high	87.6	Confident	45 Å²	45	52.6 Å²	52.6	17%	0.17	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-47.6	173.7	-174.9	-94.5	0	0	0	111.9	M233 R267 L320 L322 L409 E410 A411 T416 H417	M233-W413 HydrophobicContact CE-CE3 4.33Å; M233-W413 HydrophobicContact CE-CZ3 4.49Å; R267-W413 HydrophobicContact CB-CH2 3.92Å; R267-W413 HydrophobicContact CB-CZ2 4.42Å; R267-W413 HydrophobicContact CB-CZ3 4.04Å; R267-W413 HydrophobicContact CG-CH2 4.03Å; R267-W413 HydrophobicContact CG-CZ2 4.09Å; R267-W413 VanDerWaalsContact NH1-CD1 3.29Å; L320-W413 WeakPolarHBondContact O-CZ3 3.24Å; L322-W413 HydrophobicContact CD1-CE3 4.33Å; L322-W413 HydrophobicContact CD2-CE3 4.21Å; L322-W413 HydrophobicContact CG-CE3 3.84Å; L322-W413 HydrophobicContact CG-CZ3 4.1Å; L409-W413 WeakPolarHBondContact O-CB 3.42Å; L409-W413 PolarHBondContact O-N 3.39Å; E410-W413 WeakPolarHBondContact O-CB 3.43Å; E410-W413 PolarHBondContact O-N 2.59Å; A411-W413 VanDerWaalsContact C-N 3.31Å; A411-W413 PolarHBondContact O-N 3.09Å; W413-T416 WeakPolarHBondContact CA-OG1 3.37Å; W413-T416 PolarHBondContact O-N 3.03Å; W413-T416 PolarHBondContact O-OG1 3.23Å; W413-H417 AromaticContact CD2-CE1 3.69Å; W413-H417 AromaticContact CD2-ND1 3.58Å; W413-H417 AromaticContact CE2-CE1 3.65Å; W413-H417 AromaticContact CE2-CG 3.97Å; W413-H417 AromaticContact CE2-ND1 3.58Å; W413-H417 AromaticContact CE3-CE1 3.59Å; W413-H417 AromaticContact CE3-ND1 3.91Å; W413-H417 AromaticContact CG-ND1 3.99Å; W413-H417 AromaticContact CH2-CE1 3.46Å; W413-H417 VanDerWaalsContact CH2-CE1 3.46Å; W413-H417 WeakPolarHBondContact CH2-CE1 3.39Å; W413-H417 AromaticContact CH2-NE2 3.6Å; W413-H417 AromaticContact CZ2-CE1 3.55Å; W413-H417 AromaticContact CZ2-ND1 3.92Å; W413-H417 AromaticContact CZ2-NE2 3.6Å; W413-H417 AromaticContact CZ3-CE1 3.48Å; W413-H417 VanDerWaalsContact CZ3-CE1 3.48Å; W413-H417 WeakPolarHBondContact CZ3-CE1 3.26Å; W413-H417 AromaticContact NE1-ND1 3.98Å; W413-H417 WeakPolarHBondContact O-CB 3.28Å; W413-H417 PolarHBondContact O-N 3.07Å; W413-H417 PolarHBondContact O-ND1 2.97Å
414	K	95.4	Very high	84.9	Confident	111 Å²	111	51.7 Å²	51.7	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-41.7	174.4	-66.4	160.7	-171.4	166.2	0	112.3	E118 E410 A411 T416 H417	E118-K414 HydrophobicContact CG-CB 3.94Å; E118-K414 VanDerWaalsContact OE1-CB 3.24Å; E118-K414 WeakPolarHBondContact OE1-CB 3.47Å; E118-K414 WeakPolarHBondContact OE1-CD 3.31Å; E410-K414 VanDerWaalsContact O-CG 3.3Å; E410-K414 WeakPolarHBondContact O-CG 3.46Å; E410-K414 PolarHBondContact O-N 2.82Å; A411-K414 PolarHBondContact O-N 2.88Å; K414-T416 PolarHBondContact O-N 3.27Å; K414-H417 CarbonylContact O-C 3.56Å; K414-H417 PolarHBondContact O-N 3.49Å
415	A	95.9	Very high	82	Confident	11 Å²	11	53.4 Å²	53.4	9%	0.091	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-27.2	177.3	0	0	0	0	0	113	R114 E118 A411 Y412	R114-A415 VanDerWaalsContact CZ-O 3.31Å; R114-A415 PolarHBondContact NH1-O 3.22Å; R114-A415 PolarHBondContact NH2-O 3.34Å; E118-A415 HydrophobicContact CG-CB 4.22Å; A411-A415 WeakPolarHBondContact O-CB 3.23Å; A411-A415 PolarHBondContact O-N 3.42Å; Y412-A415 PolarHBondContact O-N 3.07Å
416	T	95.8	Very high	79.4	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	34%	0.335	C	S	.	.	H	α-helix	trans	-92.6	-28.7	177.5	47.1	0	0	0	0	113.6	V116 M233 Y412 W413 K414 P418	V116-T416 HydrophobicContact CG1-CG2 3.49Å; V116-T416 VanDerWaalsContact CG1-CG2 3.49Å; M233-T416 HydrophobicContact CE-CG2 4.1Å; M233-T416 HydrophobicContact SD-CG2 3.55Å; M233-T416 VanDerWaalsContact SD-CG2 3.55Å; Y412-T416 HydrophobicContact CD2-CG2 4.24Å; Y412-T416 HydrophobicContact CE1-CG2 4.15Å; Y412-T416 HydrophobicContact CE2-CG2 3.67Å; Y412-T416 WeakPolarHBondContact O-CB 3.44Å; Y412-T416 WeakPolarHBondContact O-CG2 3.32Å; Y412-T416 PolarHBondContact O-N 2.88Å; Y412-T416 PolarHBondContact O-OG1 2.78Å; W413-T416 WeakPolarHBondContact CA-OG1 3.37Å; W413-T416 PolarHBondContact O-N 3.03Å; W413-T416 PolarHBondContact O-OG1 3.23Å; K414-T416 PolarHBondContact O-N 3.27Å; T416-P418 WeakPolarHBondContact O-CD 3.45Å
417	H	94.1	Very high	76.8	Confident	35 Å²	35	67.3 Å²	67.3	16%	0.162	37%	0.369	C	S	.	.	S	Bend	trans	-112.7	80.1	-177.7	-62.5	80.5	0	0	0	112.1	L320 W413 K414	L320-H417 WeakPolarHBondContact CB-NE2 3.32Å; L320-H417 PolarHBondContact O-CE1 3.49Å; L320-H417 PolarHBondContact O-NE2 2.78Å; W413-H417 AromaticContact CD2-CE1 3.69Å; W413-H417 AromaticContact CD2-ND1 3.58Å; W413-H417 AromaticContact CE2-CE1 3.65Å; W413-H417 AromaticContact CE2-CG 3.97Å; W413-H417 AromaticContact CE2-ND1 3.58Å; W413-H417 AromaticContact CE3-CE1 3.59Å; W413-H417 AromaticContact CE3-ND1 3.91Å; W413-H417 AromaticContact CG-ND1 3.99Å; W413-H417 AromaticContact CH2-CE1 3.46Å; W413-H417 VanDerWaalsContact CH2-CE1 3.46Å; W413-H417 WeakPolarHBondContact CH2-CE1 3.39Å; W413-H417 AromaticContact CH2-NE2 3.6Å; W413-H417 AromaticContact CZ2-CE1 3.55Å; W413-H417 AromaticContact CZ2-ND1 3.92Å; W413-H417 AromaticContact CZ2-NE2 3.6Å; W413-H417 AromaticContact CZ3-CE1 3.48Å; W413-H417 VanDerWaalsContact CZ3-CE1 3.48Å; W413-H417 WeakPolarHBondContact CZ3-CE1 3.26Å; W413-H417 AromaticContact NE1-ND1 3.98Å; W413-H417 WeakPolarHBondContact O-CB 3.28Å; W413-H417 PolarHBondContact O-N 3.07Å; W413-H417 PolarHBondContact O-ND1 2.97Å; K414-H417 CarbonylContact O-C 3.56Å; K414-H417 PolarHBondContact O-N 3.49Å
418	P	87.4	Confident	74.5	Confident	16 Å²	16	68.8 Å²	68.8	10%	0.104	38%	0.376	C	S	.	.			trans	-63.8	145	178.1	28.9	-35.8	0	0	0	111	T416 S420 S421	T416-P418 WeakPolarHBondContact O-CD 3.45Å; P418-S420 PolarHBondContact O-N 2.99Å; P418-S421 PolarHBondContact O-N 3.43Å; P418-S421 PolarHBondContact O-OG 3.32Å
419	P	78.9	Confident	71.8	Confident	118 Å²	118	69.5 Å²	69.5	77%	0.766	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-54.1	-34	-177.6	-28.5	35.5	0	0	0	114.1	S421 N422	P419-S421 PolarHBondContact O-N 2.92Å; P419-N422 PolarHBondContact O-N 3.3Å; P419-N422 VanDerWaalsContact O-N 3.12Å
420	S	65.9	Low	69.2	Low	55 Å²	55	78.8 Å²	78.8	39%	0.385	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-67.1	-11.9	178.6	51.8	0	0	0	0	115.5	P418	P418-S420 PolarHBondContact O-N 2.99Å
421	S	58.4	Low	66.6	Low	34 Å²	34	82.1 Å²	82.1	24%	0.238	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-85	-14.4	170.9	59	0	0	0	0	114	P418 P419 P423	P418-S421 PolarHBondContact O-N 3.43Å; P418-S421 PolarHBondContact O-OG 3.32Å; P419-S421 PolarHBondContact O-N 2.92Å; S421-P423 VanDerWaalsContact O-CD 3.27Å; S421-P423 WeakPolarHBondContact O-CD 3.32Å
422	N	47.1	Very low	64.2	Low	114 Å²	114	86.6 Å²	86.6	61%	0.61	46%	0.464	S	S	*	.	S	Bend	trans	-103.8	95.5	174.9	-78.4	-25.7	0	0	0	110	P419	P419-N422 PolarHBondContact O-N 3.3Å; P419-N422 VanDerWaalsContact O-N 3.12Å
423	P	42.4	Very low	61.5	Low	88 Å²	88	89 Å²	89	57%	0.571	49%	0.489	S	S	*	.			trans	-60.8	134.7	166.5	27.1	-33.4	0	0	0	109	S421 N425	S421-P423 VanDerWaalsContact O-CD 3.27Å; S421-P423 WeakPolarHBondContact O-CD 3.32Å; P423-N425 PolarHBondContact O-N 2.89Å
424	P	41.5	Very low	58.8	Low	110 Å²	110	92.2 Å²	92.2	71%	0.714	51%	0.513	S	S	*	.			trans	-59.5	139.7	177.4	24.5	-33.4	0	0	0	110.3	Q426	P424-Q426 PolarHBondContact O-N 3.36Å
425	N	38.9	Very low	56.2	Low	114 Å²	114	90.8 Å²	90.8	61%	0.61	52%	0.522	S	S	*	.			trans	-51.4	106.4	-170.2	-115.8	-38.8	0	0	0	112.3	P423 L427 L428	P423-N425 PolarHBondContact O-N 2.89Å; N425-L427 PolarHBondContact O-N 3.44Å; N425-L428 HydrophobicContact CB-CD1 4.5Å; N425-L428 PolarHBondContact O-N 3.41Å
426	Q	43.3	Very low	53.5	Low	155 Å²	155	95.7 Å²	95.7	72%	0.724	55%	0.551	S	S	*	*	H	α-helix	trans	-60.7	-19.1	-176.5	-63.9	-173.3	7.6	0	0	113.2	P424 L428 T429 R430	P424-Q426 PolarHBondContact O-N 3.36Å; Q426-L428 VanDerWaalsContact C-N 3.3Å; Q426-L428 PolarHBondContact O-N 2.92Å; Q426-T429 PolarHBondContact O-N 3.14Å; Q426-R430 PolarHBondContact O-N 3.23Å; Q426-R430 VanDerWaalsContact O-N 3.14Å
427	L	44.4	Very low	50.7	Low	139 Å²	139	103.3 Å²	103.3	73%	0.728	59%	0.591	S	S	*	*	H	α-helix	trans	-61.8	-30.9	172.3	-70.9	168.8	0	0	0	113.5	N425 T431	N425-L427 PolarHBondContact O-N 3.44Å; L427-T431 PolarHBondContact O-OG1 3.32Å
428	L	49.2	Very low	47.9	Very low	128 Å²	128	107.5 Å²	107.5	67%	0.67	62%	0.621	S	S	*	*	H	α-helix	trans	-80.6	-42	176.2	-69.9	170.8	0	0	0	111.4	N425 Q426 R430 T431	N425-L428 HydrophobicContact CB-CD1 4.5Å; N425-L428 PolarHBondContact O-N 3.41Å; Q426-L428 VanDerWaalsContact C-N 3.3Å; Q426-L428 PolarHBondContact O-N 2.92Å; L428-R430 VanDerWaalsContact C-N 3.31Å; L428-R430 PolarHBondContact O-N 3.31Å; L428-T431 PolarHBondContact O-N 3.35Å
429	T	41.7	Very low	45.3	Very low	85 Å²	85	114.7 Å²	114.7	52%	0.521	66%	0.657	S	S	.	*	H	α-helix	trans	-64.6	-34.6	-178.6	-35.3	0	0	0	0	112.3	Q426 T431 L432 A433	Q426-T429 PolarHBondContact O-N 3.14Å; T429-T431 VanDerWaalsContact C-N 3.3Å; T429-T431 PolarHBondContact O-N 2.92Å; T429-L432 PolarHBondContact O-N 3.09Å; T429-A433 WeakPolarHBondContact O-CB 3.38Å; T429-A433 PolarHBondContact O-N 2.83Å
430	R	44.2	Very low	43.2	Very low	195 Å²	195	113.9 Å²	113.9	74%	0.736	65%	0.654	S	S	*	*	H	α-helix	trans	-63.3	-34.5	178	-171.4	172.3	-179.7	171.6	-0.4	112.9	Q426 L428 T434	Q426-R430 PolarHBondContact O-N 3.23Å; Q426-R430 VanDerWaalsContact O-N 3.14Å; L428-R430 VanDerWaalsContact C-N 3.31Å; L428-R430 PolarHBondContact O-N 3.31Å; R430-T434 PolarHBondContact O-N 2.85Å; R430-T434 PolarHBondContact O-OG1 3.38Å
431	T	43.3	Very low	41.9	Very low	106 Å²	106	117.6 Å²	117.6	65%	0.65	68%	0.677	S	S	*	*	H	α-helix	trans	-67.6	-40.4	178.3	-50.4	0	0	0	0	111.5	L427 L428 T429	L427-T431 PolarHBondContact O-OG1 3.32Å; L428-T431 PolarHBondContact O-N 3.35Å; T429-T431 VanDerWaalsContact C-N 3.3Å; T429-T431 PolarHBondContact O-N 2.92Å
432	L	46.8	Very low	40.4	Very low	136 Å²	136	119.5 Å²	119.5	71%	0.712	70%	0.702	S	S	*	*	H	α-helix	trans	-76.2	-37.3	177.6	-69.8	169.1	0	0	0	112.7	T429 T434 A435	T429-L432 PolarHBondContact O-N 3.09Å; L432-T434 PolarHBondContact O-N 3.45Å; L432-T434 VanDerWaalsContact O-N 3.13Å; L432-A435 PolarHBondContact O-N 3.46Å
433	A	41.2	Very low	39.5	Very low	74 Å²	74	119.5 Å²	119.5	61%	0.612	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-6.7	178.9	0	0	0	0	0	114.5	T429	T429-A433 WeakPolarHBondContact O-CB 3.38Å; T429-A433 PolarHBondContact O-N 2.83Å
434	T	39.5	Very low	38.9	Very low	112 Å²	112	122.6 Å²	122.6	69%	0.687	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	0	176.6	-47.3	0	0	0	0	112.1	R430 L432	R430-T434 PolarHBondContact O-N 2.85Å; R430-T434 PolarHBondContact O-OG1 3.38Å; L432-T434 PolarHBondContact O-N 3.45Å; L432-T434 VanDerWaalsContact O-N 3.13Å
435	A	41.3	Very low	38.3	Very low	80 Å²	80	125.5 Å²	125.5	66%	0.661	73%	0.73	S	S	*	*	S	Bend	trans	-101.7	3.2	-174.6	0	0	0	0	0	115.3	L432	L432-A435 PolarHBondContact O-N 3.46Å
436	T	39.3	Very low	38	Very low	115 Å²	115	126.4 Å²	126.4	71%	0.706	74%	0.735	S	S	*	*			trans	-126.9	72.5	-174.6	56.1	0	0	0	0	113
437	L	36.2	Very low	37.5	Very low	161 Å²	161	127.2 Å²	127.2	84%	0.843	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-93.1	133.1	157.6	-70.9	175.8	0	0	0	109.1	I439	L437-I439 PolarHBondContact O-N 3.47Å
438	P	36.1	Very low	37	Very low	122 Å²	122	129 Å²	129	79%	0.792	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-74.3	126.2	179.7	29.5	-33.4	0	0	0	111.1
439	I	31.7	Very low	36.1	Very low	168 Å²	168	126.3 Å²	126.3	86%	0.862	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-82.5	118.3	171.5	-62.5	174.8	0	0	0	108.5	L437	L437-I439 PolarHBondContact O-N 3.47Å
440	S	34.8	Very low	35.6	Very low	100 Å²	100	126.9 Å²	126.9	70%	0.699	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-67.9	143.8	172.8	-60.2	0	0	0	0	111.5
441	P	39.1	Very low	35.1	Very low	133 Å²	133	126.9 Å²	126.9	86%	0.864	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-68.4	137.6	177	29.3	-34.7	0	0	0	111.3
442	G	27.4	Very low	34.5	Very low	74 Å²	74	125 Å²	125	76%	0.763	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-89.3	170.9	177.3	0	0	0	0	0	113.6
443	S	27.3	Very low	33.9	Very low	115 Å²	115	125 Å²	125	80%	0.804	77%	0.769	S	S	*	*			trans	-139.5	124.7	166.3	-82.9	0	0	0	0	109.7
444	N	28.8	Very low	33.5	Very low	152 Å²	152	127.5 Å²	127.5	81%	0.813	77%	0.768	S	S	*	*			trans	38.8	123.8	158	-57.2	-17.7	0	0	0	119.6
445	I	30.5	Very low	33.2	Very low	171 Å²	171	131.4 Å²	131.4	88%	0.877	77%	0.77	S	S	*	*				-153	146.9	99.7	-95.5	148	0	0	0	110
446	N	31.2	Very low	32.6	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	77%	0.772	S	S	*	*			trans	-70.6	142.2	-177.8	179.8	28.4	0	0	0	112.9
447	L	33.8	Very low	32.1	Very low	172 Å²	172	133.9 Å²	133.9	90%	0.901	77%	0.768	S	S	*	*			trans	-162.2	158.7	143.2	-109.1	166	0	0	0	110.5
448	Q	33	Very low	31.9	Very low	177 Å²	177	134.5 Å²	134.5	83%	0.827	77%	0.766	S	S	*	*			trans	-132.8	143.2	-151.8	-176.7	174.8	6.6	0	0	114.3
449	G	30.1	Very low	31.6	Very low	71 Å²	71	134.1 Å²	134.1	73%	0.732	77%	0.766	S	S	*	*			trans	97.2	161.6	167.1	0	0	0	0	0	114.9
450	S	32.4	Very low	31.9	Very low	97 Å²	97	132.3 Å²	132.3	68%	0.678	76%	0.763	S	S	*	*			cis	-164.9	133.1	-12.6	-178.1	0	0	0	0	109.9
451	Q	32.3	Very low	32.4	Very low	196 Å²	196	133.5 Å²	133.5	92%	0.916	77%	0.768	S	S	*	*			trans	61	153.1	169.9	-65.5	160.1	-14.5	0	0	115.7
452	G	31.6	Very low	31.8	Very low	65 Å²	65	134.2 Å²	134.2	67%	0.67	76%	0.76	S	S	*	*			cis	174.9	161.7	-8.5	0	0	0	0	0	110.6
453	D	33.3	Very low	32.1	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	76%	0.76	S	S	*	*			trans	59.2	119.8	160.3	-77	-18	0	0	0	118.9
454	Q	34.2	Very low	32	Very low	128 Å²	128	140.7 Å²	140.7	60%	0.598	76%	0.763	S	S	*	*				64.9	138.3	90.8	-68.3	-171.8	80.7	0	0	113.4
455	R	32	Very low	31.8	Very low	194 Å²	194	136.4 Å²	136.4	73%	0.732	76%	0.755	S	S	*	*			cis	-171.9	167.9	-7.1	-120.7	177.1	-177.9	151.5	-11.6	106.4
456	N	30.1	Very low	31.7	Very low	129 Å²	129	133.5 Å²	133.5	69%	0.69	75%	0.75	S	S	*	*			trans	64.5	160.8	152.8	-79.7	55.5	0	0	0	117
457	D	28.9	Very low	31.5	Very low	118 Å²	118	134.7 Å²	134.7	63%	0.631	75%	0.751	S	S	*	*			cis	-150.8	-180	-36.5	-139.1	-41.8	0	0	0	109.6
458	H	31.9	Very low	31.3	Very low	174 Å²	174	132.7 Å²	132.7	81%	0.806	74%	0.74	S	S	*	*			trans	-50.7	138.7	171.9	-59.3	-75.1	0	0	0	114.4
459	S	28.9	Very low	31.2	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	74%	0.738	S	S	*	*				-161.9	139.5	122.6	41.2	0	0	0	0	112.1
460	V	38.1	Very low	31.1	Very low	131 Å²	131	137.1 Å²	137.1	79%	0.794	74%	0.741	S	S	*	*			trans	-109	145.6	167.1	179.5	0	0	0	0	106.8
461	P	44.7	Very low	31	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	75%	0.746	S	S	*	*			trans	-127	158.1	131.2	2.9	18.5	0	0	0	113
462	E	28.1	Very low	30.8	Very low	149 Å²	149	135.2 Å²	135.2	70%	0.696	74%	0.737	S	S	*	*			trans	-88.3	-177.5	178	-47.2	174.5	80.3	0	0	113.9
463	R	32.3	Very low	30.6	Very low	199 Å²	199	143.4 Å²	143.4	75%	0.751	75%	0.747	S	S	*	*			trans	90.2	101.7	137.2	-82.4	164	-175.5	-119	-6	120.9
464	S	26.1	Very low	30.5	Very low	125 Å²	125	143.8 Å²	143.8	87%	0.874	75%	0.754	S	S	*	*				74.6	133.6	111.2	-57.2	0	0	0	0	121.9
465	G	24.1	Very low	30.4	Very low	63 Å²	63	144.5 Å²	144.5	65%	0.649	76%	0.758	S	S	*	*			trans	131.1	111.1	169.7	0	0	0	0	0	109.9
466	S	28	Very low	30.6	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	76%	0.764	S	S	*	*				64.4	131.9	70.1	74.6	0	0	0	0	112.3
467	Q	27.3	Very low	30.6	Very low	159 Å²	159	140.8 Å²	140.8	74%	0.743	76%	0.758	S	S	*	*			cis	-170.9	171.3	15.5	-137.9	175.6	-51.7	0	0	109.9
468	I	29.4	Very low	30.8	Very low	129 Å²	129	144.3 Å²	144.3	66%	0.662	77%	0.768	S	S	*	*			trans	71	151.3	157.1	-64.5	158.9	0	0	0	113.2
469	E	30.9	Very low	30.7	Very low	171 Å²	171	145.5 Å²	145.5	80%	0.799	77%	0.771	S	S	*	*			cis	-141.4	177.9	20.9	-144.4	136.9	-120.4	0	0	113.8
470	E	29.4	Very low	30.6	Very low	170 Å²	170	145.8 Å²	145.8	79%	0.794	77%	0.773	S	S	*	*			trans	-52.7	176.7	166.8	-77.9	166.8	93.2	0	0	116.3
471	E	29.3	Very low	30.1	Very low	168 Å²	168	148.2 Å²	148.2	79%	0.785	78%	0.775	S	S	*	*			cis	-156.8	-173.7	12.4	-145.5	-137.3	120.7	0	0	113.1
472	A	28.1	Very low	29.3	Very low	86 Å²	86	151 Å²	151	71%	0.711	78%	0.777	S	S	*	*			trans	80.7	165.1	152.8	0	0	0	0	0	121.8
473	R	27.2	Very low	29.4	Very low	237 Å²	237	154.5 Å²	154.5	89%	0.894	78%	0.784	S	S	*	*			trans	-131.5	162.3	-162.4	-70	168.1	160.1	161.2	-7.6	113.2
474	V	30.8	Very low	29.3	Very low	143 Å²	143	149.6 Å²	149.6	87%	0.867	78%	0.78	S	S	*	*				154.6	148.4	122.8	163.9	0	0	0	0	112.4
475	E	32.2	Very low	29.4	Very low	144 Å²	144	149 Å²	149	67%	0.673	78%	0.776	S	S	*	*			trans	-72.4	-179.5	178	-56.6	-174.6	122.9	0	0	114.9	I477	E475-I477 WeakPolarHBondContact OE2-CD1 3.44Å; E475-I477 WeakPolarHBondContact OE2-CG1 3.26Å
476	P	36.4	Very low	29.5	Very low	133 Å²	133	151.4 Å²	151.4	86%	0.864	78%	0.783	S	S	*	*				-140.4	151.6	106	37.9	-26.9	0	0	0	117.2
477	I	30.8	Very low	29.6	Very low	112 Å²	112	151.2 Å²	151.2	57%	0.574	78%	0.782	S	S	*	*			trans	-103.8	141.5	175.4	-63	164.6	0	0	0	111.9	E475	E475-I477 WeakPolarHBondContact OE2-CD1 3.44Å; E475-I477 WeakPolarHBondContact OE2-CG1 3.26Å
478	K	32.7	Very low	29.7	Very low	192 Å²	192	152.9 Å²	152.9	84%	0.835	79%	0.79	S	S	*	*			trans	174.7	120.5	137.9	-92.1	145.2	-163.5	171	0	110.4
479	K	30.9	Very low	29.7	Very low	199 Å²	199	155 Å²	155	87%	0.865	80%	0.796	S	S	*	*				77.9	127	73.3	-86.1	-168.6	174.2	-176.1	0	115.3
480	S	25.1	Very low	29.6	Very low	119 Å²	119	156 Å²	156	83%	0.832	80%	0.801	S	S	*	*			trans	-143.7	146.9	149.2	69.7	0	0	0	0	110.9
481	Q	28.9	Very low	29.6	Very low	181 Å²	181	154.3 Å²	154.3	85%	0.846	80%	0.797	S	S	*	*			trans	-164.6	140.1	173.9	-88.5	-167.7	-16.3	0	0	108.3
482	H	27.9	Very low	29.7	Very low	182 Å²	182	154.4 Å²	154.4	84%	0.843	80%	0.797	S	S	*	*			trans	-178.8	131.2	147.8	-87.4	-67.1	0	0	0	105.9
483	R	29.4	Very low	29.6	Very low	223 Å²	223	161.5 Å²	161.5	84%	0.842	81%	0.806	S	S	*	*				72.7	128.5	59.3	-78.9	-165.8	-178.7	-152.4	1.7	112.8
484	S	29.4	Very low	29.6	Very low	96 Å²	96	155.4 Å²	155.4	67%	0.671	80%	0.799	S	S	*	*			cis	-159.4	160	9.1	-63.4	0	0	0	0	115.9
485	S	29.9	Very low	29.5	Very low	113 Å²	113	151.9 Å²	151.9	79%	0.79	79%	0.792	S	S	*	*			trans	59.3	122	131.1	65.5	0	0	0	0	126
486	S	26.3	Very low	29.4	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	80%	0.799	S	S	*	*				-172.4	146.6	125.5	52.7	0	0	0	0	107.9
487	S	28.9	Very low	29.1	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	79%	0.788	S	S	*	*			cis	137.8	112.8	-10.3	60.4	0	0	0	0	108.4
488	Q	29.2	Very low	29.1	Very low	193 Å²	193	155.8 Å²	155.8	90%	0.902	81%	0.805	S	S	*	*			trans	-172.5	164.7	139.2	-106.2	171.1	12	0	0	112
489	H	29.9	Very low	28.9	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.806	80%	0.798	S	S	*	*			trans	-112.3	165.9	-168.8	-61.3	-108.2	0	0	0	112
490	H	28.2	Very low	29.1	Very low	192 Å²	192	148.6 Å²	148.6	89%	0.889	80%	0.8	S	S	*	*				-167.1	167.2	111.9	-98.5	-64	0	0	0	111.9
491	N	29.5	Very low	29.4	Very low	135 Å²	135	148.5 Å²	148.5	72%	0.722	80%	0.799	S	S	*	*			trans	-152	177.6	-176.8	-162.6	-5.8	0	0	0	109
492	H	31.5	Very low	29.6	Very low	169 Å²	169	148.4 Å²	148.4	78%	0.782	79%	0.791	S	S	*	*			trans	76	157.6	-173.3	-36.9	-66.7	0	0	0	114.1
493	R	26.7	Very low	29.7	Very low	236 Å²	236	145.4 Å²	145.4	89%	0.891	78%	0.777	S	S	*	*			cis	-151.3	171.8	3.7	-149.6	173.3	177.2	173.7	-0.4	112.2
494	S	27.4	Very low	29.8	Very low	108 Å²	108	143.8 Å²	143.8	76%	0.755	78%	0.779	S	S	*	*			trans	-75	150.8	177.5	55	0	0	0	0	116.6
495	G	27.8	Very low	29.9	Very low	70 Å²	70	143 Å²	143	72%	0.722	77%	0.77	S	S	*	*			trans	166.1	105.3	162.4	0	0	0	0	0	111.5
496	V	30.2	Very low	29.8	Very low	136 Å²	136	147.7 Å²	147.7	82%	0.824	78%	0.777	S	S	*	*				95.1	120.2	59.4	167.3	0	0	0	0	114
497	S	30	Very low	30.3	Very low	91 Å²	91	148.1 Å²	148.1	64%	0.636	77%	0.771	S	S	*	*			trans	91.5	118.7	151.9	-75.6	0	0	0	0	124
498	R	31.3	Very low	30.5	Very low	244 Å²	244	149 Å²	149	92%	0.921	78%	0.777	S	S	*	*				100.2	138.6	126.5	-73.7	169.4	177.7	162	-1.5	122.7
499	G	29.7	Very low	30.8	Very low	66 Å²	66	148.6 Å²	148.6	68%	0.68	78%	0.775	S	S	*	*			trans	103.3	105.9	175.4	0	0	0	0	0	112.6
500	L	34.1	Very low	31.2	Very low	174 Å²	174	145.7 Å²	145.7	91%	0.911	77%	0.769	S	S	*	*			cis	60.2	128.9	38.3	-51.8	179.2	0	0	0	113
501	S	30.5	Very low	31.3	Very low	116 Å²	116	144.6 Å²	144.6	81%	0.811	77%	0.765	S	S	*	*			cis	-155.2	-168	-4.6	56.5	0	0	0	0	108.2
502	R	33.1	Very low	31.4	Very low	179 Å²	179	144 Å²	144	68%	0.675	76%	0.761	S	S	*	*			cis	-155.1	123.1	9.9	-175.5	-175.2	176.7	-111.2	-15.2	107.9
503	Q	31.7	Very low	31.5	Very low	119 Å²	119	141.6 Å²	141.6	56%	0.556	76%	0.764	S	S	*	*				53.1	119	94.1	177.7	-153.7	50.8	0	0	117.6	T505	Q503-T505 HydrophobicContact CG-CG2 3.72Å
504	E	31	Very low	31.9	Very low	190 Å²	190	140.8 Å²	140.8	89%	0.888	76%	0.761	S	S	*	*			trans	-128.5	158.7	139.2	-76.8	-154.6	138.5	0	0	109.1
505	T	31.8	Very low	32	Very low	79 Å²	79	142 Å²	142	49%	0.485	76%	0.759	S	S	.	*			trans	-149.4	149.3	-160.9	42.2	0	0	0	0	111.6	Q503	Q503-T505 HydrophobicContact CG-CG2 3.72Å
506	F	27.9	Very low	32.3	Very low	211 Å²	211	143.7 Å²	143.7	93%	0.925	76%	0.759	S	S	*	*			trans	-155.5	141.2	140.4	-127.9	-80.1	0	0	0	111.5
507	D	35	Very low	32.4	Very low	123 Å²	123	141.5 Å²	141.5	66%	0.658	76%	0.756	S	S	*	*			trans	-110.9	166.5	-164.6	-55.1	-79.5	0	0	0	113.9
508	S	33.7	Very low	32.4	Very low	125 Å²	125	147.2 Å²	147.2	87%	0.874	77%	0.765	S	S	*	*			trans	-164.1	140.2	146.5	-76.3	0	0	0	0	110.7
509	E	36.1	Very low	32.6	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	76%	0.762	S	S	*	*			trans	-111	178.9	-177.3	-55.9	-179.1	84.6	0	0	110.9
510	T	37.9	Very low	32.7	Very low	113 Å²	113	147.4 Å²	147.4	69%	0.693	76%	0.762	S	S	*	*			cis	-146.1	-171.4	19.4	55.7	0	0	0	0	108.5
511	Q	31.3	Very low	33.6	Very low	169 Å²	169	144 Å²	144	79%	0.79	75%	0.75	S	S	*	*			cis	-155.1	-179.9	5.1	-150.3	165.4	10.9	0	0	110.9
512	D	31.7	Very low	33.5	Very low	121 Å²	121	147.1 Å²	147.1	65%	0.647	75%	0.749	S	S	*	*			trans	-57.4	147.2	176.8	-60.7	-106.7	0	0	0	117
513	S	33.3	Very low	33.4	Very low	120 Å²	120	147.1 Å²	147.1	84%	0.839	76%	0.757	S	S	*	*				-160.8	154.5	112.8	-82.1	0	0	0	0	112.6
514	R	35.4	Very low	33.3	Very low	218 Å²	218	148.3 Å²	148.3	82%	0.823	77%	0.767	S	S	*	*			trans	-86	169.8	176.4	-60	169.3	-169.1	153.7	6.9	108.7
515	D	28.3	Very low	33.3	Very low	135 Å²	135	148.7 Å²	148.7	72%	0.722	76%	0.762	S	S	*	*			cis	-165.5	160.4	32.2	-156.9	-25.6	0	0	0	111.1
516	S	34.3	Very low	33.3	Very low	104 Å²	104	150.7 Å²	150.7	73%	0.727	78%	0.779	S	S	*	*			trans	46.5	160.5	152.6	-70.6	0	0	0	0	122.7
517	A	32.1	Very low	33.5	Very low	91 Å²	91	147.4 Å²	147.4	75%	0.752	77%	0.766	S	S	*	*			cis	-167.4	143.5	-32.6	0	0	0	0	0	108
518	Y	30.5	Very low	33.4	Very low	211 Å²	211	149 Å²	149	83%	0.827	77%	0.77	S	S	*	*			trans	-78.9	135.5	-173.6	-176.7	-87.4	0	0	0	113.2
519	I	34.6	Very low	33.3	Very low	166 Å²	166	152 Å²	152	85%	0.851	77%	0.77	S	S	*	*			trans	-141.5	132.2	164.8	-63.9	-174.8	0	0	0	110.9
520	E	33.2	Very low	33.1	Very low	148 Å²	148	146.8 Å²	146.8	69%	0.692	77%	0.765	S	S	*	*			trans	-154.3	177.4	160.4	-146.3	-149.2	149.1	0	0	108
521	P	51.7	Low	32.8	Very low	102 Å²	102	148 Å²	148	66%	0.662	77%	0.767	S	S	*	*				-101.5	177.2	-86.5	37.4	-28.8	0	0	0	113.3
522	K	29.9	Very low	32.9	Very low	181 Å²	181	147.1 Å²	147.1	79%	0.787	76%	0.763	S	S	*	*			trans	-165.5	152.6	140	-119	-175.4	173.2	-150.6	0	115.6
523	E	30.6	Very low	33.1	Very low	179 Å²	179	150.8 Å²	150.8	84%	0.836	77%	0.769	S	S	*	*			trans	-100.3	156.3	161.1	-55.6	171.8	137.9	0	0	109
524	D	28.4	Very low	33.1	Very low	144 Å²	144	151.2 Å²	151.2	77%	0.77	76%	0.762	S	S	*	*			trans	-151.4	149.6	165.4	-100	-46.9	0	0	0	111.3
525	Y	31.2	Very low	32.9	Very low	199 Å²	199	144.6 Å²	144.6	78%	0.78	75%	0.749	S	S	*	*			trans	-95.4	157.8	-178.7	-89.1	-111.3	0	0	0	112.3	H527	Y525-H527 AromaticContact CD1-NE2 3.84Å
526	S	32.3	Very low	33.3	Very low	121 Å²	121	146.5 Å²	146.5	85%	0.846	75%	0.753	S	S	*	*			trans	-159	150.3	161.1	-82.6	0	0	0	0	113.7
527	H	33.2	Very low	33.3	Very low	142 Å²	142	151.5 Å²	151.5	66%	0.657	76%	0.756	S	S	*	*			trans	-153.1	159.6	-166.5	-81.5	-98.1	0	0	0	109.1	Y525	Y525-H527 AromaticContact CD1-NE2 3.84Å
528	E	31.2	Very low	33.3	Very low	155 Å²	155	152 Å²	152	72%	0.724	75%	0.746	S	S	*	*			cis	-171.7	143.7	-13.1	172.2	174.1	-52.1	0	0	108.5
529	H	33	Very low	33.5	Very low	190 Å²	190	150 Å²	150	88%	0.88	74%	0.744	S	S	*	*			trans	-160.8	141.1	173.8	-94.6	-62	0	0	0	111.4
530	G	31.9	Very low	33.5	Very low	74 Å²	74	148.9 Å²	148.9	76%	0.763	74%	0.74	S	S	*	*			trans	159.7	22.6	173.8	0	0	0	0	0	120.1
531	D	31.1	Very low	33.6	Very low	138 Å²	138	151 Å²	151	74%	0.738	75%	0.75	S	S	*	*			trans	20.7	124.1	163.2	-53.4	-26.8	0	0	0	123.1
532	H	33.8	Very low	32.8	Very low	151 Å²	151	155.8 Å²	155.8	70%	0.699	75%	0.754	S	S	*	*			trans	88.2	122.4	130.3	-84.9	14.2	0	0	0	124
533	Y	35.3	Very low	32.9	Very low	197 Å²	197	152.1 Å²	152.1	77%	0.773	74%	0.743	S	S	*	*			trans	62.8	141.1	146.5	-69	-60.5	0	0	0	120.4
534	D	32.7	Very low	33	Very low	130 Å²	130	151.9 Å²	151.9	70%	0.695	74%	0.742	S	S	*	*			cis	-160	167.6	-11.8	-165.2	19.6	0	0	0	112.4
535	S	32.1	Very low	33.1	Very low	79 Å²	79	148.2 Å²	148.2	55%	0.552	73%	0.728	S	S	*	*			trans	54.7	99.5	150.7	-81.2	0	0	0	0	122.5
536	H	37	Very low	33.2	Very low	174 Å²	174	148 Å²	148	81%	0.806	73%	0.734	S	S	*	*				51.9	109.9	111.2	-67.9	-56.4	0	0	0	122.5
537	R	34.4	Very low	33	Very low	209 Å²	209	145.6 Å²	145.6	79%	0.789	73%	0.728	S	S	*	*				108.6	133	105.4	-165.7	174.7	-168.6	177.8	2.9	121
538	D	31.1	Very low	32.9	Very low	101 Å²	101	144.7 Å²	144.7	54%	0.54	74%	0.737	S	S	.	*			trans	12.5	126.9	155.1	-36.6	-31.3	0	0	0	120.9
539	H	34.8	Very low	32.8	Very low	171 Å²	171	142.8 Å²	142.8	79%	0.792	74%	0.741	S	S	*	*				-177.8	168	89	-96	-55.3	0	0	0	114.6
540	N	35.2	Very low	32.7	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	73%	0.728	S	S	*	*			trans	-77.6	162	175.4	-53.7	-67.5	0	0	0	112.1
541	H	35.7	Very low	32.7	Very low	194 Å²	194	143.3 Å²	143.3	90%	0.898	73%	0.728	S	S	*	*				-161	-171	124.5	-110.1	-70.3	0	0	0	112.1
542	R	33.7	Very low	32.8	Very low	202 Å²	202	146.6 Å²	146.6	76%	0.762	73%	0.73	S	S	*	*			trans	-150.5	164	-147.8	-165.1	-168.1	141	-178.5	-17.1	112.7
543	D	32.1	Very low	32.7	Very low	103 Å²	103	147.9 Å²	147.9	55%	0.551	74%	0.736	S	S	*	*			trans	88.7	135.4	155.8	-72.6	-39	0	0	0	120.4
544	E	32.3	Very low	32.4	Very low	174 Å²	174	150.7 Å²	150.7	81%	0.813	75%	0.745	S	S	*	*			trans	60	153.7	142.4	-68.3	-147.2	89.3	0	0	122
545	S	31	Very low	32.4	Very low	68 Å²	68	153.4 Å²	153.4	48%	0.476	75%	0.753	S	S	.	*			cis	-164.3	178	-16.9	-107.7	0	0	0	0	110.8
546	H	33.5	Very low	32.2	Very low	195 Å²	195	154.9 Å²	154.9	90%	0.903	76%	0.763	S	S	*	*			trans	74.3	151.1	172	-40	-73.8	0	0	0	117.5
547	G	28.8	Very low	32	Very low	70 Å²	70	156.9 Å²	156.9	72%	0.722	76%	0.764	S	S	*	*			cis	167.5	138.5	-13.6	0	0	0	0	0	115.7
548	S	29.4	Very low	32	Very low	122 Å²	122	154.8 Å²	154.8	85%	0.853	76%	0.763	S	S	*	*			trans	60.2	125.7	156.9	-154.7	0	0	0	0	122.2
549	S	29.5	Very low	32	Very low	116 Å²	116	160.9 Å²	160.9	81%	0.811	78%	0.778	S	S	*	*				-175	162.1	116	-159.6	0	0	0	0	112.6
550	D	31.2	Very low	31.7	Very low	114 Å²	114	157.3 Å²	157.3	61%	0.61	77%	0.773	S	S	*	*			trans	-91.9	155.8	-173.4	-85.2	-87	0	0	0	115.4
551	H	32.9	Very low	31.5	Very low	161 Å²	161	158.9 Å²	158.9	75%	0.745	77%	0.773	S	S	*	*				165.7	109.6	104.7	-84.3	-53.5	0	0	0	117.1
552	R	31.8	Very low	31.2	Very low	207 Å²	207	155.3 Å²	155.3	78%	0.781	76%	0.756	S	S	*	*			trans	36.2	123.1	131.7	-61.8	-175.5	-174.3	-169.2	1.4	123.4
553	H	33	Very low	31.2	Very low	178 Å²	178	153.8 Å²	153.8	82%	0.824	75%	0.751	S	S	*	*			trans	50.1	124.1	134.4	-63.5	-70.8	0	0	0	122.9
554	R	28.4	Very low	31.2	Very low	256 Å²	256	154.3 Å²	154.3	97%	0.966	75%	0.754	S	S	*	*				-159	160.9	113.9	-125	176.1	-179.6	167	1.1	113.3
555	E	31.8	Very low	31.3	Very low	186 Å²	186	153.4 Å²	153.4	87%	0.869	74%	0.743	S	S	*	*			trans	-139.8	131.6	-177	176.7	-172.9	-146.3	0	0	110.2
556	S	28.3	Very low	31.5	Very low	110 Å²	110	156.3 Å²	156.3	77%	0.769	75%	0.749	S	S	*	*			trans	-163.9	99.6	168.3	60	0	0	0	0	116.3
557	R	33.6	Very low	31.7	Very low	217 Å²	217	153.8 Å²	153.8	82%	0.819	74%	0.737	S	S	*	*				55.3	121.6	125.2	-70.5	-178.2	-178.1	178.4	0.1	123.3
558	H	33.9	Very low	31.8	Very low	165 Å²	165	156.7 Å²	156.7	76%	0.764	74%	0.736	S	S	*	*				92.6	127.5	128.1	-66.4	-36.7	0	0	0	124.3
559	R	30.2	Very low	32.2	Very low	229 Å²	229	157.6 Å²	157.6	86%	0.864	73%	0.727	S	S	*	*			trans	83.4	96.1	134.6	-91.9	-170.3	170.6	168.2	-2.1	123.5
560	S	28.8	Very low	32.4	Very low	96 Å²	96	158.5 Å²	158.5	67%	0.671	72%	0.722	S	S	*	*				73.6	133.7	107.3	69.5	0	0	0	0	124.8
561	K	30.8	Very low	32.6	Very low	173 Å²	173	161 Å²	161	75%	0.752	73%	0.73	S	S	*	*			trans	93.8	121.6	132.2	-110.2	-170	173.7	-125.4	0	121.1
562	E	31	Very low	32.5	Very low	119 Å²	119	158.5 Å²	158.5	56%	0.556	73%	0.73	S	S	*	*			trans	57.1	156	148.1	-71.9	175.2	103.3	0	0	117.4
563	R	32.2	Very low	32.2	Very low	170 Å²	170	155.2 Å²	155.2	64%	0.642	73%	0.728	S	S	*	*			cis	-152	172.6	0.4	-126	168.4	-150	-152	9.1	105.9
564	D	32	Very low	32.5	Very low	115 Å²	115	156.5 Å²	156.5	62%	0.615	73%	0.731	S	S	*	*			cis	-172.9	145.5	48.7	-113	-31.3	0	0	0	107.2
565	R	35	Very low	32.9	Very low	154 Å²	154	150.8 Å²	150.8	58%	0.581	72%	0.716	S	S	*	*				68.9	135.3	95.2	-75.5	-167.5	169	73.4	17	118
566	E	35.1	Very low	32.9	Very low	129 Å²	129	152 Å²	152	60%	0.603	71%	0.712	S	S	*	*			cis	-151.1	-147.9	-15.1	-132.8	166.5	-129.3	0	0	107.1
567	Q	37.9	Very low	33	Very low	143 Å²	143	151.8 Å²	151.8	67%	0.668	71%	0.711	S	S	*	*			cis	-129.7	-122.5	8.1	-150.7	114.6	72.2	0	0	109
568	D	30.5	Very low	33	Very low	131 Å²	131	152 Å²	152	70%	0.701	71%	0.712	S	S	*	*			cis	-152.8	-152.3	-2.8	-160.7	66.1	0	0	0	110.1
569	H	38.9	Very low	32.9	Very low	141 Å²	141	152.5 Å²	152.5	65%	0.653	71%	0.714	S	S	*	*			trans	-124.5	163.7	-165.1	-68.4	-79.3	0	0	0	112.2
570	N	33.8	Very low	33.1	Very low	134 Å²	134	150.7 Å²	150.7	72%	0.717	71%	0.712	S	S	*	*			cis	-150.7	-172.6	2.2	-134.8	9.2	0	0	0	113.6
571	E	34.5	Very low	33.2	Very low	166 Å²	166	151.2 Å²	151.2	78%	0.776	72%	0.716	S	S	*	*			trans	-62.4	179.1	179.7	-45.4	-178	116.5	0	0	114.7
572	C	30	Very low	33.2	Very low	109 Å²	109	152.3 Å²	152.3	74%	0.736	72%	0.715	S	S	*	*			cis	-163.8	149.5	20.6	-162.6	0	0	0	0	113.5
573	N	26.4	Very low	33.2	Very low	139 Å²	139	154.1 Å²	154.1	74%	0.743	73%	0.729	S	S	*	*				162	125.5	116.5	-168.9	1	0	0	0	111.6
574	K	39.7	Very low	33.2	Very low	205 Å²	205	152.8 Å²	152.8	89%	0.891	73%	0.73	S	S	*	*			trans	-155.1	113.9	174.7	-150.3	173.7	-170.3	173.5	0	112.3
575	Q	36.1	Very low	33.1	Very low	136 Å²	136	157.9 Å²	157.9	64%	0.636	74%	0.742	S	S	*	*			trans	-147.6	150.6	169.4	-70.2	-163.5	14.6	0	0	107.6
576	R	32.8	Very low	32.7	Very low	210 Å²	210	154.9 Å²	154.9	79%	0.792	74%	0.743	S	S	*	*			cis	-156.7	165.6	-4.3	-112	166.4	-171.7	168.7	5.1	106
577	S	30	Very low	32.5	Very low	106 Å²	106	155 Å²	155	74%	0.741	75%	0.748	S	S	*	*			cis	-140.7	-123.2	4.2	-169.7	0	0	0	0	110.6
578	R	33.8	Very low	32.2	Very low	223 Å²	223	155.5 Å²	155.5	84%	0.842	75%	0.748	S	S	*	*			trans	-160.1	161.2	-174.3	-72.1	177.5	167.8	165.7	-4.8	111
579	H	31.9	Very low	32.2	Very low	174 Å²	174	156.2 Å²	156.2	81%	0.806	75%	0.752	S	S	*	*				173.7	132.5	126.1	-91.7	79.4	0	0	0	106.3
580	K	34.7	Very low	31.8	Very low	192 Å²	192	153.4 Å²	153.4	84%	0.835	76%	0.761	S	S	*	*				63.8	137.1	50.6	-73.1	-158.4	171.3	-165.8	0	112.7
581	S	29.5	Very low	31.6	Very low	107 Å²	107	155.8 Å²	155.8	75%	0.748	77%	0.768	S	S	*	*			cis	-138.4	177.6	34.5	-62.4	0	0	0	0	116.2
582	R	31	Very low	31.3	Very low	196 Å²	196	153.1 Å²	153.1	74%	0.74	76%	0.762	S	S	*	*			trans	-134.2	139.9	165.5	152	-175.3	162.2	-173.8	-4.4	106.3
583	D	31.4	Very low	31.4	Very low	157 Å²	157	155.9 Å²	155.9	84%	0.84	77%	0.768	S	S	*	*			trans	-138	170	165.4	-79.2	-64.5	0	0	0	111
584	Q	31.8	Very low	31.7	Very low	141 Å²	141	154.1 Å²	154.1	66%	0.659	77%	0.767	S	S	*	*			trans	-161.3	127.6	-160.5	167.7	-174.1	-17.2	0	0	111.4
585	Y	29.5	Very low	31.4	Very low	222 Å²	222	154.7 Å²	154.7	87%	0.871	77%	0.77	S	S	*	*			trans	-161.2	178.7	150.2	-135.9	-104	0	0	0	113.4
586	C	28.5	Very low	31.4	Very low	91 Å²	91	157.1 Å²	157.1	62%	0.615	78%	0.778	S	S	*	*			trans	-71.9	-177.3	-173.3	-47.7	0	0	0	0	113.7
587	D	30.1	Very low	31.3	Very low	132 Å²	132	158.1 Å²	158.1	71%	0.706	78%	0.782	S	S	*	*			cis	-164.8	171.9	22.2	-151.8	3.4	0	0	0	114.1
588	K	30.7	Very low	31.4	Very low	154 Å²	154	158.8 Å²	158.8	67%	0.67	78%	0.777	S	S	*	*			trans	77.5	135.2	148	-82.8	174.2	-178.7	-161.8	0	126.4
589	D	30.6	Very low	31.2	Very low	146 Å²	146	154.3 Å²	154.3	78%	0.781	77%	0.77	S	S	*	*			trans	65	134.4	135.3	-52.8	-21.1	0	0	0	122.8
590	G	30.2	Very low	31.2	Very low	81 Å²	81	152.1 Å²	152.1	84%	0.835	77%	0.769	S	S	*	*			trans	160.9	95.5	173.2	0	0	0	0	0	113.9
591	E	29.6	Very low	31	Very low	184 Å²	184	146.5 Å²	146.5	86%	0.86	77%	0.766	S	S	*	*			trans	-81.9	143.8	-176.1	-82.7	-167.4	98.9	0	0	115.8
592	V	29.5	Very low	31.3	Very low	110 Å²	110	150.2 Å²	150.2	67%	0.667	77%	0.771	S	S	*	*				23.5	125.2	127.6	-165.1	0	0	0	0	118.5
593	I	32.3	Very low	31.4	Very low	167 Å²	167	151.9 Å²	151.9	86%	0.856	78%	0.778	S	S	*	*				-169.4	139.7	119.6	-99.7	160.6	0	0	0	112.6
594	S	31.9	Very low	31.4	Very low	103 Å²	103	150.9 Å²	150.9	72%	0.72	77%	0.772	S	S	*	*			trans	-95.2	154.5	-178.7	-44.8	0	0	0	0	112.7
595	K	34	Very low	31.5	Very low	217 Å²	217	154.6 Å²	154.6	94%	0.943	78%	0.78	S	S	*	*			trans	-154	155.5	141.6	-117.5	160	-171.6	171.8	0	113.6
596	K	36.4	Very low	31.7	Very low	187 Å²	187	150.6 Å²	150.6	81%	0.813	77%	0.774	S	S	*	*			trans	-152.8	128	-166	165.7	-169.1	175.4	-178.7	0	109.3
597	R	30.8	Very low	32.1	Very low	230 Å²	230	153.1 Å²	153.1	87%	0.868	79%	0.786	S	S	*	*			trans	178.4	138.4	143.9	-108.2	174	165.4	163.8	-4.7	112.1
598	N	30.7	Very low	32.7	Very low	121 Å²	121	156.9 Å²	156.9	65%	0.647	79%	0.792	S	S	*	*				35	150.4	118.6	-66.7	67.3	0	0	0	120.2
599	D	30.6	Very low	33.5	Very low	129 Å²	129	156.2 Å²	156.2	69%	0.69	79%	0.794	S	S	*	*			cis	-156.7	169.2	28.8	-130.8	0.4	0	0	0	115.8
600	T	31.5	Very low	33.9	Very low	127 Å²	127	160.3 Å²	160.3	78%	0.779	80%	0.799	S	S	*	*			trans	30.9	136	148.6	-37.4	0	0	0	0	122.7
601	G	30.6	Very low	34.5	Very low	75 Å²	75	168.1 Å²	168.1	77%	0.773	81%	0.814	S	S	*	*			trans	175.3	71	163	0	0	0	0	0	116.9
602	E	35.6	Very low	34.7	Very low	185 Å²	185	167.4 Å²	167.4	86%	0.864	81%	0.811	S	S	*	*			trans	-103	122.7	175.9	-179.7	177.5	-135.7	0	0	111.3
603	W	33.3	Very low	35	Very low	230 Å²	230	170.4 Å²	170.4	87%	0.871	82%	0.819	S	S	*	*			trans	-141.3	91.1	176.6	-85.9	84.4	0	0	0	114.4
604	N	31	Very low	35.1	Very low	137 Å²	137	170.6 Å²	170.6	73%	0.733	82%	0.817	S	S	*	*			trans	65.8	167.7	135	-102.1	-36.3	0	0	0	123.6
605	R	35.2	Very low	35.3	Very low	218 Å²	218	174.5 Å²	174.5	82%	0.823	82%	0.823	S	S	*	*			trans	-119.7	-163.7	-168.7	-58.3	179.2	177.2	-179	0.1	112.2
606	D	33.8	Very low	35.4	Very low	139 Å²	139	171.9 Å²	171.9	74%	0.743	82%	0.815	S	S	*	*			trans	98.5	152.3	157.5	-51.9	-27.3	0	0	0	115
607	V	36.8	Very low	35.3	Very low	143 Å²	143	170.9 Å²	170.9	87%	0.867	82%	0.815	S	S	*	*			cis	-134.2	159.2	16.9	-178.2	0	0	0	0	111.5
608	Y	41.7	Very low	35.7	Very low	212 Å²	212	166.6 Å²	166.6	83%	0.831	81%	0.811	S	S	*	*			trans	-125.9	139.4	170.7	-136.1	-41	0	0	0	110.2
609	I	48.2	Very low	36	Very low	140 Å²	140	170.2 Å²	170.2	72%	0.718	82%	0.824	S	S	*	*			trans	64.4	113.6	164.5	-43.8	-174.6	0	0	0	119
610	R	38.7	Very low	36.5	Very low	232 Å²	232	173.6 Å²	173.6	88%	0.875	84%	0.835	S	S	*	*				-174.1	156.4	121.1	-99.1	173.2	-166	-152.2	2.7	108.6
611	Q	41.8	Very low	37	Very low	245 Å²	245	177.8 Å²	177.8	100%	1.145	84%	0.84	S	S	*	*			cis	-137.5	0	9.9	-168.5	167	2.1	0	0	111.2

Retrieved 611 of 611 residues in 199.6 ms (Link to these results)

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