G7N498_MACMU Loading...

Oxysterol-binding protein

AlphaFold DB , UniProt , Accession G7N498, Species MACMU (Macaca mulatta, Rhesus macaque), Gene OSBPL2, Length 480 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.5	Very low	30.8	Very low	241 Å²	241	130.5 Å²	130.5	100%	1.187	69%	0.689	S	S	*	*				0	91.1	0	-80.8	175.5	174.5	0	0	105.5	G3	M1-G3 PolarHBondContact O-N 3.08Å
2	N	29.6	Very low	31.1	Very low	156 Å²	156	126.2 Å²	126.2	83%	0.834	67%	0.671	S	S	*	*			trans	-76.6	113.9	-179	-68	-5.5	0	0	0	107.1
3	G	26.5	Very low	31.2	Very low	71 Å²	71	119.9 Å²	119.9	73%	0.732	66%	0.655	S	S	*	*			trans	-95.1	91.1	164.3	0	0	0	0	0	107.1	M1 E5	M1-G3 PolarHBondContact O-N 3.08Å; G3-E5 PolarHBondContact O-N 2.95Å; G3-E5 VanDerWaalsContact O-N 3.12Å
4	E	29.3	Very low	30.9	Very low	177 Å²	177	125.1 Å²	125.1	83%	0.827	67%	0.669	S	S	*	*			trans	-65.6	103.7	160.2	-72	178.2	175	0	0	106.2	E6	E4-E6 PolarHBondContact O-N 2.85Å; E4-E6 VanDerWaalsContact O-N 3.14Å
5	E	29.7	Very low	30.7	Very low	150 Å²	150	126.8 Å²	126.8	70%	0.701	68%	0.678	S	S	*	*			trans	-68	106.7	167.9	-75.6	-176.8	167.1	0	0	107	G3 F7	G3-E5 PolarHBondContact O-N 2.95Å; G3-E5 VanDerWaalsContact O-N 3.12Å; E5-F7 HydrophobicContact CB-CD2 4.15Å; E5-F7 HydrophobicContact CB-CE2 3.61Å; E5-F7 HydrophobicContact CB-CZ 4.29Å; E5-F7 WeakPolarHBondContact O-CD2 3.48Å; E5-F7 PolarHBondContact O-N 3.26Å
6	E	27.7	Very low	30.5	Very low	161 Å²	161	126.3 Å²	126.3	75%	0.752	69%	0.687	S	S	*	*			trans	-64.7	101.1	171.8	-77.4	-178.6	152.5	0	0	109.4	E4 F8	E4-E6 PolarHBondContact O-N 2.85Å; E4-E6 VanDerWaalsContact O-N 3.14Å; E6-F8 HydrophobicContact CB-CD2 4.41Å; E6-F8 HydrophobicContact CB-CE2 4.05Å; E6-F8 PolarHBondContact O-N 3.15Å
7	F	34.7	Very low	30.3	Very low	110 Å²	110	128.4 Å²	128.4	48%	0.482	70%	0.698	S	S	.	*			trans	-80.5	94.9	175	-77.5	-95.6	0	0	0	110.1	E5	E5-F7 HydrophobicContact CB-CD2 4.15Å; E5-F7 HydrophobicContact CB-CE2 3.61Å; E5-F7 HydrophobicContact CB-CZ 4.29Å; E5-F7 WeakPolarHBondContact O-CD2 3.48Å; E5-F7 PolarHBondContact O-N 3.26Å
8	F	28.4	Very low	30.3	Very low	154 Å²	154	130.3 Å²	130.3	68%	0.675	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-73.9	124.5	162.1	-71.1	-90.8	0	0	0	109.5	E6 K90	E6-F8 HydrophobicContact CB-CD2 4.41Å; E6-F8 HydrophobicContact CB-CE2 4.05Å; E6-F8 PolarHBondContact O-N 3.15Å; F8-K90 PolarHBondContact O-NZ 3.32Å
9	D	37.7	Very low	30.1	Very low	51 Å²	51	129.8 Å²	129.8	27%	0.273	72%	0.715	S	S	.	*	P	Polyproline II helix	trans	-81.5	154.6	162.9	-73.1	-42.6	0	0	0	109.4	V11 H179 R434	D9-V11 PolarHBondContact O-N 3.35Å; D9-H179 IonicContact OD1-CE1 3.5Å; D9-H179 IonicContact OD2-CE1 3.91Å; D9-H179 PolarHBondContact OD2-CE1 3.26Å; D9-H179 IonicContact OD2-NE2 2.77Å; D9-H179 PolarHBondContact OD2-NE2 2.94Å; D9-R434 IonicContact OD2-NH1 2.92Å; D9-R434 PolarHBondContact OD2-NH1 2.86Å
10	A	36.6	Very low	30.1	Very low	52 Å²	52	129.1 Å²	129.1	43%	0.43	72%	0.719	S	S	.	*	P	Polyproline II helix	trans	-54.6	130	-167.5	0	0	0	0	0	113.4	T12 K90	A10-T12 PolarHBondContact O-N 2.87Å; A10-K90 WeakPolarHBondContact CB-O 3.32Å
11	V	27.5	Very low	29.9	Very low	113 Å²	113	126.2 Å²	126.2	69%	0.685	72%	0.719	S	S	*	*			trans	-67.8	114.1	170.7	-179.7	0	0	0	0	108.5	D9 G13	D9-V11 PolarHBondContact O-N 3.35Å; V11-G13 PolarHBondContact O-N 3Å
12	T	35.2	Very low	29.7	Very low	78 Å²	78	123.7 Å²	123.7	48%	0.479	70%	0.704	S	S	.	*			trans	-82.5	98.4	162	45.7	0	0	0	0	107.8	A10	A10-T12 PolarHBondContact O-N 2.87Å
13	G	32.6	Very low	29.5	Very low	45 Å²	45	126.6 Å²	126.6	46%	0.464	71%	0.71	S	S	.	*			trans	167.4	88.4	175	0	0	0	0	0	111.8	V11	V11-G13 PolarHBondContact O-N 3Å
14	F	27.1	Very low	29.5	Very low	193 Å²	193	128.4 Å²	128.4	85%	0.846	71%	0.711	S	S	*	*			trans	-140.9	116.7	151.1	-74	-66.8	0	0	0	108.6
15	D	27	Very low	29.4	Very low	150 Å²	150	127.8 Å²	127.8	80%	0.802	71%	0.709	S	S	*	*			trans	-29.6	133.5	-174.9	-59.3	-55.6	0	0	0	117	D17	D15-D17 PolarHBondContact O-N 2.92Å
16	S	28.5	Very low	29.2	Very low	118 Å²	118	125.6 Å²	125.6	83%	0.825	72%	0.716	S	S	*	*			trans	-71.8	104.2	160.4	52.3	0	0	0	0	109.4
17	D	26.5	Very low	29.1	Very low	163 Å²	163	125.4 Å²	125.4	87%	0.872	72%	0.715	S	S	*	*			trans	-72.8	127.5	165	-90.9	-28.4	0	0	0	110.3	D15	D15-D17 PolarHBondContact O-N 2.92Å
18	N	30.1	Very low	28.7	Very low	163 Å²	163	129.4 Å²	129.4	87%	0.872	74%	0.735	S	S	*	*			trans	-46.2	134.1	178.6	-80.6	-38.3	0	0	0	114.3
19	S	26.6	Very low	28.6	Very low	120 Å²	120	130.8 Å²	130.8	84%	0.839	74%	0.741	S	S	*	*			trans	-140.6	100.9	141.1	-172.4	0	0	0	0	109.3	G21	S19-G21 PolarHBondContact O-N 3.04Å
20	S	30.4	Very low	28	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	77%	0.769	S	S	*	*			trans	-64.8	114.9	168.4	49.1	0	0	0	0	109.9
21	G	25.9	Very low	27.4	Very low	69 Å²	69	139 Å²	139	71%	0.711	79%	0.787	S	S	*	*			trans	-125.2	94.3	164.9	0	0	0	0	0	109	S19 F23	S19-G21 PolarHBondContact O-N 3.04Å; G21-F23 PolarHBondContact O-N 3.47Å
22	E	25	Very low	27.3	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.874	79%	0.788	S	S	*	*			trans	-54.9	129.3	167.5	-67.9	176.8	147.7	0	0	110
23	F	26.9	Very low	26.8	Very low	217 Å²	217	142.1 Å²	142.1	95%	0.952	81%	0.809	S	S	*	*			trans	-137.6	117.3	151.5	-100.8	-81.1	0	0	0	110.2	G21	G21-F23 PolarHBondContact O-N 3.47Å
24	S	25.8	Very low	26.6	Very low	109 Å²	109	146.8 Å²	146.8	76%	0.762	82%	0.822	S	S	*	*			trans	-74.2	155.7	-177.7	-177	0	0	0	0	112.7
25	E	27.4	Very low	26.5	Very low	165 Å²	165	145.4 Å²	145.4	77%	0.771	82%	0.823	S	S	*	*			trans	-41	151.5	177.5	-60.1	174.5	140.1	0	0	117.5
26	A	25.5	Very low	26.4	Very low	103 Å²	103	144.7 Å²	144.7	85%	0.851	82%	0.819	S	S	*	*			trans	-151.4	109.9	132.9	0	0	0	0	0	111.7
27	H	26.5	Very low	26.3	Very low	158 Å²	158	147 Å²	147	73%	0.731	82%	0.822	S	S	*	*			trans	-58.7	137.2	163.4	-92.7	-75	0	0	0	112.1
28	Q	25.8	Very low	26.3	Very low	193 Å²	193	143.9 Å²	143.9	90%	0.902	81%	0.809	S	S	*	*			trans	-131.6	109.8	147.4	-95	-176.9	-16.4	0	0	110.8
29	K	25.1	Very low	26.2	Very low	184 Å²	184	141.9 Å²	141.9	80%	0.8	81%	0.807	S	S	*	*			trans	-68	133.7	163.3	-75.7	172.7	173.5	173.8	0	109
30	V	25.7	Very low	26.4	Very low	144 Å²	144	144.7 Å²	144.7	87%	0.873	81%	0.805	S	S	*	*			trans	-127.7	120.4	151	176.6	0	0	0	0	107.9
31	T	24.3	Very low	26.3	Very low	132 Å²	132	147 Å²	147	81%	0.81	81%	0.808	S	S	*	*			trans	-97.3	137.4	179.2	-52	0	0	0	0	109.3
32	G	25.3	Very low	26.5	Very low	67 Å²	67	150.8 Å²	150.8	69%	0.691	81%	0.812	S	S	*	*			trans	97.2	113.4	146.3	0	0	0	0	0	117
33	M	25.4	Very low	26.8	Very low	188 Å²	188	153.1 Å²	153.1	93%	0.926	81%	0.812	S	S	*	*				-165.3	136.5	94.2	-96.7	177.3	76.8	0	0	110.1
34	I	27	Very low	27.3	Very low	143 Å²	143	151.2 Å²	151.2	73%	0.733	81%	0.811	S	S	*	*			trans	-82.8	131.5	177	-58.7	156.4	0	0	0	105.7	L36	I34-L36 HydrophobicContact CG2-CD1 4.24Å
35	D	25.2	Very low	27.5	Very low	164 Å²	164	149.2 Å²	149.2	88%	0.877	81%	0.807	S	S	*	*			trans	-129.8	118.9	148.7	-110	-25.4	0	0	0	109.7
36	L	26.2	Very low	27.7	Very low	135 Å²	135	151.3 Å²	151.3	71%	0.707	81%	0.814	S	S	*	*			trans	-79.5	126.2	177.2	-135.6	82.4	0	0	0	106.1	I34	I34-L36 HydrophobicContact CG2-CD1 4.24Å
37	D	25.9	Very low	28.4	Very low	168 Å²	168	155.1 Å²	155.1	90%	0.898	82%	0.818	S	S	*	*			trans	-134.5	127.3	148.6	-141.5	-9.6	0	0	0	111.8
38	T	27.3	Very low	29.1	Very low	96 Å²	96	151.1 Å²	151.1	59%	0.589	82%	0.82	S	S	*	*			trans	-113.5	106.8	-162.2	-45.8	0	0	0	0	106.7
39	S	27.7	Very low	29.6	Very low	121 Å²	121	150.9 Å²	150.9	85%	0.846	82%	0.818	S	S	*	*			trans	-132.2	99.4	158.4	63.1	0	0	0	0	110.2	N41	S39-N41 PolarHBondContact O-N 3.47Å
40	K	30	Very low	30.5	Very low	180 Å²	180	153.4 Å²	153.4	78%	0.783	82%	0.823	S	S	*	*			trans	-63.6	125.8	167.2	-72.3	175.4	175.6	175.2	0	108.6
41	N	28.2	Very low	31	Very low	163 Å²	163	152.4 Å²	152.4	87%	0.872	82%	0.819	S	S	*	*			trans	-125.4	100.2	150.6	-102.9	-19.1	0	0	0	108.7	S39 R43	S39-N41 PolarHBondContact O-N 3.47Å; N41-R43 PolarHBondContact O-N 2.87Å
42	N	29.5	Very low	31.6	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	82%	0.821	S	S	*	*			trans	-64.1	112.6	167.8	-91.1	-10.7	0	0	0	109.3
43	R	31.2	Very low	32.6	Very low	236 Å²	236	152.8 Å²	152.8	89%	0.891	81%	0.807	S	S	*	*			trans	-134.8	104.3	151.5	-73.5	-168.5	179.9	-175.4	1	109.1	N41 G45	N41-R43 PolarHBondContact O-N 2.87Å; R43-G45 PolarHBondContact O-N 3.4Å; R43-G45 VanDerWaalsContact O-N 3.14Å
44	I	37.8	Very low	33.3	Very low	178 Å²	178	152.5 Å²	152.5	91%	0.913	80%	0.804	S	S	*	*			trans	-67	102.3	162.1	-65.9	167.2	0	0	0	105.8
45	G	31.1	Very low	34.2	Very low	67 Å²	67	153.1 Å²	153.1	69%	0.691	81%	0.808	S	S	*	*			trans	-109.9	132.2	173.5	0	0	0	0	0	109.7	R43	R43-G45 PolarHBondContact O-N 3.4Å; R43-G45 VanDerWaalsContact O-N 3.14Å
46	K	31.7	Very low	35.5	Very low	208 Å²	208	148.6 Å²	148.6	90%	0.904	80%	0.8	S	S	*	*			trans	-56.6	142	-176.3	-72.5	172.8	173.3	177	0	112.4	G48	K46-G48 PolarHBondContact O-N 2.87Å
47	I	38.8	Very low	37	Very low	183 Å²	183	147.8 Å²	147.8	94%	0.938	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	119.1	168.5	-65.1	165.4	0	0	0	108.2
48	G	42	Very low	39	Very low	75 Å²	75	144 Å²	144	77%	0.773	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	142.8	3.9	165.7	0	0	0	0	0	119.4	K46	K46-G48 PolarHBondContact O-N 2.87Å
49	E	35.6	Very low	41.6	Very low	187 Å²	187	147.4 Å²	147.4	87%	0.874	78%	0.779	S	S	*	*			trans	-111.3	126.6	179.6	-73.7	-180	172.3	0	0	112.1
50	R	44.9	Very low	44.7	Very low	238 Å²	238	143.6 Å²	143.6	90%	0.898	75%	0.748	S	S	*	*			trans	-52.8	136.3	166.3	-70	178.4	178.2	-177.7	-2.5	108	S52	R50-S52 PolarHBondContact O-N 3.4Å
51	P	36.5	Very low	47.7	Very low	122 Å²	122	136.9 Å²	136.9	79%	0.792	72%	0.718	S	S	*	*			trans	-59.7	114.7	173.3	23	-29.2	0	0	0	108.6	Q53	P51-Q53 PolarHBondContact O-N 3.28Å; P51-Q53 VanDerWaalsContact O-N 3.14Å
52	S	36	Very low	50.8	Low	120 Å²	120	134 Å²	134	84%	0.839	71%	0.706	S	S	*	*			trans	-64.4	109.7	177.4	48	0	0	0	0	109.5	R50	R50-S52 PolarHBondContact O-N 3.4Å
53	Q	46.1	Very low	54	Low	87 Å²	87	129.7 Å²	129.7	41%	0.407	69%	0.687	S	S	.	*			trans	-75.8	134.8	168.9	-73.4	165.1	-23.8	0	0	109.3	P51 N55 G56 I57	P51-Q53 PolarHBondContact O-N 3.28Å; P51-Q53 VanDerWaalsContact O-N 3.14Å; Q53-N55 PolarHBondContact O-N 3.44Å; Q53-N55 VanDerWaalsContact O-N 3.16Å; Q53-G56 PolarHBondContact O-N 2.93Å; Q53-G56 VanDerWaalsContact O-N 3.16Å; Q53-I57 PolarHBondContact OE1-O 3.38Å
54	E	40.3	Very low	57.1	Low	183 Å²	183	119 Å²	119	86%	0.855	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-53	122.6	170.8	-78.2	-178.9	147.4	0	0	109.3	G56	E54-G56 PolarHBondContact O-N 3.07Å
55	N	45.4	Very low	59.8	Low	155 Å²	155	114.5 Å²	114.5	83%	0.829	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	73.4	8.3	179.6	-49.9	-33	0	0	0	117.9	Q53 I57	Q53-N55 PolarHBondContact O-N 3.44Å; Q53-N55 VanDerWaalsContact O-N 3.16Å; N55-I57 PolarHBondContact O-N 3.49Å
56	G	52.9	Low	62.8	Low	69 Å²	69	112.1 Å²	112.1	71%	0.711	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	69.4	15.7	172.5	0	0	0	0	0	115.5	Q53 E54	Q53-G56 PolarHBondContact O-N 2.93Å; Q53-G56 VanDerWaalsContact O-N 3.16Å; E54-G56 PolarHBondContact O-N 3.07Å
57	I	57.9	Low	65.8	Low	119 Å²	119	106.3 Å²	106.3	61%	0.61	59%	0.587	S	S	*	*			trans	-93.6	116.5	175.1	-60	173.6	0	0	0	109.1	Q53 N55 K59	Q53-I57 PolarHBondContact OE1-O 3.38Å; N55-I57 PolarHBondContact O-N 3.49Å; I57-K59 PolarHBondContact O-N 3.38Å; I57-K59 VanDerWaalsContact O-N 3.16Å
58	Q	68.4	Low	68.2	Low	87 Å²	87	99.8 Å²	99.8	41%	0.407	55%	0.554	S	S	.	*			trans	-62.9	112.8	173.1	-164.3	167.9	1.9	0	0	111.1	H60 E390	Q58-H60 PolarHBondContact O-N 2.79Å; Q58-E390 PolarHBondContact NE2-OE1 2.91Å; Q58-E390 PolarHBondContact NE2-OE2 2.85Å
59	K	82.1	Confident	70.2	Confident	168 Å²	168	99.3 Å²	99.3	73%	0.73	53%	0.531	S	S	*	.			trans	-86	109.8	176.9	-171	179.1	-179.1	-178.5	0	109.8	I57	I57-K59 PolarHBondContact O-N 3.38Å; I57-K59 VanDerWaalsContact O-N 3.16Å
60	H	91.3	Very high	72.2	Confident	42 Å²	42	94 Å²	94	19%	0.194	51%	0.514	C	S	.	.			trans	-76.6	156.2	175.1	-56.5	-60.4	0	0	0	112.7	Q58 R164	Q58-H60 PolarHBondContact O-N 2.79Å; H60-R164 PolarHBondContact NE2-NE 3.08Å
61	R	93.9	Very high	73.5	Confident	39 Å²	39	85.2 Å²	85.2	15%	0.147	48%	0.481	C	S	.	.			trans	-59.7	143.7	173	67.8	-177.4	-172.6	177.8	4.8	111.8	V384 E388 E412	R61-V384 HydrophobicContact CG-CG1 4.06Å; R61-V384 PolarHBondContact NE-O 3.36Å; R61-V384 PolarHBondContact NH2-O 2.65Å; R61-E388 VanDerWaalsContact CB-OE1 3.26Å; R61-E388 WeakPolarHBondContact CB-OE1 3.49Å; R61-E388 HydrophobicContact CG-CB 4.1Å; R61-E388 HydrophobicContact CG-CG 4.11Å; R61-E388 PolarHBondContact N-OE1 3.29Å; R61-E388 VanDerWaalsContact N-OE1 3.16Å; R61-E388 PolarHBondContact N-OE2 3.08Å; R61-E412 IonicContact CZ-OE1 3.45Å; R61-E412 IonicContact CZ-OE2 3.81Å; R61-E412 IonicContact NH1-OE1 3.9Å; R61-E412 PolarHBondContact NH1-OE1 3.18Å; R61-E412 VanDerWaalsContact NH1-OE1 3.14Å; R61-E412 IonicContact NH1-OE2 2.99Å; R61-E412 PolarHBondContact NH1-OE2 2.79Å; R61-E412 IonicContact NH2-OE1 3.17Å; R61-E412 PolarHBondContact NH2-OE1 3.17Å; R61-E412 IonicContact NH2-OE2 3.37Å
62	T	94	Very high	74.8	Confident	103 Å²	103	83.8 Å²	83.8	63%	0.632	47%	0.474	S	S	*	.	S	Bend	trans	-108.6	-2.1	178.2	56.4	0	0	0	0	112.8
63	S	95.8	Very high	75.7	Confident	57 Å²	57	84.3 Å²	84.3	40%	0.399	47%	0.467	S	S	.	.	S	Bend	trans	-146.5	153.7	177.8	57.5	0	0	0	0	111.9	M376	S63-M376 WeakPolarHBondContact CA-SD 3.36Å
64	L	96.3	Very high	76.5	Confident	13 Å²	13	85.5 Å²	85.5	7%	0.068	47%	0.471	C	S	.	.			trans	-74.4	158.1	168.3	-60.4	-177.8	0	0	0	110.7	A66 P100 M376 Y377 F379 V384 E412	L64-A66 VanDerWaalsContact C-N 3.28Å; L64-A66 PolarHBondContact O-N 3.16Å; L64-P100 HydrophobicContact CD1-CG 4.27Å; L64-M376 HydrophobicContact CB-CG 4.34Å; L64-M376 HydrophobicContact CB-SD 4.31Å; L64-M376 HydrophobicContact CD1-CB 3.87Å; L64-M376 HydrophobicContact CD1-CG 4.27Å; L64-M376 HydrophobicContact CG-CB 4.11Å; L64-M376 HydrophobicContact CG-CG 4.15Å; L64-M376 HydrophobicContact CG-SD 4.17Å; L64-M376 PolarHBondContact N-SD 3.38Å; L64-Y377 HydrophobicContact CD1-CD2 3.9Å; L64-Y377 HydrophobicContact CD1-CE2 4.2Å; L64-F379 HydrophobicContact CD1-CD2 4.11Å; L64-F379 HydrophobicContact CD1-CE2 4.06Å; L64-F379 HydrophobicContact CD2-CD2 4.37Å; L64-F379 HydrophobicContact CD2-CE2 4.44Å; L64-V384 HydrophobicContact CD2-CG1 4.48Å; L64-E412 HydrophobicContact CD2-CG 4.17Å
65	P	94.6	Very high	77.5	Confident	82 Å²	82	79.6 Å²	79.6	53%	0.532	45%	0.45	S	S	.	.	S	Bend	trans	-64.2	-30.5	177.4	-21.4	34.6	0	0	0	113.7	N413	P65-N413 WeakPolarHBondContact CB-OD1 3.49Å; P65-N413 WeakPolarHBondContact CG-OD1 3.34Å
66	A	95.1	Very high	78.2	Confident	18 Å²	18	73.2 Å²	73.2	15%	0.149	42%	0.417	C	S	.	.	S	Bend	trans	-134.3	152.1	176.3	0	0	0	0	0	111.2	L64	L64-A66 VanDerWaalsContact C-N 3.28Å; L64-A66 PolarHBondContact O-N 3.16Å
67	P	92.9	Very high	78.5	Confident	85 Å²	85	75 Å²	75	55%	0.552	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-69	157.9	170.5	31.2	-35.1	0	0	0	111	Q375	P67-Q375 CarbonylContact C-O 3.5Å; P67-Q375 VanDerWaalsContact CA-O 3.32Å; P67-Q375 WeakPolarHBondContact CA-O 3.26Å; P67-Q375 HydrophobicContact CB-CB 4.48Å
68	M	90.3	Very high	78.8	Confident	47 Å²	47	73.5 Å²	73.5	23%	0.232	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-63.8	146.4	172.2	72.9	172.6	-71.2	0	0	111.5	R71 A374 Q375 Y377	M68-R71 HydrophobicContact CE-CG 4.44Å; M68-A374 VanDerWaalsContact SD-O 3.38Å; M68-Q375 PolarHBondContact N-O 3.3Å; M68-Y377 HydrophobicContact CB-CD1 3.83Å; M68-Y377 HydrophobicContact CB-CD2 3.7Å; M68-Y377 HydrophobicContact CB-CE1 3.6Å; M68-Y377 HydrophobicContact CB-CE2 3.43Å; M68-Y377 VanDerWaalsContact CB-CE2 3.43Å; M68-Y377 HydrophobicContact CB-CG 3.88Å; M68-Y377 HydrophobicContact CE-CD1 4.11Å; M68-Y377 HydrophobicContact CE-CE1 4.35Å; M68-Y377 HydrophobicContact SD-CD1 4.37Å; M68-Y377 HydrophobicContact SD-CG 4.48Å
69	F	83.2	Confident	78.4	Confident	65 Å²	65	70.5 Å²	70.5	29%	0.285	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-70.5	149.9	174.2	-51.9	-87.5	0	0	0	111.5	R71 G414 M416	F69-R71 PolarHBondContact O-N 3Å; F69-G414 WeakPolarHBondContact CE1-O 3.42Å; F69-G414 VanDerWaalsContact CZ-C 3.41Å; F69-G414 VanDerWaalsContact CZ-O 3.32Å; F69-G414 WeakPolarHBondContact CZ-O 3.37Å; F69-M416 HydrophobicContact CD1-CG 3.82Å; F69-M416 HydrophobicContact CD1-SD 4.49Å; F69-M416 HydrophobicContact CD2-CE 4Å; F69-M416 HydrophobicContact CD2-CG 3.93Å; F69-M416 HydrophobicContact CD2-SD 3.49Å; F69-M416 WeakPolarHBondContact CD2-SD 3.44Å; F69-M416 HydrophobicContact CE1-CG 3.36Å; F69-M416 HydrophobicContact CE1-SD 4.15Å; F69-M416 HydrophobicContact CE2-CE 4.21Å; F69-M416 HydrophobicContact CE2-CG 3.53Å; F69-M416 HydrophobicContact CE2-SD 3.1Å; F69-M416 WeakPolarHBondContact CE2-SD 3.49Å; F69-M416 HydrophobicContact CG-CE 4.43Å; F69-M416 HydrophobicContact CG-CG 4.06Å; F69-M416 HydrophobicContact CG-SD 4.17Å; F69-M416 HydrophobicContact CZ-CB 4.47Å; F69-M416 HydrophobicContact CZ-CG 3.16Å; F69-M416 HydrophobicContact CZ-SD 3.43Å; F69-M416 WeakPolarHBondContact CZ-SD 3.33Å
70	S	78.1	Confident	77.4	Confident	76 Å²	76	63.2 Å²	63.2	53%	0.531	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-65.6	127.3	170.5	-170.8	0	0	0	0	109.9	S72	S70-S72 WeakPolarHBondContact OG-CB 3.37Å; S70-S72 PolarHBondContact OG-N 3.45Å; S70-S72 PolarHBondContact OG-OG 3.24Å
71	R	71.6	Confident	75.8	Confident	52 Å²	52	68 Å²	68	20%	0.196	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-85	1	173.4	-64.8	-176.7	176.6	166.6	3.4	112.7	M68 F69 D73 F74 A96 N98 T148	M68-R71 HydrophobicContact CE-CG 4.44Å; F69-R71 PolarHBondContact O-N 3Å; R71-D73 PolarHBondContact O-N 3.45Å; R71-D73 VanDerWaalsContact O-N 3.16Å; R71-F74 PolarHBondContact O-N 3.06Å; R71-A96 PolarHBondContact NE-O 2.85Å; R71-N98 PolarHBondContact NH2-O 3.49Å; R71-T148 PolarHBondContact NH1-OG1 2.84Å
72	S	63.7	Low	73.9	Confident	92 Å²	92	74.4 Å²	74.4	64%	0.643	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27.1	-177.8	53.2	0	0	0	0	113.7	S70	S70-S72 WeakPolarHBondContact OG-CB 3.37Å; S70-S72 PolarHBondContact OG-N 3.45Å; S70-S72 PolarHBondContact OG-OG 3.24Å
73	D	55.8	Low	71.9	Confident	132 Å²	132	70.1 Å²	70.1	71%	0.706	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-93.8	-2.8	-170	-52.1	-16.8	0	0	0	112.1	R71	R71-D73 PolarHBondContact O-N 3.45Å; R71-D73 VanDerWaalsContact O-N 3.16Å
74	F	62.4	Low	69.8	Low	111 Å²	111	73.2 Å²	73.2	49%	0.487	39%	0.393	S	S	.	.			trans	-120.9	117.9	-176.1	-67.4	-86.2	0	0	0	112.1	R71 A96 F97	R71-F74 PolarHBondContact O-N 3.06Å; F74-A96 HydrophobicContact CD1-CB 4.19Å; F74-A96 HydrophobicContact CD2-CB 3.64Å; F74-A96 HydrophobicContact CE1-CB 4.3Å; F74-A96 HydrophobicContact CE2-CB 3.76Å; F74-A96 HydrophobicContact CG-CB 3.87Å; F74-A96 HydrophobicContact CZ-CB 4.09Å; F74-F97 HydrophobicContact CB-CE2 3.93Å; F74-F97 HydrophobicContact CB-CZ 3.65Å
75	S	61.5	Low	67.7	Low	59 Å²	59	76.4 Å²	76.4	41%	0.413	43%	0.429	S	S	.	.			trans	-92.3	122.1	173	180	0	0	0	0	111.6	W77 T78	S75-W77 PolarHBondContact O-N 2.83Å; S75-W77 WeakPolarHBondContact OG-CB 3.31Å; S75-W77 PolarHBondContact OG-N 2.68Å; S75-T78 PolarHBondContact O-N 2.88Å
76	V	60.4	Low	65.8	Low	22 Å²	22	77.7 Å²	77.7	13%	0.133	43%	0.431	C	S	.	.	H	α-helix	trans	-61.6	-29.5	172.8	-174.8	0	0	0	0	111	T78 I79 L80 F97 V242	V76-T78 VanDerWaalsContact C-N 3.33Å; V76-T78 PolarHBondContact O-N 2.88Å; V76-I79 WeakPolarHBondContact O-CB 3.41Å; V76-I79 PolarHBondContact O-N 2.8Å; V76-I79 VanDerWaalsContact O-N 3.11Å; V76-L80 HydrophobicContact CG1-CD1 3.78Å; V76-L80 HydrophobicContact CG1-CG 3.97Å; V76-L80 PolarHBondContact O-N 3.31Å; V76-F97 HydrophobicContact CB-CE1 4.35Å; V76-F97 HydrophobicContact CB-CZ 4.34Å; V76-F97 HydrophobicContact CG2-CD1 3.81Å; V76-F97 HydrophobicContact CG2-CE1 3.13Å; V76-F97 HydrophobicContact CG2-CE2 4.49Å; V76-F97 HydrophobicContact CG2-CZ 3.52Å; V76-V242 WeakPolarHBondContact CB-O 3.29Å; V76-V242 WeakPolarHBondContact CG1-O 3.34Å
77	W	60.1	Low	63.9	Low	107 Å²	107	82.2 Å²	82.2	41%	0.405	45%	0.45	S	S	.	.	H	α-helix	trans	-61.7	-37.5	177	-179.7	-121.1	0	0	0	113.3	S75 I79 L80 K81 I243	S75-W77 PolarHBondContact O-N 2.83Å; S75-W77 WeakPolarHBondContact OG-CB 3.31Å; S75-W77 PolarHBondContact OG-N 2.68Å; W77-I79 PolarHBondContact O-N 2.94Å; W77-L80 HydrophobicContact CE3-CB 4.28Å; W77-L80 PolarHBondContact O-N 3.17Å; W77-K81 WeakPolarHBondContact O-CB 3.17Å; W77-K81 PolarHBondContact O-N 3.12Å; W77-I243 HydrophobicContact CB-CG2 4.16Å; W77-I243 HydrophobicContact CD2-CG2 3.61Å; W77-I243 HydrophobicContact CE3-CB 3.93Å; W77-I243 HydrophobicContact CE3-CD1 3.88Å; W77-I243 HydrophobicContact CE3-CG1 3.63Å; W77-I243 HydrophobicContact CE3-CG2 3.2Å; W77-I243 HydrophobicContact CG-CG2 4.06Å; W77-I243 HydrophobicContact CH2-CD1 4.43Å; W77-I243 HydrophobicContact CZ3-CB 4.37Å; W77-I243 HydrophobicContact CZ3-CD1 3.47Å; W77-I243 VanDerWaalsContact CZ3-CD1 3.47Å; W77-I243 HydrophobicContact CZ3-CG1 3.79Å; W77-I243 HydrophobicContact CZ3-CG2 3.72Å
78	T	62.5	Low	62	Low	87 Å²	87	80 Å²	80	53%	0.534	43%	0.433	S	S	.	.	H	α-helix	trans	-62	-28.3	177.6	-50.7	0	0	0	0	111.6	S75 V76	S75-T78 PolarHBondContact O-N 2.88Å; V76-T78 VanDerWaalsContact C-N 3.33Å; V76-T78 PolarHBondContact O-N 2.88Å
79	I	62	Low	60	Low	24 Å²	24	81.6 Å²	81.6	12%	0.123	45%	0.449	C	S	.	.	H	α-helix	trans	-79.8	-57.5	173	-57.6	155.2	0	0	0	109.1	V76 W77 K81 K82 C83 I91 M93 P94 F97	V76-I79 WeakPolarHBondContact O-CB 3.41Å; V76-I79 PolarHBondContact O-N 2.8Å; V76-I79 VanDerWaalsContact O-N 3.11Å; W77-I79 PolarHBondContact O-N 2.94Å; I79-K81 PolarHBondContact O-N 3.05Å; I79-K81 VanDerWaalsContact O-N 3.15Å; I79-K82 WeakPolarHBondContact O-CA 3.46Å; I79-K82 VanDerWaalsContact O-CB 3.32Å; I79-K82 WeakPolarHBondContact O-CB 3.4Å; I79-K82 PolarHBondContact O-N 3.03Å; I79-C83 PolarHBondContact O-N 2.87Å; I79-C83 PolarHBondContact O-SG 3.45Å; I79-I91 HydrophobicContact CG2-CG2 4.2Å; I79-M93 HydrophobicContact CG2-SD 4.38Å; I79-P94 HydrophobicContact CD1-CG 3.56Å; I79-P94 HydrophobicContact CG1-CG 3.95Å; I79-F97 HydrophobicContact CD1-CD2 3.71Å; I79-F97 HydrophobicContact CD1-CE2 3.32Å; I79-F97 HydrophobicContact CD1-CZ 4.17Å
80	L	59.3	Low	58.5	Low	14 Å²	14	80.8 Å²	80.8	7%	0.073	45%	0.445	C	S	.	.	H	α-helix	trans	-58.6	-31.3	-176.1	-69.7	174.1	0	0	0	113.8	V76 W77 K82 C83 V84 L88 F206 V242 I243	V76-L80 HydrophobicContact CG1-CD1 3.78Å; V76-L80 HydrophobicContact CG1-CG 3.97Å; V76-L80 PolarHBondContact O-N 3.31Å; W77-L80 HydrophobicContact CE3-CB 4.28Å; W77-L80 PolarHBondContact O-N 3.17Å; L80-K82 VanDerWaalsContact C-N 3.27Å; L80-K82 PolarHBondContact O-N 3.08Å; L80-C83 WeakPolarHBondContact O-CA 3.24Å; L80-C83 VanDerWaalsContact O-CB 3.3Å; L80-C83 WeakPolarHBondContact O-CB 3.46Å; L80-C83 PolarHBondContact O-N 2.93Å; L80-V84 PolarHBondContact O-N 3.12Å; L80-L88 HydrophobicContact CD2-CD2 3.98Å; L80-F206 HydrophobicContact CD1-CE2 3.93Å; L80-F206 HydrophobicContact CD1-CZ 4.26Å; L80-F206 HydrophobicContact CD2-CE2 4.03Å; L80-F206 HydrophobicContact CD2-CZ 4.43Å; L80-V242 HydrophobicContact CD1-CB 4.1Å; L80-V242 HydrophobicContact CD1-CG2 3.77Å; L80-V242 WeakPolarHBondContact CD1-O 3.35Å; L80-I243 HydrophobicContact CD1-CG1 3.76Å
81	K	59.5	Low	57.4	Low	144 Å²	144	78.5 Å²	78.5	63%	0.626	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-61.8	-34.6	173.2	-174.9	179.7	178.3	-175.6	0	112	W77 I79 C83	W77-K81 WeakPolarHBondContact O-CB 3.17Å; W77-K81 PolarHBondContact O-N 3.12Å; I79-K81 PolarHBondContact O-N 3.05Å; I79-K81 VanDerWaalsContact O-N 3.15Å; K81-C83 PolarHBondContact O-N 2.77Å
82	K	53.7	Low	56.8	Low	173 Å²	173	79.3 Å²	79.3	75%	0.752	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-76.1	-11.1	173	-60.5	179.9	178.6	-172.9	0	112.3	I79 L80	I79-K82 WeakPolarHBondContact O-CA 3.46Å; I79-K82 VanDerWaalsContact O-CB 3.32Å; I79-K82 WeakPolarHBondContact O-CB 3.4Å; I79-K82 PolarHBondContact O-N 3.03Å; L80-K82 VanDerWaalsContact C-N 3.27Å; L80-K82 PolarHBondContact O-N 3.08Å
83	C	50.8	Low	56.8	Low	13 Å²	13	76.9 Å²	76.9	9%	0.088	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-102	-1.5	-174	-52.7	0	0	0	0	114.3	I79 L80 K81 G85 L86 I91	I79-C83 PolarHBondContact O-N 2.87Å; I79-C83 PolarHBondContact O-SG 3.45Å; L80-C83 WeakPolarHBondContact O-CA 3.24Å; L80-C83 VanDerWaalsContact O-CB 3.3Å; L80-C83 WeakPolarHBondContact O-CB 3.46Å; L80-C83 PolarHBondContact O-N 2.93Å; K81-C83 PolarHBondContact O-N 2.77Å; C83-G85 PolarHBondContact O-N 2.9Å; C83-L86 PolarHBondContact O-N 3.44Å; C83-L86 VanDerWaalsContact O-N 3.13Å; C83-I91 HydrophobicContact CB-CD1 3.47Å; C83-I91 VanDerWaalsContact CB-CD1 3.47Å; C83-I91 WeakPolarHBondContact SG-CD1 3.39Å
84	V	51.3	Low	57.5	Low	121 Å²	121	72.8 Å²	72.8	73%	0.733	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	110.2	-178.4	-177.8	0	0	0	0	109.6	L80	L80-V84 PolarHBondContact O-N 3.12Å
85	G	52.6	Low	58.2	Low	80 Å²	80	68.2 Å²	68.2	83%	0.825	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.5	0.5	179.7	0	0	0	0	0	116	C83	C83-G85 PolarHBondContact O-N 2.9Å
86	L	55.1	Low	59.1	Low	109 Å²	109	65.9 Å²	65.9	57%	0.571	36%	0.361	S	S	*	.	S	Bend	trans	-111.2	155.2	177.5	-63.8	174.9	0	0	0	112.3	C83 L88 I91	C83-L86 PolarHBondContact O-N 3.44Å; C83-L86 VanDerWaalsContact O-N 3.13Å; L86-L88 PolarHBondContact O-N 2.84Å; L86-I91 HydrophobicContact CB-CD1 4.34Å
87	E	54.4	Low	60.1	Low	114 Å²	114	65.4 Å²	65.4	53%	0.533	36%	0.358	S	S	.	.			trans	-67.9	127.4	167.8	-72	-170.7	145.7	0	0	110.7	S89 K90	E87-S89 PolarHBondContact O-N 2.83Å; E87-S89 VanDerWaalsContact O-N 3.09Å; E87-K90 HydrophobicContact CB-CG 4.35Å; E87-K90 PolarHBondContact O-N 3.49Å
88	L	53.2	Low	61.5	Low	38 Å²	38	60.4 Å²	60.4	20%	0.199	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-57.8	-25.5	-177.5	-76.7	178.8	0	0	0	114.4	L80 L86 K90 I91 F206 V211	L80-L88 HydrophobicContact CD2-CD2 3.98Å; L86-L88 PolarHBondContact O-N 2.84Å; L88-K90 PolarHBondContact O-N 3.41Å; L88-I91 HydrophobicContact CD2-CD1 4.35Å; L88-I91 PolarHBondContact O-N 3.49Å; L88-F206 HydrophobicContact CD1-CB 3.73Å; L88-F206 HydrophobicContact CD1-CD2 4.34Å; L88-F206 HydrophobicContact CD1-CG 4.37Å; L88-F206 HydrophobicContact CG-CB 4.34Å; L88-V211 HydrophobicContact CD1-CG1 4.19Å; L88-V211 HydrophobicContact CD1-CG2 3.89Å
89	S	48.3	Very low	63	Low	81 Å²	81	56.2 Å²	56.2	57%	0.566	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-67.5	-22.4	177.7	45.7	0	0	0	0	113.4	E87 I91	E87-S89 PolarHBondContact O-N 2.83Å; E87-S89 VanDerWaalsContact O-N 3.09Å; S89-I91 VanDerWaalsContact C-N 3.3Å; S89-I91 PolarHBondContact O-N 2.76Å
90	K	51.3	Low	64.7	Low	48 Å²	48	55.1 Å²	55.1	21%	0.209	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-87.4	4.3	-177.8	-60.6	-172.6	177	-170.7	0	113.6	F8 A10 E87 L88	F8-K90 PolarHBondContact O-NZ 3.32Å; A10-K90 WeakPolarHBondContact CB-O 3.32Å; E87-K90 HydrophobicContact CB-CG 4.35Å; E87-K90 PolarHBondContact O-N 3.49Å; L88-K90 PolarHBondContact O-N 3.41Å
91	I	56.6	Low	66.6	Low	28 Å²	28	54.4 Å²	54.4	14%	0.144	30%	0.304	C	S	.	.	S	Bend	trans	-111.2	121.1	-173.3	-65.5	147.6	0	0	0	110	I79 C83 L86 L88 S89 M93	I79-I91 HydrophobicContact CG2-CG2 4.2Å; C83-I91 HydrophobicContact CB-CD1 3.47Å; C83-I91 VanDerWaalsContact CB-CD1 3.47Å; C83-I91 WeakPolarHBondContact SG-CD1 3.39Å; L86-I91 HydrophobicContact CB-CD1 4.34Å; L88-I91 HydrophobicContact CD2-CD1 4.35Å; L88-I91 PolarHBondContact O-N 3.49Å; S89-I91 VanDerWaalsContact C-N 3.3Å; S89-I91 PolarHBondContact O-N 2.76Å; I91-M93 PolarHBondContact O-N 3.19Å; I91-M93 VanDerWaalsContact O-N 3.08Å
92	T	58.3	Low	68.4	Low	68 Å²	68	47.6 Å²	47.6	42%	0.417	27%	0.274	S	S	.	.			trans	-69.8	106.3	172.5	-54.6	0	0	0	0	109.2	E427	T92-E427 WeakPolarHBondContact CG2-OE2 3.22Å; T92-E427 PolarHBondContact OG1-OE2 2.9Å
93	M	64.4	Low	70.5	Confident	41 Å²	41	41.1 Å²	41.1	20%	0.202	25%	0.246	C	C	.	.			trans	-65.1	133.3	174	-72.2	-66.7	-67.2	0	0	109.7	I79 I91 I95 F97 K150 K423	I79-M93 HydrophobicContact CG2-SD 4.38Å; I91-M93 PolarHBondContact O-N 3.19Å; I91-M93 VanDerWaalsContact O-N 3.08Å; M93-I95 PolarHBondContact O-N 2.79Å; M93-F97 HydrophobicContact CE-CB 3.9Å; M93-F97 HydrophobicContact CE-CD2 4.23Å; M93-F97 HydrophobicContact CE-CG 4.04Å; M93-K150 HydrophobicContact CB-CD 4.16Å; M93-K150 HydrophobicContact CG-CD 3.82Å; M93-K423 PolarHBondContact O-NZ 3.23Å
94	P	69.6	Low	72.8	Confident	47 Å²	47	40.5 Å²	40.5	31%	0.305	24%	0.242	S	C	.	.			trans	-57	141	172.6	-28	38.8	0	0	0	111.1	I79 A96 F97	I79-P94 HydrophobicContact CD1-CG 3.56Å; I79-P94 HydrophobicContact CG1-CG 3.95Å; P94-A96 PolarHBondContact O-N 3.06Å; P94-F97 HydrophobicContact CB-CD2 4.14Å; P94-F97 HydrophobicContact CB-CE2 4.49Å; P94-F97 HydrophobicContact CG-CD2 4.41Å; P94-F97 PolarHBondContact O-N 2.93Å
95	I	77.9	Confident	75	Confident	15 Å²	15	34.7 Å²	34.7	8%	0.077	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-60.3	-23.2	-173.2	-165.1	157.1	0	0	0	113.3	M93 F97 N98 F152 M411 M416 A419 S420 K423	M93-I95 PolarHBondContact O-N 2.79Å; I95-F97 PolarHBondContact O-N 3.11Å; I95-N98 VanDerWaalsContact O-CB 3.32Å; I95-N98 WeakPolarHBondContact O-CB 3.29Å; I95-N98 PolarHBondContact O-N 2.82Å; I95-F152 HydrophobicContact CD1-CE1 4.07Å; I95-F152 HydrophobicContact CD1-CZ 3.81Å; I95-F152 HydrophobicContact CG1-CE1 4.39Å; I95-F152 HydrophobicContact CG1-CZ 3.88Å; I95-M411 HydrophobicContact CG1-SD 3.94Å; I95-M411 VanDerWaalsContact O-CE 3.27Å; I95-M411 WeakPolarHBondContact O-CE 3.15Å; I95-M416 HydrophobicContact CB-CE 4.48Å; I95-M416 HydrophobicContact CG1-CE 4.49Å; I95-M416 HydrophobicContact CG2-CE 3.61Å; I95-A419 HydrophobicContact CD1-CB 3.34Å; I95-A419 WeakPolarHBondContact CD1-O 3.48Å; I95-A419 HydrophobicContact CG1-CB 4.49Å; I95-S420 WeakPolarHBondContact CG2-OG 3.36Å; I95-K423 HydrophobicContact CD1-CD 4.38Å
96	A	79.1	Confident	77.2	Confident	9 Å²	9	31.7 Å²	31.7	7%	0.074	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-60.5	-25.9	174.3	0	0	0	0	0	113.8	R71 F74 P94 N98 M416	R71-A96 PolarHBondContact NE-O 2.85Å; F74-A96 HydrophobicContact CD1-CB 4.19Å; F74-A96 HydrophobicContact CD2-CB 3.64Å; F74-A96 HydrophobicContact CE1-CB 4.3Å; F74-A96 HydrophobicContact CE2-CB 3.76Å; F74-A96 HydrophobicContact CG-CB 3.87Å; F74-A96 HydrophobicContact CZ-CB 4.09Å; P94-A96 PolarHBondContact O-N 3.06Å; A96-N98 VanDerWaalsContact C-N 3.33Å; A96-M416 HydrophobicContact CB-CE 4.37Å
97	F	81.6	Confident	79.2	Confident	12 Å²	12	26.5 Å²	26.5	5%	0.053	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-86.2	-8.6	175.2	-66.8	-71.3	0	0	0	113.1	F74 V76 I79 M93 P94 I95 G149 K150	F74-F97 HydrophobicContact CB-CE2 3.93Å; F74-F97 HydrophobicContact CB-CZ 3.65Å; V76-F97 HydrophobicContact CB-CE1 4.35Å; V76-F97 HydrophobicContact CB-CZ 4.34Å; V76-F97 HydrophobicContact CG2-CD1 3.81Å; V76-F97 HydrophobicContact CG2-CE1 3.13Å; V76-F97 HydrophobicContact CG2-CE2 4.49Å; V76-F97 HydrophobicContact CG2-CZ 3.52Å; I79-F97 HydrophobicContact CD1-CD2 3.71Å; I79-F97 HydrophobicContact CD1-CE2 3.32Å; I79-F97 HydrophobicContact CD1-CZ 4.17Å; M93-F97 HydrophobicContact CE-CB 3.9Å; M93-F97 HydrophobicContact CE-CD2 4.23Å; M93-F97 HydrophobicContact CE-CG 4.04Å; P94-F97 HydrophobicContact CB-CD2 4.14Å; P94-F97 HydrophobicContact CB-CE2 4.49Å; P94-F97 HydrophobicContact CG-CD2 4.41Å; P94-F97 PolarHBondContact O-N 2.93Å; I95-F97 PolarHBondContact O-N 3.11Å; F97-G149 WeakPolarHBondContact O-CA 3.23Å; F97-K150 PolarHBondContact O-N 3.25Å
98	N	90.2	Very high	81.3	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.011	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	168.5	175.5	-74.2	99.4	0	0	0	111.6	R71 I95 A96 K150 P151 F152 M411 K423	R71-N98 PolarHBondContact NH2-O 3.49Å; I95-N98 VanDerWaalsContact O-CB 3.32Å; I95-N98 WeakPolarHBondContact O-CB 3.29Å; I95-N98 PolarHBondContact O-N 2.82Å; A96-N98 VanDerWaalsContact C-N 3.33Å; N98-K150 CarbonylContact C-O 3.59Å; N98-K150 WeakPolarHBondContact CA-O 3.49Å; N98-K150 WeakPolarHBondContact CB-O 3.43Å; N98-K150 PolarHBondContact ND2-O 3.37Å; N98-P151 PolarHBondContact ND2-O 3.48Å; N98-F152 HydrophobicContact CB-CD2 4.12Å; N98-F152 HydrophobicContact CB-CE2 3.67Å; N98-F152 HydrophobicContact CB-CZ 4.09Å; N98-M411 VanDerWaalsContact C-CE 3.47Å; N98-M411 HydrophobicContact CB-CE 4.01Å; N98-M411 HydrophobicContact CB-SD 3.8Å; N98-M411 WeakPolarHBondContact O-CE 3.4Å; N98-K423 PolarHBondContact OD1-NZ 2.75Å
99	E	94.6	Very high	83.5	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	155.8	157	59.3	179.2	-158.1	0	0	107.3	L101 R106 R147 K150 F152 Y377 F379	E99-L101 PolarHBondContact O-N 2.8Å; E99-R106 IonicContact OE1-CZ 2.8Å; E99-R106 VanDerWaalsContact OE1-CZ 3.23Å; E99-R106 IonicContact OE1-NE 3.14Å; E99-R106 PolarHBondContact OE1-NE 3.27Å; E99-R106 VanDerWaalsContact OE1-NE 3.09Å; E99-R106 IonicContact OE1-NH2 3.71Å; E99-R106 PolarHBondContact OE1-NH2 3.17Å; E99-R106 IonicContact OE2-CZ 3.12Å; E99-R106 IonicContact OE2-NH2 2.65Å; E99-R106 PolarHBondContact OE2-NH2 2.79Å; E99-R147 IonicContact OE1-CZ 3.85Å; E99-R147 IonicContact OE1-NE 2.83Å; E99-R147 IonicContact OE1-NH2 2.79Å; E99-R147 PolarHBondContact OE1-NH2 3.5Å; E99-R147 IonicContact OE2-CZ 3.96Å; E99-R147 IonicContact OE2-NE 3.4Å; E99-R147 PolarHBondContact OE2-NE 3.35Å; E99-R147 IonicContact OE2-NH2 3.28Å; E99-R147 PolarHBondContact OE2-NH2 2.91Å; E99-R147 VanDerWaalsContact OE2-NH2 3.12Å; E99-K150 PolarHBondContact N-O 2.82Å; E99-F152 VanDerWaalsContact O-CD2 3.27Å; E99-F152 WeakPolarHBondContact O-CD2 3.46Å; E99-F152 VanDerWaalsContact O-CE2 3.3Å; E99-F152 WeakPolarHBondContact O-CE2 3.38Å; E99-Y377 HydrophobicContact CB-CD1 3.98Å; E99-Y377 HydrophobicContact CB-CG 4.22Å; E99-F379 HydrophobicContact CB-CE1 4.11Å; E99-F379 HydrophobicContact CB-CZ 4.09Å; E99-F379 HydrophobicContact CG-CE1 4.47Å
100	P	97	Very high	85.9	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	54.9	-172.9	33.6	-38	0	0	0	112.3	L64 Y377 F379 I408 M411 E412	L64-P100 HydrophobicContact CD1-CG 4.27Å; P100-Y377 VanDerWaalsContact CD-CD2 3.47Å; P100-Y377 HydrophobicContact CG-CD2 3.91Å; P100-Y377 HydrophobicContact CG-CE2 3.69Å; P100-F379 HydrophobicContact CG-CE2 4.14Å; P100-F379 HydrophobicContact CG-CZ 4.16Å; P100-I408 HydrophobicContact CB-CG2 4.47Å; P100-I408 WeakPolarHBondContact O-CG2 3.17Å; P100-M411 HydrophobicContact CB-CB 4.44Å; P100-M411 HydrophobicContact CB-CG 4.29Å; P100-E412 HydrophobicContact CB-CB 3.72Å; P100-E412 HydrophobicContact CB-CG 4.01Å; P100-E412 HydrophobicContact CG-CB 4.38Å; P100-E412 HydrophobicContact CG-CG 4.2Å
101	L	98	Very high	88.2	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	144.3	174.3	-67.6	175.2	0	0	0	110.7	E99 Q105 P151 F152 F379 T383 L386 N387	E99-L101 PolarHBondContact O-N 2.8Å; L101-Q105 VanDerWaalsContact CA-OE1 3.27Å; L101-Q105 HydrophobicContact CB-CB 4.24Å; L101-Q105 HydrophobicContact CD2-CB 4.02Å; L101-Q105 HydrophobicContact CD2-CG 4.44Å; L101-Q105 VanDerWaalsContact CD2-OE1 3.32Å; L101-P151 CarbonylContact O-C 3.23Å; L101-P151 VanDerWaalsContact O-CA 3.31Å; L101-P151 WeakPolarHBondContact O-CA 2.92Å; L101-P151 WeakPolarHBondContact O-CB 3.44Å; L101-F152 PolarHBondContact O-N 3.04Å; L101-F379 HydrophobicContact CD1-CE1 3.96Å; L101-F379 HydrophobicContact CD1-CE2 4Å; L101-F379 HydrophobicContact CD1-CZ 3.54Å; L101-F379 HydrophobicContact CG-CE2 4.08Å; L101-F379 HydrophobicContact CG-CZ 3.73Å; L101-T383 HydrophobicContact CD1-CG2 3.46Å; L101-T383 VanDerWaalsContact CD1-CG2 3.46Å; L101-L386 HydrophobicContact CD2-CB 4.23Å; L101-N387 HydrophobicContact CD2-CB 3.94Å
102	S	98.3	Very high	90.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	154.7	164.5	175.9	0	0	0	0	110.4	L104 Q105 R106 P154 E158	S102-L104 PolarHBondContact O-N 2.96Å; S102-L104 PolarHBondContact OG-N 3.07Å; S102-Q105 WeakPolarHBondContact O-CB 3.4Å; S102-Q105 PolarHBondContact O-N 3.04Å; S102-Q105 VanDerWaalsContact O-N 3.11Å; S102-R106 PolarHBondContact O-N 3.45Å; S102-P154 WeakPolarHBondContact OG-CG 3.32Å; S102-E158 VanDerWaalsContact CB-OE1 3.27Å; S102-E158 WeakPolarHBondContact CB-OE1 3.44Å; S102-E158 PolarHBondContact OG-OE1 2.92Å
103	F	97.7	Very high	92.1	Very high	37 Å²	37	10.5 Å²	10.5	16%	0.162	5%	0.053	C	C	.	.	H	α-helix	trans	-60.6	-27.5	171	-173.2	-123.1	0	0	0	112.1	Q105 R106 I107 P151 F152 P154 S183 I200 P202	F103-Q105 VanDerWaalsContact C-N 3.33Å; F103-Q105 PolarHBondContact O-N 3.29Å; F103-R106 HydrophobicContact CD2-CB 4.1Å; F103-R106 HydrophobicContact CD2-CG 4.19Å; F103-R106 HydrophobicContact CE2-CG 4.36Å; F103-R106 WeakPolarHBondContact O-CB 3.48Å; F103-R106 PolarHBondContact O-N 2.9Å; F103-I107 HydrophobicContact CD1-CD1 3.91Å; F103-I107 HydrophobicContact CD1-CG1 4.46Å; F103-I107 HydrophobicContact CE1-CD1 3.64Å; F103-I107 HydrophobicContact CE1-CG1 4.14Å; F103-I107 HydrophobicContact CE2-CG1 4.38Å; F103-I107 HydrophobicContact CZ-CD1 4.09Å; F103-I107 HydrophobicContact CZ-CG1 4.09Å; F103-I107 WeakPolarHBondContact O-CG1 3.28Å; F103-I107 PolarHBondContact O-N 2.99Å; F103-P151 HydrophobicContact CB-CB 4.36Å; F103-P151 HydrophobicContact CB-CG 4.26Å; F103-P151 HydrophobicContact CD2-CG 3.81Å; F103-P151 HydrophobicContact CG-CG 4.5Å; F103-F152 PolarHBondContact N-O 2.9Å; F103-P154 HydrophobicContact CB-CG 3.72Å; F103-S183 WeakPolarHBondContact CD1-OG 3.38Å; F103-I200 HydrophobicContact CE1-CB 4.46Å; F103-I200 HydrophobicContact CE1-CG2 4.02Å; F103-I200 HydrophobicContact CZ-CG2 3.8Å; F103-P202 HydrophobicContact CE1-CG 3.89Å; F103-P202 HydrophobicContact CZ-CB 4.26Å; F103-P202 HydrophobicContact CZ-CG 3.96Å
104	L	98.8	Very high	93.7	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-61	-42.3	173.3	-58.1	-171.3	0	0	0	112	S102 I107 T108 P154 E158 S173	S102-L104 PolarHBondContact O-N 2.96Å; S102-L104 PolarHBondContact OG-N 3.07Å; L104-I107 PolarHBondContact O-N 2.79Å; L104-T108 PolarHBondContact O-N 2.77Å; L104-T108 VanDerWaalsContact O-N 3.15Å; L104-T108 PolarHBondContact O-OG1 2.91Å; L104-P154 HydrophobicContact CD1-CB 4.33Å; L104-P154 HydrophobicContact CD2-CB 4.29Å; L104-P154 HydrophobicContact CD2-CG 3.97Å; L104-P154 HydrophobicContact CG-CB 3.98Å; L104-P154 HydrophobicContact CG-CG 3.79Å; L104-E158 HydrophobicContact CD1-CB 4.25Å; L104-E158 HydrophobicContact CD1-CG 3.93Å; L104-E158 WeakPolarHBondContact CD1-O 3.49Å; L104-S173 WeakPolarHBondContact CB-OG 3.34Å
105	Q	98.8	Very high	95.1	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-67.2	-40.4	173.8	-72.2	166.6	-32.7	0	0	111.4	L101 S102 F103 I107 T108 E109 Y160 L386 N387 C402	L101-Q105 VanDerWaalsContact CA-OE1 3.27Å; L101-Q105 HydrophobicContact CB-CB 4.24Å; L101-Q105 HydrophobicContact CD2-CB 4.02Å; L101-Q105 HydrophobicContact CD2-CG 4.44Å; L101-Q105 VanDerWaalsContact CD2-OE1 3.32Å; S102-Q105 WeakPolarHBondContact O-CB 3.4Å; S102-Q105 PolarHBondContact O-N 3.04Å; S102-Q105 VanDerWaalsContact O-N 3.11Å; F103-Q105 VanDerWaalsContact C-N 3.33Å; F103-Q105 PolarHBondContact O-N 3.29Å; Q105-I107 VanDerWaalsContact C-N 3.3Å; Q105-I107 PolarHBondContact O-N 2.96Å; Q105-T108 WeakPolarHBondContact O-CB 3.32Å; Q105-T108 PolarHBondContact O-N 3.37Å; Q105-E109 PolarHBondContact O-N 2.9Å; Q105-Y160 HydrophobicContact CG-CD1 3.99Å; Q105-Y160 HydrophobicContact CG-CD2 3.58Å; Q105-Y160 HydrophobicContact CG-CE1 3.9Å; Q105-Y160 HydrophobicContact CG-CE2 3.47Å; Q105-Y160 VanDerWaalsContact CG-CE2 3.47Å; Q105-Y160 HydrophobicContact CG-CG 3.83Å; Q105-L386 HydrophobicContact CB-CD1 4.29Å; Q105-L386 WeakPolarHBondContact O-CD1 3.24Å; Q105-N387 PolarHBondContact NE2-OD1 2.86Å; Q105-C402 PolarHBondContact NE2-SG 2.98Å; Q105-C402 VanDerWaalsContact NE2-SG 3.36Å
106	R	97.7	Very high	96.1	Very high	16 Å²	16	10.5 Å²	10.5	6%	0.06	5%	0.045	C	C	.	.	H	α-helix	trans	-58.9	-39.6	175.3	177.5	67.4	77.3	125.8	5.8	112.1	E99 S102 F103 T108 E109 R147 G149 P151	E99-R106 IonicContact OE1-CZ 2.8Å; E99-R106 VanDerWaalsContact OE1-CZ 3.23Å; E99-R106 IonicContact OE1-NE 3.14Å; E99-R106 PolarHBondContact OE1-NE 3.27Å; E99-R106 VanDerWaalsContact OE1-NE 3.09Å; E99-R106 IonicContact OE1-NH2 3.71Å; E99-R106 PolarHBondContact OE1-NH2 3.17Å; E99-R106 IonicContact OE2-CZ 3.12Å; E99-R106 IonicContact OE2-NH2 2.65Å; E99-R106 PolarHBondContact OE2-NH2 2.79Å; S102-R106 PolarHBondContact O-N 3.45Å; F103-R106 HydrophobicContact CD2-CB 4.1Å; F103-R106 HydrophobicContact CD2-CG 4.19Å; F103-R106 HydrophobicContact CE2-CG 4.36Å; F103-R106 WeakPolarHBondContact O-CB 3.48Å; F103-R106 PolarHBondContact O-N 2.9Å; R106-T108 VanDerWaalsContact C-N 3.32Å; R106-E109 WeakPolarHBondContact CD-OE1 3.45Å; R106-E109 IonicContact NE-OE1 3.02Å; R106-E109 WeakPolarHBondContact O-CB 3.37Å; R106-E109 PolarHBondContact O-N 2.88Å; R106-R147 VanDerWaalsContact CZ-CZ 3.41Å; R106-G149 PolarHBondContact NH2-O 2.89Å; R106-P151 HydrophobicContact CB-CB 4.31Å; R106-P151 HydrophobicContact CB-CG 4.32Å; R106-P151 HydrophobicContact CG-CG 4.42Å
107	I	97.9	Very high	97	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-66.9	-36.6	174.9	-66.7	166.6	0	0	0	110.8	F103 L104 Q105 E109 Y110 F171 S183 F185 I200	F103-I107 HydrophobicContact CD1-CD1 3.91Å; F103-I107 HydrophobicContact CD1-CG1 4.46Å; F103-I107 HydrophobicContact CE1-CD1 3.64Å; F103-I107 HydrophobicContact CE1-CG1 4.14Å; F103-I107 HydrophobicContact CE2-CG1 4.38Å; F103-I107 HydrophobicContact CZ-CD1 4.09Å; F103-I107 HydrophobicContact CZ-CG1 4.09Å; F103-I107 WeakPolarHBondContact O-CG1 3.28Å; F103-I107 PolarHBondContact O-N 2.99Å; L104-I107 PolarHBondContact O-N 2.79Å; Q105-I107 VanDerWaalsContact C-N 3.3Å; Q105-I107 PolarHBondContact O-N 2.96Å; I107-E109 PolarHBondContact O-N 2.82Å; I107-E109 VanDerWaalsContact O-N 3.14Å; I107-Y110 HydrophobicContact CG2-CD2 4.06Å; I107-Y110 HydrophobicContact CG2-CE2 4.02Å; I107-Y110 VanDerWaalsContact O-CB 3.27Å; I107-Y110 WeakPolarHBondContact O-CB 3.28Å; I107-Y110 PolarHBondContact O-N 3.31Å; I107-F171 HydrophobicContact CG2-CZ 4.28Å; I107-S183 VanDerWaalsContact CD1-CB 3.45Å; I107-F185 HydrophobicContact CG2-CB 4.31Å; I107-F185 HydrophobicContact CG2-CD1 3.51Å; I107-F185 HydrophobicContact CG2-CE1 3.94Å; I107-F185 HydrophobicContact CG2-CG 3.89Å; I107-I200 HydrophobicContact CD1-CB 4.14Å; I107-I200 HydrophobicContact CD1-CG1 4.28Å
108	T	98.8	Very high	97.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-61.4	-24	178.7	-51.6	0	0	0	0	112.9	L104 Q105 R106 Y110 M111 Y160 L162 F171 L386	L104-T108 PolarHBondContact O-N 2.77Å; L104-T108 VanDerWaalsContact O-N 3.15Å; L104-T108 PolarHBondContact O-OG1 2.91Å; Q105-T108 WeakPolarHBondContact O-CB 3.32Å; Q105-T108 PolarHBondContact O-N 3.37Å; R106-T108 VanDerWaalsContact C-N 3.32Å; T108-Y110 PolarHBondContact O-N 3.27Å; T108-M111 WeakPolarHBondContact O-CB 3.28Å; T108-M111 PolarHBondContact O-N 3.43Å; T108-Y160 HydrophobicContact CG2-CE1 3.9Å; T108-Y160 VanDerWaalsContact OG1-CD1 3.24Å; T108-Y160 WeakPolarHBondContact OG1-CD1 3.32Å; T108-Y160 WeakPolarHBondContact OG1-CE1 3.38Å; T108-L162 HydrophobicContact CG2-CB 4.12Å; T108-L162 HydrophobicContact CG2-CD2 3.52Å; T108-L162 HydrophobicContact CG2-CG 4.47Å; T108-F171 HydrophobicContact CG2-CD1 3.94Å; T108-F171 HydrophobicContact CG2-CD2 4.28Å; T108-F171 HydrophobicContact CG2-CE1 4.14Å; T108-F171 HydrophobicContact CG2-CE2 4.48Å; T108-F171 HydrophobicContact CG2-CG 4.03Å; T108-F171 HydrophobicContact CG2-CZ 4.4Å; T108-F171 WeakPolarHBondContact OG1-CE1 3.43Å; T108-F171 WeakPolarHBondContact OG1-CZ 3.35Å; T108-L386 HydrophobicContact CG2-CD2 4.23Å
109	E	98.6	Very high	98.2	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-58.2	-18.5	173	-60.6	-178.1	-135.7	0	0	113.4	Q105 R106 I107 M111 E112 S143 R147 T383 L386	Q105-E109 PolarHBondContact O-N 2.9Å; R106-E109 WeakPolarHBondContact CD-OE1 3.45Å; R106-E109 IonicContact NE-OE1 3.02Å; R106-E109 WeakPolarHBondContact O-CB 3.37Å; R106-E109 PolarHBondContact O-N 2.88Å; I107-E109 PolarHBondContact O-N 2.82Å; I107-E109 VanDerWaalsContact O-N 3.14Å; E109-M111 PolarHBondContact O-N 3.2Å; E109-M111 VanDerWaalsContact O-N 3.08Å; E109-E112 WeakPolarHBondContact O-CB 3.46Å; E109-E112 PolarHBondContact O-N 2.82Å; E109-S143 VanDerWaalsContact OE2-CB 3.31Å; E109-S143 WeakPolarHBondContact OE2-CB 3.14Å; E109-S143 PolarHBondContact OE2-OG 3.3Å; E109-R147 VanDerWaalsContact CD-NH1 3.26Å; E109-R147 IonicContact OE1-CZ 3.65Å; E109-R147 IonicContact OE1-NH1 3.11Å; E109-R147 PolarHBondContact OE1-NH1 3.31Å; E109-R147 IonicContact OE1-NH2 3.95Å; E109-R147 PolarHBondContact OE1-NH2 2.97Å; E109-R147 IonicContact OE2-CZ 2.68Å; E109-R147 IonicContact OE2-NH1 2.68Å; E109-R147 PolarHBondContact OE2-NH1 2.89Å; E109-T383 PolarHBondContact OE2-OG1 2.86Å; E109-L386 HydrophobicContact CG-CD1 3.76Å
110	Y	98.8	Very high	98.4	Very high	22 Å²	22	14.8 Å²	14.8	9%	0.086	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-54.1	-28.6	170.2	-67.6	-5.8	0	0	0	112.3	I107 T108 F136 A140 V141 F185 F196 I219 N234	I107-Y110 HydrophobicContact CG2-CD2 4.06Å; I107-Y110 HydrophobicContact CG2-CE2 4.02Å; I107-Y110 VanDerWaalsContact O-CB 3.27Å; I107-Y110 WeakPolarHBondContact O-CB 3.28Å; I107-Y110 PolarHBondContact O-N 3.31Å; T108-Y110 PolarHBondContact O-N 3.27Å; Y110-F136 VanDerWaalsContact O-CE2 3.22Å; Y110-F136 WeakPolarHBondContact O-CE2 3.26Å; Y110-F136 WeakPolarHBondContact O-CZ 3.39Å; Y110-A140 HydrophobicContact CD1-CB 3.93Å; Y110-A140 WeakPolarHBondContact CD1-O 3.39Å; Y110-A140 HydrophobicContact CG-CB 4.06Å; Y110-V141 HydrophobicContact CE1-CG1 4.22Å; Y110-F185 HydrophobicContact CD2-CZ 4.32Å; Y110-F185 HydrophobicContact CE2-CE1 4.48Å; Y110-F196 HydrophobicContact CD2-CE1 4.28Å; Y110-F196 HydrophobicContact CD2-CZ 4.13Å; Y110-I219 HydrophobicContact CE2-CD1 4.41Å; Y110-N234 PolarHBondContact OH-ND2 2.95Å
111	M	98.8	Very high	98.4	Very high	0 Å²	0	15 Å²	15	0%	0	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-86.2	-0.8	-177.8	-55.6	-51.7	-67.5	0	0	114.3	T108 E109 H113 V114 I117 F136 F169 F171 S187 F194 F196 F382	T108-M111 WeakPolarHBondContact O-CB 3.28Å; T108-M111 PolarHBondContact O-N 3.43Å; E109-M111 PolarHBondContact O-N 3.2Å; E109-M111 VanDerWaalsContact O-N 3.08Å; M111-H113 PolarHBondContact O-N 3.46Å; M111-H113 VanDerWaalsContact O-N 3.08Å; M111-V114 HydrophobicContact CE-CB 4.1Å; M111-V114 HydrophobicContact CE-CG2 3.64Å; M111-V114 WeakPolarHBondContact O-CB 3.39Å; M111-V114 PolarHBondContact O-N 2.94Å; M111-V114 VanDerWaalsContact O-N 3.1Å; M111-I117 HydrophobicContact CE-CD1 4.31Å; M111-F136 HydrophobicContact SD-CZ 4.26Å; M111-F169 HydrophobicContact CB-CD2 4.42Å; M111-F169 HydrophobicContact CB-CE1 4.14Å; M111-F169 HydrophobicContact CB-CE2 3.75Å; M111-F169 HydrophobicContact CB-CZ 3.58Å; M111-F169 HydrophobicContact CE-CD2 4.16Å; M111-F169 HydrophobicContact CE-CG 4.24Å; M111-F169 HydrophobicContact CG-CD2 4.39Å; M111-F169 HydrophobicContact CG-CE2 3.97Å; M111-F169 HydrophobicContact CG-CZ 4.33Å; M111-F171 HydrophobicContact CG-CD2 3.86Å; M111-F171 HydrophobicContact CG-CE2 4.26Å; M111-S187 WeakPolarHBondContact CE-OG 3.24Å; M111-F194 HydrophobicContact CE-CE2 3.89Å; M111-F194 HydrophobicContact CE-CZ 3.82Å; M111-F196 HydrophobicContact CE-CD1 4.29Å; M111-F196 HydrophobicContact SD-CD1 3.26Å; M111-F196 WeakPolarHBondContact SD-CD1 3.47Å; M111-F196 HydrophobicContact SD-CE1 3.57Å; M111-F196 VanDerWaalsContact SD-CE1 3.57Å; M111-F196 HydrophobicContact SD-CG 4.2Å; M111-F382 HydrophobicContact CB-CZ 4.39Å
112	E	98.6	Very high	98.4	Very high	16 Å²	16	19.5 Å²	19.5	8%	0.075	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-54.3	-35	-178.3	179	173.5	167.6	0	0	112.4	E109 N367 T380 F382	E109-E112 WeakPolarHBondContact O-CB 3.46Å; E109-E112 PolarHBondContact O-N 2.82Å; E112-N367 PolarHBondContact OE1-ND2 2.99Å; E112-T380 PolarHBondContact OE2-OG1 3.48Å; E112-T380 VanDerWaalsContact OE2-OG1 3.05Å; E112-F382 HydrophobicContact CB-CB 4.26Å; E112-F382 HydrophobicContact CB-CD1 3.98Å; E112-F382 HydrophobicContact CB-CD2 4.32Å; E112-F382 HydrophobicContact CB-CE1 4.4Å; E112-F382 HydrophobicContact CB-CG 3.94Å; E112-F382 HydrophobicContact CG-CB 3.73Å; E112-F382 HydrophobicContact CG-CD1 4.4Å; E112-F382 HydrophobicContact CG-CD2 4.36Å; E112-F382 HydrophobicContact CG-CG 3.94Å
113	H	98.7	Very high	98.4	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-112.4	35.2	-177.8	-56	86.7	0	0	0	112.5	M111 Y115 L116 S139 W364	M111-H113 PolarHBondContact O-N 3.46Å; M111-H113 VanDerWaalsContact O-N 3.08Å; H113-Y115 HydrophobicContact CB-CD1 4.32Å; H113-Y115 HydrophobicContact CB-CE1 3.93Å; H113-Y115 AromaticContact CD2-CE1 3.92Å; H113-Y115 PolarHBondContact O-N 2.83Å; H113-L116 HydrophobicContact CB-CD1 3.85Å; H113-L116 HydrophobicContact CB-CG 4.4Å; H113-L116 WeakPolarHBondContact O-CB 3.25Å; H113-L116 WeakPolarHBondContact O-CG 3.48Å; H113-L116 PolarHBondContact O-N 2.88Å; H113-S139 WeakPolarHBondContact CB-OG 3.29Å; H113-W364 AromaticContact CD2-CD1 3.69Å; H113-W364 AromaticContact CD2-NE1 3.16Å; H113-W364 PolarHBondContact CD2-NE1 3.14Å; H113-W364 AromaticContact CE1-NE1 3.74Å; H113-W364 AromaticContact CG-NE1 3.7Å; H113-W364 AromaticContact NE2-NE1 3.16Å; H113-W364 PolarHBondContact NE2-NE1 3.09Å; H113-W364 VanDerWaalsContact NE2-NE1 3.16Å
114	V	98.7	Very high	98.4	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.018	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-24.8	179.6	66.4	0	0	0	0	114.1	M111 L116 I117 H118 L167 F169 F194	M111-V114 HydrophobicContact CE-CB 4.1Å; M111-V114 HydrophobicContact CE-CG2 3.64Å; M111-V114 WeakPolarHBondContact O-CB 3.39Å; M111-V114 PolarHBondContact O-N 2.94Å; M111-V114 VanDerWaalsContact O-N 3.1Å; V114-L116 PolarHBondContact O-N 2.86Å; V114-I117 HydrophobicContact CG2-CD1 4.33Å; V114-I117 WeakPolarHBondContact O-CA 3.36Å; V114-I117 WeakPolarHBondContact O-CB 3.12Å; V114-I117 PolarHBondContact O-N 2.86Å; V114-H118 PolarHBondContact O-N 3.19Å; V114-L167 HydrophobicContact CG1-CB 3.86Å; V114-F169 HydrophobicContact CB-CD1 4.24Å; V114-F169 HydrophobicContact CG1-CD1 3.8Å; V114-F169 HydrophobicContact CG1-CE1 4.01Å; V114-F169 HydrophobicContact CG2-CB 4.42Å; V114-F169 HydrophobicContact CG2-CD1 4.16Å; V114-F169 HydrophobicContact CG2-CG 4.48Å; V114-F194 HydrophobicContact CG2-CE1 3.86Å; V114-F194 HydrophobicContact CG2-CZ 3.68Å
115	Y	98.6	Very high	98.3	Very high	100 Å²	100	29.9 Å²	29.9	39%	0.392	15%	0.15	S	C	.	.	H	α-helix	trans	-54.5	-25.2	173	78.8	-95.3	0	0	0	113.2	H113 H118 R119	H113-Y115 HydrophobicContact CB-CD1 4.32Å; H113-Y115 HydrophobicContact CB-CE1 3.93Å; H113-Y115 AromaticContact CD2-CE1 3.92Å; H113-Y115 PolarHBondContact O-N 2.83Å; Y115-H118 PolarHBondContact O-N 3.28Å; Y115-R119 VanDerWaalsContact O-CB 3.27Å; Y115-R119 WeakPolarHBondContact O-CB 3.3Å; Y115-R119 PolarHBondContact O-N 3.48Å
116	L	98.9	Very high	98.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.2	-33.8	174.9	-65.6	170.6	0	0	0	111.9	H113 V114 A120 S132 A135 F136 S139 W364	H113-L116 HydrophobicContact CB-CD1 3.85Å; H113-L116 HydrophobicContact CB-CG 4.4Å; H113-L116 WeakPolarHBondContact O-CB 3.25Å; H113-L116 WeakPolarHBondContact O-CG 3.48Å; H113-L116 PolarHBondContact O-N 2.88Å; V114-L116 PolarHBondContact O-N 2.86Å; L116-A120 WeakPolarHBondContact O-CB 3.46Å; L116-A120 PolarHBondContact O-N 2.85Å; L116-S132 WeakPolarHBondContact O-CB 3.37Å; L116-A135 HydrophobicContact CD1-CB 4.15Å; L116-A135 HydrophobicContact CD2-CB 4.16Å; L116-F136 HydrophobicContact CB-CB 3.89Å; L116-F136 HydrophobicContact CB-CD2 4.4Å; L116-F136 HydrophobicContact CD1-CB 4.29Å; L116-S139 WeakPolarHBondContact CD1-OG 3.27Å; L116-W364 HydrophobicContact CD1-CB 4.25Å; L116-W364 HydrophobicContact CD1-CG 4.25Å
117	I	98.8	Very high	98.3	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-48.9	172.3	-62.8	170.5	0	0	0	109.7	M111 V114 R119 A120 S121 F136 F194 L221 L223	M111-I117 HydrophobicContact CE-CD1 4.31Å; V114-I117 HydrophobicContact CG2-CD1 4.33Å; V114-I117 WeakPolarHBondContact O-CA 3.36Å; V114-I117 WeakPolarHBondContact O-CB 3.12Å; V114-I117 PolarHBondContact O-N 2.86Å; I117-R119 VanDerWaalsContact C-N 3.28Å; I117-R119 PolarHBondContact O-N 2.97Å; I117-A120 CarbonylContact O-C 3.6Å; I117-A120 WeakPolarHBondContact O-CA 3.31Å; I117-A120 VanDerWaalsContact O-CB 3.3Å; I117-A120 WeakPolarHBondContact O-CB 3.42Å; I117-A120 PolarHBondContact O-N 2.86Å; I117-S121 PolarHBondContact O-N 2.82Å; I117-F136 HydrophobicContact CD1-CD1 4.11Å; I117-F136 HydrophobicContact CD1-CD2 3.97Å; I117-F136 HydrophobicContact CD1-CE1 3.74Å; I117-F136 HydrophobicContact CD1-CE2 3.58Å; I117-F136 HydrophobicContact CD1-CG 4.22Å; I117-F136 HydrophobicContact CD1-CZ 3.46Å; I117-F136 VanDerWaalsContact CD1-CZ 3.46Å; I117-F136 HydrophobicContact CG1-CD1 4.02Å; I117-F136 HydrophobicContact CG1-CD2 3.79Å; I117-F136 HydrophobicContact CG1-CE1 4.18Å; I117-F136 HydrophobicContact CG1-CE2 3.95Å; I117-F136 HydrophobicContact CG1-CG 3.83Å; I117-F136 HydrophobicContact CG1-CZ 4.16Å; I117-F194 HydrophobicContact CB-CD1 4.44Å; I117-F194 HydrophobicContact CD1-CD2 4.25Å; I117-F194 HydrophobicContact CD1-CE2 4.14Å; I117-F194 HydrophobicContact CD1-CZ 4.46Å; I117-F194 HydrophobicContact CG2-CB 3.54Å; I117-F194 HydrophobicContact CG2-CD1 3.53Å; I117-F194 HydrophobicContact CG2-CD2 3.95Å; I117-F194 HydrophobicContact CG2-CE1 4.19Å; I117-F194 HydrophobicContact CG2-CG 3.39Å; I117-L221 HydrophobicContact CD1-CD1 3.82Å; I117-L221 HydrophobicContact CG1-CD1 4.07Å; I117-L221 HydrophobicContact CG1-CD2 4.13Å; I117-L221 HydrophobicContact CG2-CD1 3.84Å; I117-L223 HydrophobicContact CG2-CD2 3.92Å
118	H	98.4	Very high	98.4	Very high	41 Å²	41	35.7 Å²	35.7	19%	0.19	18%	0.181	C	C	.	.	H	α-helix	trans	-57.5	-43.2	175.7	-61.4	-49.5	0	0	0	111.5	V114 Y115 A120 S121 C122 L167 D193 F194	V114-H118 PolarHBondContact O-N 3.19Å; Y115-H118 PolarHBondContact O-N 3.28Å; H118-A120 VanDerWaalsContact C-N 3.32Å; H118-A120 PolarHBondContact O-N 2.95Å; H118-S121 PolarHBondContact O-N 2.95Å; H118-C122 PolarHBondContact O-N 3.28Å; H118-C122 VanDerWaalsContact O-N 3.09Å; H118-C122 PolarHBondContact O-SG 2.98Å; H118-C122 VanDerWaalsContact O-SG 3.42Å; H118-L167 PolarHBondContact NE2-O 3.36Å; H118-D193 IonicContact CE1-OD1 3.85Å; H118-D193 IonicContact CE1-OD2 2.88Å; H118-D193 IonicContact CG-OD2 3.7Å; H118-D193 IonicContact ND1-OD1 3.39Å; H118-D193 IonicContact ND1-OD2 2.91Å; H118-D193 PolarHBondContact ND1-OD2 3.01Å; H118-F194 AromaticContact CE1-CE1 3.56Å
119	R	98.3	Very high	98.4	Very high	71 Å²	71	36.2 Å²	36.2	27%	0.268	18%	0.183	S	C	.	.	H	α-helix	trans	-59.4	-43.1	174.3	-172.2	177.2	74.5	-169.8	-1	111.4	Y115 I117 C122 Q123 S132 L363	Y115-R119 VanDerWaalsContact O-CB 3.27Å; Y115-R119 WeakPolarHBondContact O-CB 3.3Å; Y115-R119 PolarHBondContact O-N 3.48Å; I117-R119 VanDerWaalsContact C-N 3.28Å; I117-R119 PolarHBondContact O-N 2.97Å; R119-C122 PolarHBondContact O-N 3.45Å; R119-Q123 VanDerWaalsContact O-CG 3.3Å; R119-Q123 WeakPolarHBondContact O-CG 3.41Å; R119-Q123 PolarHBondContact O-N 3.12Å; R119-Q123 PolarHBondContact O-NE2 2.62Å; R119-S132 PolarHBondContact NE-OG 3.09Å; R119-S132 PolarHBondContact NH2-OG 3.15Å; R119-L363 PolarHBondContact NH1-O 2.84Å; R119-L363 PolarHBondContact NH2-O 2.79Å
120	A	98.6	Very high	98.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-47.6	175.6	0	0	0	0	0	111.3	L116 I117 H118 C122 Q123 R129 V133 L223	L116-A120 WeakPolarHBondContact O-CB 3.46Å; L116-A120 PolarHBondContact O-N 2.85Å; I117-A120 CarbonylContact O-C 3.6Å; I117-A120 WeakPolarHBondContact O-CA 3.31Å; I117-A120 VanDerWaalsContact O-CB 3.3Å; I117-A120 WeakPolarHBondContact O-CB 3.42Å; I117-A120 PolarHBondContact O-N 2.86Å; H118-A120 VanDerWaalsContact C-N 3.32Å; H118-A120 PolarHBondContact O-N 2.95Å; A120-C122 PolarHBondContact O-N 3.34Å; A120-C122 VanDerWaalsContact O-N 3.15Å; A120-Q123 PolarHBondContact O-N 2.92Å; A120-R129 VanDerWaalsContact O-CG 3.31Å; A120-R129 WeakPolarHBondContact O-CG 3.34Å; A120-V133 HydrophobicContact CB-CG2 4.2Å; A120-L223 HydrophobicContact CB-CD1 3.87Å; A120-L223 HydrophobicContact CB-CD2 4.49Å
121	S	97.9	Very high	98.4	Very high	6 Å²	6	35.6 Å²	35.6	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-59.2	-28.9	178.7	-163.8	0	0	0	0	112.7	I117 H118 H226	I117-S121 PolarHBondContact O-N 2.82Å; H118-S121 PolarHBondContact O-N 2.95Å; S121-H226 PolarHBondContact O-NE2 3.38Å
122	C	97.3	Very high	98.4	Very high	94 Å²	94	35.8 Å²	35.8	64%	0.635	18%	0.183	S	C	*	.	H	α-helix	trans	-80.8	-14.8	175.1	-69.1	0	0	0	0	115.2	H118 R119 A120	H118-C122 PolarHBondContact O-N 3.28Å; H118-C122 VanDerWaalsContact O-N 3.09Å; H118-C122 PolarHBondContact O-SG 2.98Å; H118-C122 VanDerWaalsContact O-SG 3.42Å; R119-C122 PolarHBondContact O-N 3.45Å; A120-C122 PolarHBondContact O-N 3.34Å; A120-C122 VanDerWaalsContact O-N 3.15Å
123	Q	98.1	Very high	98.4	Very high	45 Å²	45	35 Å²	35	21%	0.21	18%	0.179	C	C	.	.			trans	-80.6	131.2	-177	-55.7	-50.6	-58.1	0	0	112.3	R119 A120 E128 R129 H226	R119-Q123 VanDerWaalsContact O-CG 3.3Å; R119-Q123 WeakPolarHBondContact O-CG 3.41Å; R119-Q123 PolarHBondContact O-N 3.12Å; R119-Q123 PolarHBondContact O-NE2 2.62Å; A120-Q123 PolarHBondContact O-N 2.92Å; Q123-E128 HydrophobicContact CB-CB 3.85Å; Q123-E128 HydrophobicContact CG-CB 3.83Å; Q123-E128 PolarHBondContact OE1-OE2 3.3Å; Q123-R129 HydrophobicContact CB-CG 3.8Å; Q123-R129 PolarHBondContact O-NH1 2.88Å; Q123-H226 PolarHBondContact O-CE1 2.82Å; Q123-H226 VanDerWaalsContact O-CE1 3.24Å
124	P	97.2	Very high	98.4	Very high	95 Å²	95	35 Å²	35	62%	0.617	18%	0.179	S	C	*	.	S	Bend	trans	-74	-33.6	177.5	28.4	-32.6	0	0	0	112.4	R129	P124-R129 PolarHBondContact O-NH1 3.26Å
125	Q	97.9	Very high	98.4	Very high	114 Å²	114	34.8 Å²	34.8	53%	0.533	18%	0.178	S	C	.	.	S	Bend	trans	-91.5	132.4	-174.4	-63	-62.1	-11	0	0	112.4	L127 E128 R129	Q125-L127 PolarHBondContact O-N 3.03Å; Q125-E128 HydrophobicContact CB-CB 4.42Å; Q125-E128 HydrophobicContact CB-CG 4.19Å; Q125-E128 PolarHBondContact O-N 3.21Å; Q125-E128 VanDerWaalsContact O-N 3.08Å; Q125-R129 PolarHBondContact O-N 3.43Å
126	P	98	Very high	98.4	Very high	31 Å²	31	30 Å²	30	20%	0.201	16%	0.159	C	C	.	.	H	α-helix	trans	-55.4	-34.9	177.9	-23.5	28.9	0	0	0	114.1	R129 M130 T262	P126-R129 PolarHBondContact O-N 3Å; P126-M130 WeakPolarHBondContact O-CB 3.22Å; P126-M130 PolarHBondContact O-N 3.2Å; P126-T262 HydrophobicContact CB-CG2 4.15Å; P126-T262 HydrophobicContact CG-CG2 4.17Å
127	L	98.4	Very high	98.4	Very high	44 Å²	44	30.2 Å²	30.2	23%	0.23	16%	0.161	C	C	.	.	H	α-helix	trans	-64	-44	177.9	179.3	59	0	0	0	111.8	Q125 M130 Q131 I287 L295 F296	Q125-L127 PolarHBondContact O-N 3.03Å; L127-M130 PolarHBondContact O-N 2.77Å; L127-Q131 WeakPolarHBondContact O-CG 3.43Å; L127-Q131 PolarHBondContact O-N 3.22Å; L127-I287 HydrophobicContact CD1-CB 3.99Å; L127-I287 HydrophobicContact CD1-CD1 3.99Å; L127-I287 HydrophobicContact CD1-CG2 3.61Å; L127-L295 HydrophobicContact CD1-CB 3.9Å; L127-L295 HydrophobicContact CD1-CD1 4.16Å; L127-L295 HydrophobicContact CD2-CB 4.08Å; L127-L295 HydrophobicContact CD2-CD1 4.47Å; L127-F296 HydrophobicContact CD1-CB 4.11Å
128	E	98.5	Very high	98.4	Very high	64 Å²	64	30.2 Å²	30.2	30%	0.299	16%	0.161	S	C	.	.	H	α-helix	trans	-71.5	-33.4	179.3	-65.2	175.7	165	0	0	111.8	Q123 Q125 Q131 S132	Q123-E128 HydrophobicContact CB-CB 3.85Å; Q123-E128 HydrophobicContact CG-CB 3.83Å; Q123-E128 PolarHBondContact OE1-OE2 3.3Å; Q125-E128 HydrophobicContact CB-CB 4.42Å; Q125-E128 HydrophobicContact CB-CG 4.19Å; Q125-E128 PolarHBondContact O-N 3.21Å; Q125-E128 VanDerWaalsContact O-N 3.08Å; E128-Q131 PolarHBondContact O-N 3.05Å; E128-S132 PolarHBondContact O-N 2.97Å; E128-S132 PolarHBondContact O-OG 3.23Å
129	R	98.8	Very high	98.4	Very high	11 Å²	11	28.4 Å²	28.4	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-59.4	-52.3	167.7	-66.8	-161.3	-72.8	-80.3	4.9	110.8	A120 Q123 P124 Q125 P126 Q131 S132 V133 H226 E228 Y230	A120-R129 VanDerWaalsContact O-CG 3.31Å; A120-R129 WeakPolarHBondContact O-CG 3.34Å; Q123-R129 HydrophobicContact CB-CG 3.8Å; Q123-R129 PolarHBondContact O-NH1 2.88Å; P124-R129 PolarHBondContact O-NH1 3.26Å; Q125-R129 PolarHBondContact O-N 3.43Å; P126-R129 PolarHBondContact O-N 3Å; R129-Q131 VanDerWaalsContact C-N 3.28Å; R129-Q131 PolarHBondContact O-N 3.22Å; R129-S132 WeakPolarHBondContact O-CA 3.49Å; R129-S132 PolarHBondContact O-N 3.16Å; R129-V133 WeakPolarHBondContact O-CG2 3.2Å; R129-V133 PolarHBondContact O-N 3.02Å; R129-H226 PolarHBondContact NH1-CE1 3.28Å; R129-H226 PolarHBondContact NH1-ND1 2.89Å; R129-E228 IonicContact CZ-OE1 2.67Å; R129-E228 IonicContact CZ-OE2 3.49Å; R129-E228 IonicContact NE-OE1 3.5Å; R129-E228 IonicContact NE-OE2 3.54Å; R129-E228 PolarHBondContact NE-OE2 3.19Å; R129-E228 VanDerWaalsContact NH2-CD 3.28Å; R129-E228 IonicContact NH2-OE1 3.52Å; R129-E228 PolarHBondContact NH2-OE1 3.45Å; R129-E228 IonicContact NH2-OE2 2.75Å; R129-E228 PolarHBondContact NH2-OE2 3.38Å; R129-Y230 VanDerWaalsContact CB-OH 3.29Å; R129-Y230 WeakPolarHBondContact CB-OH 3.41Å
130	M	98.9	Very high	98.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.1	-35.9	179.3	-175.5	62.6	83.3	0	0	112.5	P126 L127 S132 V133 A134 Y230 I257 N259 H264 C266 I287	P126-M130 WeakPolarHBondContact O-CB 3.22Å; P126-M130 PolarHBondContact O-N 3.2Å; L127-M130 PolarHBondContact O-N 2.77Å; M130-S132 VanDerWaalsContact C-N 3.32Å; M130-S132 PolarHBondContact O-N 2.75Å; M130-V133 PolarHBondContact O-N 3.48Å; M130-A134 VanDerWaalsContact O-CB 3.22Å; M130-A134 WeakPolarHBondContact O-CB 3.38Å; M130-A134 PolarHBondContact O-N 3.09Å; M130-Y230 HydrophobicContact CE-CD1 3.89Å; M130-Y230 HydrophobicContact CE-CE1 3.85Å; M130-Y230 HydrophobicContact SD-CD1 4.11Å; M130-Y230 HydrophobicContact SD-CE1 4.09Å; M130-I257 HydrophobicContact CE-CG2 4.44Å; M130-I257 HydrophobicContact SD-CB 4.25Å; M130-I257 HydrophobicContact SD-CG2 3.88Å; M130-N259 HydrophobicContact CE-CB 3.7Å; M130-H264 HydrophobicContact CE-CB 3.91Å; M130-H264 VanDerWaalsContact CE-O 3.28Å; M130-H264 WeakPolarHBondContact CE-O 3.28Å; M130-C266 HydrophobicContact CG-CB 3.99Å; M130-C266 HydrophobicContact SD-CB 3.77Å; M130-I287 HydrophobicContact CB-CD1 4.12Å; M130-I287 HydrophobicContact CB-CG2 4.28Å; M130-I287 HydrophobicContact CG-CB 4.46Å; M130-I287 HydrophobicContact CG-CD1 3.8Å; M130-I287 HydrophobicContact CG-CG1 3.93Å; M130-I287 HydrophobicContact CG-CG2 3.7Å
131	Q	98.8	Very high	98.3	Very high	10 Å²	10	25.5 Å²	25.5	5%	0.047	14%	0.143	C	C	.	.	H	α-helix	trans	-58.8	-42.8	171.7	-72.3	170.2	8.3	0	0	112.1	L127 E128 R129 A135 I287 F296 K361 L363	L127-Q131 WeakPolarHBondContact O-CG 3.43Å; L127-Q131 PolarHBondContact O-N 3.22Å; E128-Q131 PolarHBondContact O-N 3.05Å; R129-Q131 VanDerWaalsContact C-N 3.28Å; R129-Q131 PolarHBondContact O-N 3.22Å; Q131-A135 WeakPolarHBondContact O-CB 3.46Å; Q131-A135 PolarHBondContact O-N 2.92Å; Q131-I287 HydrophobicContact CB-CD1 4.35Å; Q131-I287 HydrophobicContact CG-CD1 3.63Å; Q131-F296 HydrophobicContact CG-CD1 3.7Å; Q131-F296 HydrophobicContact CG-CE1 3.63Å; Q131-F296 HydrophobicContact CG-CG 4.38Å; Q131-F296 HydrophobicContact CG-CZ 4.31Å; Q131-K361 VanDerWaalsContact OE1-NZ 3.07Å; Q131-L363 HydrophobicContact CB-CD2 4.21Å
132	S	98.8	Very high	98.2	Very high	4 Å²	4	25.2 Å²	25.2	3%	0.028	14%	0.141	C	C	.	.	H	α-helix	trans	-74	-38.3	179.9	-61.2	0	0	0	0	112.3	L116 R119 E128 R129 M130 A135 F136	L116-S132 WeakPolarHBondContact O-CB 3.37Å; R119-S132 PolarHBondContact NE-OG 3.09Å; R119-S132 PolarHBondContact NH2-OG 3.15Å; E128-S132 PolarHBondContact O-N 2.97Å; E128-S132 PolarHBondContact O-OG 3.23Å; R129-S132 WeakPolarHBondContact O-CA 3.49Å; R129-S132 PolarHBondContact O-N 3.16Å; M130-S132 VanDerWaalsContact C-N 3.32Å; M130-S132 PolarHBondContact O-N 2.75Å; S132-A135 PolarHBondContact O-N 3.42Å; S132-F136 WeakPolarHBondContact O-CB 3.22Å; S132-F136 PolarHBondContact O-N 3.33Å
133	V	98.9	Very high	98.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65	-42.1	173.5	177.9	0	0	0	0	111.3	A120 R129 M130 A135 F136 A137 L221 L223 Y230 W232 I257	A120-V133 HydrophobicContact CB-CG2 4.2Å; R129-V133 WeakPolarHBondContact O-CG2 3.2Å; R129-V133 PolarHBondContact O-N 3.02Å; M130-V133 PolarHBondContact O-N 3.48Å; V133-A135 VanDerWaalsContact C-N 3.34Å; V133-A135 PolarHBondContact O-N 3.44Å; V133-F136 WeakPolarHBondContact O-CB 3.41Å; V133-F136 PolarHBondContact O-N 2.86Å; V133-A137 PolarHBondContact O-N 3.22Å; V133-L221 HydrophobicContact CB-CD2 4.5Å; V133-L221 HydrophobicContact CG1-CD2 4.04Å; V133-L221 HydrophobicContact CG2-CD2 3.83Å; V133-L223 HydrophobicContact CG2-CD1 4.49Å; V133-Y230 HydrophobicContact CB-CD1 4.26Å; V133-Y230 HydrophobicContact CB-CE1 4.37Å; V133-Y230 HydrophobicContact CG1-CD1 3.94Å; V133-Y230 HydrophobicContact CG1-CG 3.99Å; V133-Y230 HydrophobicContact CG2-CD1 4.09Å; V133-Y230 HydrophobicContact CG2-CD2 4.21Å; V133-Y230 HydrophobicContact CG2-CE1 3.94Å; V133-Y230 HydrophobicContact CG2-CE2 4.11Å; V133-Y230 HydrophobicContact CG2-CG 4.21Å; V133-W232 HydrophobicContact CG1-CZ3 4.29Å; V133-I257 HydrophobicContact CG1-CG2 3.88Å
134	A	98.9	Very high	97.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63	-41.3	174.8	0	0	0	0	0	112.1	M130 F136 A137 V138 I257 C266 L268 I298	M130-A134 VanDerWaalsContact O-CB 3.22Å; M130-A134 WeakPolarHBondContact O-CB 3.38Å; M130-A134 PolarHBondContact O-N 3.09Å; A134-F136 VanDerWaalsContact C-N 3.34Å; A134-A137 PolarHBondContact O-N 3.49Å; A134-V138 PolarHBondContact O-N 2.81Å; A134-I257 HydrophobicContact CB-CD1 4Å; A134-C266 HydrophobicContact CB-CB 4.44Å; A134-L268 HydrophobicContact CB-CD1 4.33Å; A134-I298 HydrophobicContact CB-CD1 3.69Å
135	A	98.9	Very high	97.6	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.8	-43.2	173.5	0	0	0	0	0	111.7	L116 Q131 S132 V133 V138 S139 L363 W364	L116-A135 HydrophobicContact CD1-CB 4.15Å; L116-A135 HydrophobicContact CD2-CB 4.16Å; Q131-A135 WeakPolarHBondContact O-CB 3.46Å; Q131-A135 PolarHBondContact O-N 2.92Å; S132-A135 PolarHBondContact O-N 3.42Å; V133-A135 VanDerWaalsContact C-N 3.34Å; V133-A135 PolarHBondContact O-N 3.44Å; A135-V138 PolarHBondContact O-N 2.82Å; A135-S139 VanDerWaalsContact O-CB 3.31Å; A135-S139 WeakPolarHBondContact O-CB 3.37Å; A135-S139 PolarHBondContact O-N 3.33Å; A135-S139 PolarHBondContact O-OG 2.84Å; A135-L363 HydrophobicContact CB-CB 4.04Å; A135-W364 HydrophobicContact CB-CB 3.96Å
136	F	98.9	Very high	97.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.5	-49.8	177.1	175.3	-105	0	0	0	111.8	Y110 M111 L116 I117 S132 V133 A134 V138 S139 A140 F196 W232	Y110-F136 VanDerWaalsContact O-CE2 3.22Å; Y110-F136 WeakPolarHBondContact O-CE2 3.26Å; Y110-F136 WeakPolarHBondContact O-CZ 3.39Å; M111-F136 HydrophobicContact SD-CZ 4.26Å; L116-F136 HydrophobicContact CB-CB 3.89Å; L116-F136 HydrophobicContact CB-CD2 4.4Å; L116-F136 HydrophobicContact CD1-CB 4.29Å; I117-F136 HydrophobicContact CD1-CD1 4.11Å; I117-F136 HydrophobicContact CD1-CD2 3.97Å; I117-F136 HydrophobicContact CD1-CE1 3.74Å; I117-F136 HydrophobicContact CD1-CE2 3.58Å; I117-F136 HydrophobicContact CD1-CG 4.22Å; I117-F136 HydrophobicContact CD1-CZ 3.46Å; I117-F136 VanDerWaalsContact CD1-CZ 3.46Å; I117-F136 HydrophobicContact CG1-CD1 4.02Å; I117-F136 HydrophobicContact CG1-CD2 3.79Å; I117-F136 HydrophobicContact CG1-CE1 4.18Å; I117-F136 HydrophobicContact CG1-CE2 3.95Å; I117-F136 HydrophobicContact CG1-CG 3.83Å; I117-F136 HydrophobicContact CG1-CZ 4.16Å; S132-F136 WeakPolarHBondContact O-CB 3.22Å; S132-F136 PolarHBondContact O-N 3.33Å; V133-F136 WeakPolarHBondContact O-CB 3.41Å; V133-F136 PolarHBondContact O-N 2.86Å; A134-F136 VanDerWaalsContact C-N 3.34Å; F136-V138 VanDerWaalsContact C-N 3.29Å; F136-V138 PolarHBondContact O-N 3.24Å; F136-S139 WeakPolarHBondContact CA-OG 3.13Å; F136-S139 PolarHBondContact O-N 3.41Å; F136-S139 PolarHBondContact O-OG 2.61Å; F136-A140 WeakPolarHBondContact O-CB 3.48Å; F136-A140 PolarHBondContact O-N 3.15Å; F136-F196 HydrophobicContact CE1-CD2 4Å; F136-F196 AromaticContact CE1-CE2 3.58Å; F136-F196 HydrophobicContact CE1-CE2 3.58Å; F136-F196 AromaticContact CE1-CZ 3.86Å; F136-F196 HydrophobicContact CE1-CZ 3.86Å; F136-F196 HydrophobicContact CZ-CD2 4.44Å; F136-F196 HydrophobicContact CZ-CE1 4.24Å; F136-F196 HydrophobicContact CZ-CE2 4.11Å; F136-F196 AromaticContact CZ-CZ 4Å; F136-F196 HydrophobicContact CZ-CZ 4Å; F136-W232 HydrophobicContact CD1-CH2 4.14Å; F136-W232 HydrophobicContact CD1-CZ2 4.27Å; F136-W232 HydrophobicContact CE1-CH2 4.15Å; F136-W232 HydrophobicContact CE1-CZ2 4.2Å
137	A	98.8	Very high	96.9	Very high	4 Å²	4	14.1 Å²	14.1	3%	0.033	7%	0.068	C	C	.	.	H	α-helix	trans	-57.5	-38.8	-179.9	0	0	0	0	0	113.1	V133 A134 W232 I257	V133-A137 PolarHBondContact O-N 3.22Å; A134-A137 PolarHBondContact O-N 3.49Å; A137-W232 HydrophobicContact CB-CD2 4.41Å; A137-W232 HydrophobicContact CB-CZ2 4.06Å; A137-I257 HydrophobicContact CB-CD1 3.75Å
138	V	98.8	Very high	96.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-74	-41.3	174.4	176.9	0	0	0	0	111.5	A134 A135 F136 A140 V141 A142 L268 F270 V283 W302 L306 W364	A134-V138 PolarHBondContact O-N 2.81Å; A135-V138 PolarHBondContact O-N 2.82Å; F136-V138 VanDerWaalsContact C-N 3.29Å; F136-V138 PolarHBondContact O-N 3.24Å; V138-A140 VanDerWaalsContact C-N 3.27Å; V138-A140 PolarHBondContact O-N 2.93Å; V138-V141 VanDerWaalsContact O-CG2 3.29Å; V138-V141 WeakPolarHBondContact O-CG2 3.36Å; V138-V141 PolarHBondContact O-N 2.84Å; V138-A142 PolarHBondContact O-N 3.01Å; V138-L268 HydrophobicContact CG2-CD1 3.69Å; V138-F270 HydrophobicContact CB-CZ 4.4Å; V138-F270 HydrophobicContact CG1-CE1 4.47Å; V138-F270 HydrophobicContact CG1-CZ 4.33Å; V138-F270 HydrophobicContact CG2-CE2 4.33Å; V138-F270 HydrophobicContact CG2-CZ 3.83Å; V138-V283 HydrophobicContact CG1-CG2 4.43Å; V138-V283 HydrophobicContact CG2-CG1 4.34Å; V138-W302 HydrophobicContact CG1-CB 3.81Å; V138-L306 HydrophobicContact CB-CD1 3.57Å; V138-L306 HydrophobicContact CB-CG 4.42Å; V138-L306 HydrophobicContact CG1-CD1 3.81Å; V138-L306 HydrophobicContact CG1-CD2 4.43Å; V138-L306 HydrophobicContact CG1-CG 4.12Å; V138-L306 HydrophobicContact CG2-CD1 3.7Å; V138-W364 HydrophobicContact CG1-CZ3 4.28Å
139	S	98.6	Very high	95.8	Very high	3 Å²	3	11 Å²	11	2%	0.021	6%	0.057	C	C	.	.	H	α-helix	trans	-64.8	-31.5	-179.6	74.2	0	0	0	0	113.3	H113 L116 A135 F136 V141 A142 W364	H113-S139 WeakPolarHBondContact CB-OG 3.29Å; L116-S139 WeakPolarHBondContact CD1-OG 3.27Å; A135-S139 VanDerWaalsContact O-CB 3.31Å; A135-S139 WeakPolarHBondContact O-CB 3.37Å; A135-S139 PolarHBondContact O-N 3.33Å; A135-S139 PolarHBondContact O-OG 2.84Å; F136-S139 WeakPolarHBondContact CA-OG 3.13Å; F136-S139 PolarHBondContact O-N 3.41Å; F136-S139 PolarHBondContact O-OG 2.61Å; S139-V141 PolarHBondContact O-N 2.96Å; S139-A142 VanDerWaalsContact O-CB 3.27Å; S139-A142 WeakPolarHBondContact O-CB 3.02Å; S139-A142 PolarHBondContact O-N 2.99Å; S139-A142 VanDerWaalsContact O-N 3.09Å; S139-W364 VanDerWaalsContact CB-NE1 3.31Å
140	A	98.1	Very high	95.3	Very high	2 Å²	2	14.2 Å²	14.2	2%	0.017	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.9	179.4	0	0	0	0	0	112.2	Y110 F136 V138	Y110-A140 HydrophobicContact CD1-CB 3.93Å; Y110-A140 WeakPolarHBondContact CD1-O 3.39Å; Y110-A140 HydrophobicContact CG-CB 4.06Å; F136-A140 WeakPolarHBondContact O-CB 3.48Å; F136-A140 PolarHBondContact O-N 3.15Å; V138-A140 VanDerWaalsContact C-N 3.27Å; V138-A140 PolarHBondContact O-N 2.93Å
141	V	96.3	Very high	95	Very high	9 Å²	9	15.1 Å²	15.1	6%	0.055	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	11.1	179.5	-60.7	0	0	0	0	112.8	Y110 V138 S139 Q144 P235 Q251 F270	Y110-V141 HydrophobicContact CE1-CG1 4.22Å; V138-V141 VanDerWaalsContact O-CG2 3.29Å; V138-V141 WeakPolarHBondContact O-CG2 3.36Å; V138-V141 PolarHBondContact O-N 2.84Å; S139-V141 PolarHBondContact O-N 2.96Å; V141-Q144 WeakPolarHBondContact O-CG 2.99Å; V141-P235 HydrophobicContact CG2-CG 4.26Å; V141-Q251 VanDerWaalsContact CB-OE1 3.27Å; V141-Q251 PolarHBondContact O-NE2 3.46Å; V141-F270 HydrophobicContact CG2-CE1 4.13Å; V141-F270 HydrophobicContact CG2-CZ 4.27Å
142	A	96.2	Very high	94.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-76.4	-31.5	-174	0	0	0	0	0	114.1	V138 S139 Q144 W302 W364 I366	V138-A142 PolarHBondContact O-N 3.01Å; S139-A142 VanDerWaalsContact O-CB 3.27Å; S139-A142 WeakPolarHBondContact O-CB 3.02Å; S139-A142 PolarHBondContact O-N 2.99Å; S139-A142 VanDerWaalsContact O-N 3.09Å; A142-Q144 PolarHBondContact O-N 2.89Å; A142-W302 VanDerWaalsContact CB-O 3.25Å; A142-W302 WeakPolarHBondContact CB-O 3.27Å; A142-W364 HydrophobicContact CB-CH2 3.58Å; A142-W364 HydrophobicContact CB-CZ2 3.47Å; A142-W364 VanDerWaalsContact CB-CZ2 3.47Å; A142-I366 HydrophobicContact CB-CD1 4.07Å; A142-I366 HydrophobicContact CB-CG1 4.44Å
143	S	95.2	Very high	94.6	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.028	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-66.2	-9.7	-174.2	69.1	0	0	0	0	114.1	E109 W145 R147 R369	E109-S143 VanDerWaalsContact OE2-CB 3.31Å; E109-S143 WeakPolarHBondContact OE2-CB 3.14Å; E109-S143 PolarHBondContact OE2-OG 3.3Å; S143-W145 PolarHBondContact O-N 3.35Å; S143-R147 WeakPolarHBondContact O-CG 3.36Å; S143-R369 PolarHBondContact O-NH2 3.11Å
144	Q	91.8	Very high	94.5	Very high	27 Å²	27	17.7 Å²	17.7	13%	0.126	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-76	-18.8	-169.2	-48.2	-61.1	-62.1	0	0	114.2	V141 A142 E146 R147 I249 W302	V141-Q144 WeakPolarHBondContact O-CG 2.99Å; A142-Q144 PolarHBondContact O-N 2.89Å; Q144-E146 PolarHBondContact O-N 3.03Å; Q144-R147 WeakPolarHBondContact O-CB 3.49Å; Q144-R147 PolarHBondContact O-N 3.45Å; Q144-R147 VanDerWaalsContact O-N 3.15Å; Q144-I249 HydrophobicContact CB-CG2 4.44Å; Q144-I249 WeakPolarHBondContact O-CD1 3.27Å; Q144-W302 HydrophobicContact CB-CZ3 4.41Å
145	W	91.1	Very high	94.4	Very high	30 Å²	30	18 Å²	18	11%	0.114	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	134	-179.8	178.2	-123.1	0	0	0	110.9	S143 R147 W248 I249 H281 W302 T303 A350 R369	S143-W145 PolarHBondContact O-N 3.35Å; W145-R147 PolarHBondContact O-N 2.81Å; W145-W248 HydrophobicContact CZ3-CB 4.49Å; W145-W248 HydrophobicContact CZ3-CE3 4.5Å; W145-I249 WeakPolarHBondContact CZ3-O 3.44Å; W145-H281 AromaticContact CD2-CE1 3.79Å; W145-H281 AromaticContact CE3-CE1 3.37Å; W145-H281 AromaticContact CE3-NE2 3.51Å; W145-H281 AromaticContact CH2-CE1 3.63Å; W145-H281 AromaticContact CZ3-CE1 3.29Å; W145-H281 WeakPolarHBondContact CZ3-CE1 3.19Å; W145-H281 AromaticContact CZ3-NE2 3.32Å; W145-H281 VanDerWaalsContact CZ3-NE2 3.32Å; W145-H281 WeakPolarHBondContact CZ3-NE2 3.24Å; W145-W302 HydrophobicContact CB-CH2 4.01Å; W145-W302 HydrophobicContact CB-CZ3 3.94Å; W145-W302 HydrophobicContact CE3-CH2 4.39Å; W145-T303 HydrophobicContact CB-CG2 3.78Å; W145-T303 HydrophobicContact CD2-CG2 4.23Å; W145-T303 HydrophobicContact CG-CG2 3.87Å; W145-A350 HydrophobicContact CZ2-CB 4.25Å; W145-R369 PolarHBondContact O-NH1 3.45Å; W145-R369 PolarHBondContact O-NH2 2.88Å
146	E	89.4	Confident	94.3	Very high	81 Å²	81	19 Å²	19	38%	0.379	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	-2.1	-176	-48.5	173	140.9	0	0	116.8	Q144 T148 R369 N378	Q144-E146 PolarHBondContact O-N 3.03Å; E146-T148 PolarHBondContact O-N 3.22Å; E146-R369 IonicContact OE2-NH1 2.86Å; E146-R369 PolarHBondContact OE2-NH1 3.06Å; E146-N378 HydrophobicContact CB-CB 4.13Å; E146-N378 PolarHBondContact O-ND2 3.24Å
147	R	92.1	Very high	94.3	Very high	3 Å²	3	19.1 Å²	19.1	1%	0.011	10%	0.098	C	C	.	.			trans	-82.3	59.8	175.3	-73.1	-79.6	-59.7	-75.9	8	111.5	E99 R106 E109 S143 Q144 W145 G149 I249 Y377 N378	E99-R147 IonicContact OE1-CZ 3.85Å; E99-R147 IonicContact OE1-NE 2.83Å; E99-R147 IonicContact OE1-NH2 2.79Å; E99-R147 PolarHBondContact OE1-NH2 3.5Å; E99-R147 IonicContact OE2-CZ 3.96Å; E99-R147 IonicContact OE2-NE 3.4Å; E99-R147 PolarHBondContact OE2-NE 3.35Å; E99-R147 IonicContact OE2-NH2 3.28Å; E99-R147 PolarHBondContact OE2-NH2 2.91Å; E99-R147 VanDerWaalsContact OE2-NH2 3.12Å; R106-R147 VanDerWaalsContact CZ-CZ 3.41Å; E109-R147 VanDerWaalsContact CD-NH1 3.26Å; E109-R147 IonicContact OE1-CZ 3.65Å; E109-R147 IonicContact OE1-NH1 3.11Å; E109-R147 PolarHBondContact OE1-NH1 3.31Å; E109-R147 IonicContact OE1-NH2 3.95Å; E109-R147 PolarHBondContact OE1-NH2 2.97Å; E109-R147 IonicContact OE2-CZ 2.68Å; E109-R147 IonicContact OE2-NH1 2.68Å; E109-R147 PolarHBondContact OE2-NH1 2.89Å; S143-R147 WeakPolarHBondContact O-CG 3.36Å; Q144-R147 WeakPolarHBondContact O-CB 3.49Å; Q144-R147 PolarHBondContact O-N 3.45Å; Q144-R147 VanDerWaalsContact O-N 3.15Å; W145-R147 PolarHBondContact O-N 2.81Å; R147-G149 PolarHBondContact O-N 2.84Å; R147-I249 VanDerWaalsContact C-CD1 3.48Å; R147-I249 WeakPolarHBondContact O-CD1 3.36Å; R147-Y377 VanDerWaalsContact CD-O 3.23Å; R147-Y377 WeakPolarHBondContact CD-O 3.28Å; R147-N378 WeakPolarHBondContact CD-O 3.31Å
148	T	86.7	Confident	94.3	Very high	37 Å²	37	18.9 Å²	18.9	23%	0.227	10%	0.096	C	C	.	.			trans	-74.8	-2.5	-176.2	57.8	0	0	0	0	113.9	R71 E146 L247 I249	R71-T148 PolarHBondContact NH1-OG1 2.84Å; E146-T148 PolarHBondContact O-N 3.22Å; T148-L247 HydrophobicContact CG2-CB 3.69Å; T148-I249 HydrophobicContact CG2-CD1 4.27Å; T148-I249 HydrophobicContact CG2-CG1 4.3Å
149	G	87.1	Confident	94.3	Very high	6 Å²	6	19 Å²	19	6%	0.062	10%	0.097	C	C	.	.	S	Bend	trans	-71.3	135.8	172.1	0	0	0	0	0	112.1	F97 R106 R147	F97-G149 WeakPolarHBondContact O-CA 3.23Å; R106-G149 PolarHBondContact NH2-O 2.89Å; R147-G149 PolarHBondContact O-N 2.84Å
150	K	88	Confident	94.3	Very high	78 Å²	78	18.8 Å²	18.8	34%	0.339	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.5	171.9	-171.2	-169.4	169.1	-178.6	0	108.7	M93 F97 N98 E99	M93-K150 HydrophobicContact CB-CD 4.16Å; M93-K150 HydrophobicContact CG-CD 3.82Å; F97-K150 PolarHBondContact O-N 3.25Å; N98-K150 CarbonylContact C-O 3.59Å; N98-K150 WeakPolarHBondContact CA-O 3.49Å; N98-K150 WeakPolarHBondContact CB-O 3.43Å; N98-K150 PolarHBondContact ND2-O 3.37Å; E99-K150 PolarHBondContact N-O 2.82Å
151	P	93.8	Very high	94.3	Very high	20 Å²	20	19.3 Å²	19.3	13%	0.13	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	155.4	168.8	26.9	-32.5	0	0	0	110.3	N98 L101 F103 R106 N153	N98-P151 PolarHBondContact ND2-O 3.48Å; L101-P151 CarbonylContact O-C 3.23Å; L101-P151 VanDerWaalsContact O-CA 3.31Å; L101-P151 WeakPolarHBondContact O-CA 2.92Å; L101-P151 WeakPolarHBondContact O-CB 3.44Å; F103-P151 HydrophobicContact CB-CB 4.36Å; F103-P151 HydrophobicContact CB-CG 4.26Å; F103-P151 HydrophobicContact CD2-CG 3.81Å; F103-P151 HydrophobicContact CG-CG 4.5Å; R106-P151 HydrophobicContact CB-CB 4.31Å; R106-P151 HydrophobicContact CB-CG 4.32Å; R106-P151 HydrophobicContact CG-CG 4.42Å; P151-N153 PolarHBondContact O-N 3.47Å
152	F	94.5	Very high	94.4	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.009	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	137.6	172.9	-77.8	-107	0	0	0	109.7	I95 N98 E99 L101 F103 P154 D407 I408 M411 K423	I95-F152 HydrophobicContact CD1-CE1 4.07Å; I95-F152 HydrophobicContact CD1-CZ 3.81Å; I95-F152 HydrophobicContact CG1-CE1 4.39Å; I95-F152 HydrophobicContact CG1-CZ 3.88Å; N98-F152 HydrophobicContact CB-CD2 4.12Å; N98-F152 HydrophobicContact CB-CE2 3.67Å; N98-F152 HydrophobicContact CB-CZ 4.09Å; E99-F152 VanDerWaalsContact O-CD2 3.27Å; E99-F152 WeakPolarHBondContact O-CD2 3.46Å; E99-F152 VanDerWaalsContact O-CE2 3.3Å; E99-F152 WeakPolarHBondContact O-CE2 3.38Å; L101-F152 PolarHBondContact O-N 3.04Å; F103-F152 PolarHBondContact N-O 2.9Å; F152-P154 WeakPolarHBondContact O-CD 3.41Å; F152-D407 WeakPolarHBondContact CD1-OD2 3.13Å; F152-D407 HydrophobicContact CE1-CB 4.08Å; F152-D407 WeakPolarHBondContact CE1-OD2 3.35Å; F152-I408 HydrophobicContact CB-CD1 3.99Å; F152-I408 HydrophobicContact CB-CG1 4.1Å; F152-I408 HydrophobicContact CD1-CG1 4.02Å; F152-I408 HydrophobicContact CD2-CD1 4.37Å; F152-I408 HydrophobicContact CD2-CG1 3.8Å; F152-I408 HydrophobicContact CE1-CG1 4.38Å; F152-I408 HydrophobicContact CE2-CG1 4.18Å; F152-I408 HydrophobicContact CG-CD1 4.16Å; F152-I408 HydrophobicContact CG-CG1 3.71Å; F152-I408 HydrophobicContact CZ-CG1 4.45Å; F152-M411 HydrophobicContact CE2-SD 3.57Å; F152-M411 VanDerWaalsContact CE2-SD 3.57Å; F152-M411 HydrophobicContact CZ-CB 4.36Å; F152-M411 HydrophobicContact CZ-SD 3.76Å; F152-K423 HydrophobicContact CE1-CD 4.25Å
153	N	93.4	Very high	94.4	Very high	66 Å²	66	22.6 Å²	22.6	35%	0.353	11%	0.114	S	C	.	.	P	Polyproline II helix	trans	-69.5	120.9	172.4	-167.8	21.9	0	0	0	107.4	P151 H178 R405	P151-N153 PolarHBondContact O-N 3.47Å; N153-H178 PolarHBondContact ND2-CE1 3.31Å; N153-H178 VanDerWaalsContact ND2-CE1 3.29Å; N153-R405 PolarHBondContact O-NH1 3.03Å
154	P	97.1	Very high	94.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-63.3	145	-179.1	-19.9	33.1	0	0	0	110.6	S102 F103 L104 F152 E158 Q175	S102-P154 WeakPolarHBondContact OG-CG 3.32Å; F103-P154 HydrophobicContact CB-CG 3.72Å; L104-P154 HydrophobicContact CD1-CB 4.33Å; L104-P154 HydrophobicContact CD2-CB 4.29Å; L104-P154 HydrophobicContact CD2-CG 3.97Å; L104-P154 HydrophobicContact CG-CB 3.98Å; L104-P154 HydrophobicContact CG-CG 3.79Å; F152-P154 WeakPolarHBondContact O-CD 3.41Å; P154-E158 HydrophobicContact CB-CB 4.16Å; P154-E158 HydrophobicContact CB-CG 4.38Å; P154-Q175 HydrophobicContact CB-CB 3.8Å; P154-Q175 HydrophobicContact CB-CG 3.86Å; P154-Q175 VanDerWaalsContact CG-OE1 3.3Å
155	L	97.1	Very high	94.7	Very high	6 Å²	6	29.6 Å²	29.6	3%	0.031	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-71.7	152.3	170.6	-56.6	176	0	0	0	109.7	G157 E158 Q175 L426 Q430 I479 Y480	L155-G157 PolarHBondContact O-N 2.87Å; L155-E158 HydrophobicContact CB-CB 4.3Å; L155-E158 PolarHBondContact N-OE2 2.7Å; L155-E158 VanDerWaalsContact N-OE2 3.07Å; L155-E158 WeakPolarHBondContact O-CB 3.47Å; L155-E158 PolarHBondContact O-N 2.78Å; L155-Q175 WeakPolarHBondContact O-CB 3.34Å; L155-Q175 WeakPolarHBondContact O-CG 3.38Å; L155-L426 HydrophobicContact CD1-CB 4.17Å; L155-L426 HydrophobicContact CD1-CD1 4.49Å; L155-L426 HydrophobicContact CD1-CD2 4.1Å; L155-L426 HydrophobicContact CD1-CG 4.49Å; L155-L426 HydrophobicContact CD2-CB 4.5Å; L155-Q430 VanDerWaalsContact CA-OE1 3.25Å; L155-Q430 HydrophobicContact CD2-CB 4.41Å; L155-I479 HydrophobicContact CB-CD1 4.5Å; L155-I479 HydrophobicContact CD1-CB 4.42Å; L155-I479 VanDerWaalsContact CD1-O 3.22Å; L155-I479 WeakPolarHBondContact CD1-O 3.19Å; L155-Y480 HydrophobicContact CD1-CD1 3.98Å; L155-Y480 HydrophobicContact CD1-CE1 4.01Å
156	L	97.8	Very high	94.9	Very high	22 Å²	22	32.5 Å²	32.5	12%	0.115	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	126.4	173.6	-175.8	64.8	0	0	0	110	E158 H178 W444	L156-E158 VanDerWaalsContact C-N 3.27Å; L156-E158 PolarHBondContact O-N 2.81Å; L156-H178 HydrophobicContact CB-CB 4.3Å; L156-H178 HydrophobicContact CD1-CB 4.45Å; L156-W444 HydrophobicContact CD1-CD2 4.46Å; L156-W444 HydrophobicContact CD1-CG 4.31Å; L156-W444 HydrophobicContact CD2-CB 4.17Å; L156-W444 HydrophobicContact CD2-CD2 3.62Å; L156-W444 HydrophobicContact CD2-CE3 3.97Å; L156-W444 HydrophobicContact CD2-CG 3.68Å; L156-W444 HydrophobicContact CG-CD2 3.83Å; L156-W444 HydrophobicContact CG-CE3 4.38Å; L156-W444 HydrophobicContact CG-CG 4.09Å; L156-W444 HydrophobicContact CG-CZ2 4.11Å
157	G	97.9	Very high	95.3	Very high	1 Å²	1	31 Å²	31	1%	0.01	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	-0.7	-174.1	0	0	0	0	0	115	L155 Q175	L155-G157 PolarHBondContact O-N 2.87Å; G157-Q175 PolarHBondContact N-O 3.26Å
158	E	98.8	Very high	95.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.			trans	-60	138.6	168.8	-173.5	174.2	122.6	0	0	109.9	S102 L104 P154 L155 L156 E174 Q175 C402 R405 I479 Y480	S102-E158 VanDerWaalsContact CB-OE1 3.27Å; S102-E158 WeakPolarHBondContact CB-OE1 3.44Å; S102-E158 PolarHBondContact OG-OE1 2.92Å; L104-E158 HydrophobicContact CD1-CB 4.25Å; L104-E158 HydrophobicContact CD1-CG 3.93Å; L104-E158 WeakPolarHBondContact CD1-O 3.49Å; P154-E158 HydrophobicContact CB-CB 4.16Å; P154-E158 HydrophobicContact CB-CG 4.38Å; L155-E158 HydrophobicContact CB-CB 4.3Å; L155-E158 PolarHBondContact N-OE2 2.7Å; L155-E158 VanDerWaalsContact N-OE2 3.07Å; L155-E158 WeakPolarHBondContact O-CB 3.47Å; L155-E158 PolarHBondContact O-N 2.78Å; L156-E158 VanDerWaalsContact C-N 3.27Å; L156-E158 PolarHBondContact O-N 2.81Å; E158-E174 CarbonylContact O-C 3.58Å; E158-E174 WeakPolarHBondContact O-CA 3.39Å; E158-Q175 HydrophobicContact CB-CB 4.39Å; E158-Q175 PolarHBondContact O-N 2.93Å; E158-C402 HydrophobicContact CG-CB 3.95Å; E158-C402 VanDerWaalsContact OE1-CB 3.3Å; E158-C402 WeakPolarHBondContact OE1-CB 3.37Å; E158-R405 IonicContact OE1-NH1 2.75Å; E158-R405 VanDerWaalsContact OE2-CD 3.31Å; E158-R405 WeakPolarHBondContact OE2-CD 3.19Å; E158-R405 IonicContact OE2-CZ 2.89Å; E158-R405 IonicContact OE2-NE 2.77Å; E158-R405 IonicContact OE2-NH1 3.56Å; E158-R405 PolarHBondContact OE2-NH1 2.64Å; E158-I479 VanDerWaalsContact CA-CD1 3.44Å; E158-I479 HydrophobicContact CB-CD1 3.91Å; E158-I479 HydrophobicContact CG-CD1 4.47Å; E158-Y480 WeakPolarHBondContact CG-OH 3.39Å
159	T	98.8	Very high	96.1	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	161.1	178.7	58.3	0	0	0	0	111	S173 E174 T400 D401 C402	T159-S173 CarbonylContact C-O 3.58Å; T159-S173 WeakPolarHBondContact CA-O 3.4Å; T159-E174 HydrophobicContact CG2-CB 4.34Å; T159-E174 HydrophobicContact CG2-CG 4.19Å; T159-T400 PolarHBondContact N-O 2.95Å; T159-T400 VanDerWaalsContact O-O 3.11Å; T159-T400 WeakPolarHBondContact OG1-CB 3.44Å; T159-T400 PolarHBondContact OG1-O 3.05Å; T159-T400 PolarHBondContact OG1-OG1 3.38Å; T159-D401 CarbonylContact O-C 3.48Å; T159-D401 VanDerWaalsContact O-CA 3.29Å; T159-D401 WeakPolarHBondContact O-CA 3.45Å; T159-D401 PolarHBondContact OG1-N 2.79Å; T159-C402 PolarHBondContact O-N 3.32Å
160	Y	98.9	Very high	96.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	127.8	166.4	175.2	-106.1	0	0	0	110.3	Q105 T108 L162 I172 S173 L386 D401 C402 R403	Q105-Y160 HydrophobicContact CG-CD1 3.99Å; Q105-Y160 HydrophobicContact CG-CD2 3.58Å; Q105-Y160 HydrophobicContact CG-CE1 3.9Å; Q105-Y160 HydrophobicContact CG-CE2 3.47Å; Q105-Y160 VanDerWaalsContact CG-CE2 3.47Å; Q105-Y160 HydrophobicContact CG-CG 3.83Å; T108-Y160 HydrophobicContact CG2-CE1 3.9Å; T108-Y160 VanDerWaalsContact OG1-CD1 3.24Å; T108-Y160 WeakPolarHBondContact OG1-CD1 3.32Å; T108-Y160 WeakPolarHBondContact OG1-CE1 3.38Å; Y160-L162 HydrophobicContact CE1-CB 4.02Å; Y160-I172 CarbonylContact O-C 3.56Å; Y160-I172 WeakPolarHBondContact O-CA 3.45Å; Y160-I172 WeakPolarHBondContact O-CD1 3.27Å; Y160-S173 PolarHBondContact N-O 3.42Å; Y160-S173 PolarHBondContact O-N 3.03Å; Y160-S173 PolarHBondContact O-OG 2.84Å; Y160-L386 WeakPolarHBondContact CE2-O 3.34Å; Y160-L386 WeakPolarHBondContact OH-CA 3.18Å; Y160-L386 WeakPolarHBondContact OH-CD2 3.42Å; Y160-L386 PolarHBondContact OH-O 3.04Å; Y160-D401 WeakPolarHBondContact CA-OD2 3.37Å; Y160-C402 WeakPolarHBondContact CD2-SG 3.27Å; Y160-R403 HydrophobicContact CE2-CG 4.43Å; Y160-R403 VanDerWaalsContact CE2-NH1 3.3Å; Y160-R403 VanDerWaalsContact CE2-NH2 3.32Å; Y160-R403 PolarHBondContact OH-NH2 3.26Å
161	E	98.6	Very high	97.2	Very high	12 Å²	12	29.1 Å²	29.1	6%	0.056	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	152.5	170.3	67.9	164.2	179.5	0	0	113.8	F171 I172 L397 D401 R403 Y468 R471	E161-F171 CarbonylContact C-O 3.55Å; E161-F171 VanDerWaalsContact CA-O 3.29Å; E161-F171 WeakPolarHBondContact CA-O 3.45Å; E161-I172 HydrophobicContact CB-CD1 4.32Å; E161-L397 HydrophobicContact CG-CD2 3.86Å; E161-L397 VanDerWaalsContact OE1-CD2 3.26Å; E161-L397 WeakPolarHBondContact OE1-CD2 3.43Å; E161-D401 PolarHBondContact N-OD2 3.25Å; E161-R403 VanDerWaalsContact O-CZ 3.25Å; E161-R403 PolarHBondContact O-NH1 3.01Å; E161-R403 PolarHBondContact O-NH2 3Å; E161-Y468 HydrophobicContact CB-CE1 3.78Å; E161-Y468 WeakPolarHBondContact CB-OH 3.34Å; E161-Y468 HydrophobicContact CG-CE1 4.3Å; E161-Y468 WeakPolarHBondContact OE2-CE1 3.33Å; E161-R471 IonicContact OE1-CZ 3.89Å; E161-R471 IonicContact OE1-NH1 3.84Å; E161-R471 PolarHBondContact OE1-NH1 3.36Å; E161-R471 IonicContact OE1-NH2 3.7Å; E161-R471 PolarHBondContact OE1-NH2 2.9Å; E161-R471 IonicContact OE2-CZ 3.12Å; E161-R471 VanDerWaalsContact OE2-CZ 3.24Å; E161-R471 IonicContact OE2-NH1 3.23Å; E161-R471 PolarHBondContact OE2-NH1 2.86Å; E161-R471 IonicContact OE2-NH2 3.97Å; E161-R471 PolarHBondContact OE2-NH2 3.44Å
162	L	98.2	Very high	97.4	Very high	11 Å²	11	28.1 Å²	28.1	6%	0.058	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	125.7	168	-179.6	67	0	0	0	110.1	T108 Y160 R164 F169 R170 F171 F382 L386	T108-L162 HydrophobicContact CG2-CB 4.12Å; T108-L162 HydrophobicContact CG2-CD2 3.52Å; T108-L162 HydrophobicContact CG2-CG 4.47Å; Y160-L162 HydrophobicContact CE1-CB 4.02Å; L162-R164 HydrophobicContact CD1-CG 4.11Å; L162-R164 HydrophobicContact CD2-CG 4.04Å; L162-R164 HydrophobicContact CG-CG 3.93Å; L162-F169 HydrophobicContact CD2-CE2 4.13Å; L162-F169 HydrophobicContact CD2-CZ 3.93Å; L162-F169 HydrophobicContact CG-CE2 4.48Å; L162-R170 CarbonylContact O-C 3.52Å; L162-R170 WeakPolarHBondContact O-CA 3.3Å; L162-F171 HydrophobicContact CB-CB 4.31Å; L162-F171 PolarHBondContact N-O 2.92Å; L162-F171 PolarHBondContact O-N 3.06Å; L162-F382 HydrophobicContact CD2-CE2 4.4Å; L162-F382 HydrophobicContact CD2-CZ 3.78Å; L162-L386 HydrophobicContact CD2-CD2 3.77Å
163	I	97.1	Very high	97.6	Very high	68 Å²	68	28 Å²	28	35%	0.349	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124	170.5	-55.7	176.8	0	0	0	107.5	E165 R170 F469	I163-E165 HydrophobicContact CG2-CG 4.23Å; I163-R170 HydrophobicContact CG1-CB 4.05Å; I163-F469 HydrophobicContact CD1-CE1 4.37Å; I163-F469 HydrophobicContact CG1-CE1 4.45Å
164	R	96.7	Very high	97.9	Very high	20 Å²	20	25 Å²	25	8%	0.075	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	86.7	177.2	-71.8	-66.2	-61.7	-90.6	2.4	108.6	H60 L162 D166 L167 G168 F169	H60-R164 PolarHBondContact NE2-NE 3.08Å; L162-R164 HydrophobicContact CD1-CG 4.11Å; L162-R164 HydrophobicContact CD2-CG 4.04Å; L162-R164 HydrophobicContact CG-CG 3.93Å; R164-D166 IonicContact CZ-OD1 3.85Å; R164-D166 IonicContact CZ-OD2 3.03Å; R164-D166 IonicContact NE-OD1 2.79Å; R164-D166 PolarHBondContact NE-OD1 2.88Å; R164-D166 IonicContact NE-OD2 2.79Å; R164-D166 IonicContact NH2-OD1 2.86Å; R164-D166 PolarHBondContact NH2-OD1 3.14Å; R164-D166 IonicContact NH2-OD2 3.74Å; R164-D166 PolarHBondContact NH2-OD2 3Å; R164-D166 PolarHBondContact O-N 2.99Å; R164-L167 HydrophobicContact CB-CB 3.87Å; R164-L167 HydrophobicContact CB-CD1 4.26Å; R164-L167 HydrophobicContact CB-CG 4.19Å; R164-L167 HydrophobicContact CG-CD1 4.34Å; R164-L167 CarbonylContact O-C 3.59Å; R164-L167 PolarHBondContact O-N 2.8Å; R164-L167 VanDerWaalsContact O-N 3.12Å; R164-G168 PolarHBondContact O-N 2.86Å; R164-F169 HydrophobicContact CB-CD1 4.02Å; R164-F169 HydrophobicContact CB-CE1 3.61Å; R164-F169 HydrophobicContact CB-CZ 3.96Å; R164-F169 HydrophobicContact CG-CE1 3.93Å; R164-F169 HydrophobicContact CG-CZ 3.85Å; R164-F169 PolarHBondContact N-O 3.49Å; R164-F169 PolarHBondContact O-N 3.12Å
165	E	96.1	Very high	97.9	Very high	158 Å²	158	25.1 Å²	25.1	74%	0.738	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.4	177.5	-64.9	-175.9	168.7	0	0	111.5	I163 L167 G168 L190	I163-E165 HydrophobicContact CG2-CG 4.23Å; E165-L167 VanDerWaalsContact C-N 3.27Å; E165-L167 PolarHBondContact O-N 3.02Å; E165-G168 PolarHBondContact O-N 2.86Å; E165-L190 HydrophobicContact CB-CD1 4.45Å; E165-L190 HydrophobicContact CG-CD1 4.25Å
166	D	95.4	Very high	98	Very high	90 Å²	90	25 Å²	25	48%	0.481	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.7	177	68.7	-51.7	0	0	0	113.4	R164	R164-D166 IonicContact CZ-OD1 3.85Å; R164-D166 IonicContact CZ-OD2 3.03Å; R164-D166 IonicContact NE-OD1 2.79Å; R164-D166 PolarHBondContact NE-OD1 2.88Å; R164-D166 IonicContact NE-OD2 2.79Å; R164-D166 IonicContact NH2-OD1 2.86Å; R164-D166 PolarHBondContact NH2-OD1 3.14Å; R164-D166 IonicContact NH2-OD2 3.74Å; R164-D166 PolarHBondContact NH2-OD2 3Å; R164-D166 PolarHBondContact O-N 2.99Å
167	L	96.6	Very high	97.9	Very high	50 Å²	50	25 Å²	25	26%	0.262	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-5.4	175.9	-58.7	-178.1	0	0	0	113.4	V114 H118 R164 E165 F169 F382	V114-L167 HydrophobicContact CG1-CB 3.86Å; H118-L167 PolarHBondContact NE2-O 3.36Å; R164-L167 HydrophobicContact CB-CB 3.87Å; R164-L167 HydrophobicContact CB-CD1 4.26Å; R164-L167 HydrophobicContact CB-CG 4.19Å; R164-L167 HydrophobicContact CG-CD1 4.34Å; R164-L167 CarbonylContact O-C 3.59Å; R164-L167 PolarHBondContact O-N 2.8Å; R164-L167 VanDerWaalsContact O-N 3.12Å; E165-L167 VanDerWaalsContact C-N 3.27Å; E165-L167 PolarHBondContact O-N 3.02Å; L167-F169 HydrophobicContact CB-CD1 3.82Å; L167-F169 HydrophobicContact CB-CE1 3.75Å; L167-F169 HydrophobicContact CD1-CE1 3.89Å; L167-F169 HydrophobicContact CG-CE1 4.47Å; L167-F382 HydrophobicContact CD1-CD2 4.21Å; L167-F382 HydrophobicContact CD1-CE2 3.91Å
168	G	97.8	Very high	97.5	Very high	12 Å²	12	26.7 Å²	26.7	12%	0.124	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	27.8	174.3	0	0	0	0	0	116.2	R164 E165 G189 L190	R164-G168 PolarHBondContact O-N 2.86Å; E165-G168 PolarHBondContact O-N 2.86Å; G168-G189 CarbonylContact O-C 3.59Å; G168-G189 WeakPolarHBondContact O-CA 3.29Å; G168-L190 PolarHBondContact O-N 2.95Å
169	F	98.6	Very high	96.9	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	160	177.1	77	-84.6	0	0	0	114.7	M111 V114 L162 R164 L167 F171 E188 F194 F382	M111-F169 HydrophobicContact CB-CD2 4.42Å; M111-F169 HydrophobicContact CB-CE1 4.14Å; M111-F169 HydrophobicContact CB-CE2 3.75Å; M111-F169 HydrophobicContact CB-CZ 3.58Å; M111-F169 HydrophobicContact CE-CD2 4.16Å; M111-F169 HydrophobicContact CE-CG 4.24Å; M111-F169 HydrophobicContact CG-CD2 4.39Å; M111-F169 HydrophobicContact CG-CE2 3.97Å; M111-F169 HydrophobicContact CG-CZ 4.33Å; V114-F169 HydrophobicContact CB-CD1 4.24Å; V114-F169 HydrophobicContact CG1-CD1 3.8Å; V114-F169 HydrophobicContact CG1-CE1 4.01Å; V114-F169 HydrophobicContact CG2-CB 4.42Å; V114-F169 HydrophobicContact CG2-CD1 4.16Å; V114-F169 HydrophobicContact CG2-CG 4.48Å; L162-F169 HydrophobicContact CD2-CE2 4.13Å; L162-F169 HydrophobicContact CD2-CZ 3.93Å; L162-F169 HydrophobicContact CG-CE2 4.48Å; R164-F169 HydrophobicContact CB-CD1 4.02Å; R164-F169 HydrophobicContact CB-CE1 3.61Å; R164-F169 HydrophobicContact CB-CZ 3.96Å; R164-F169 HydrophobicContact CG-CE1 3.93Å; R164-F169 HydrophobicContact CG-CZ 3.85Å; R164-F169 PolarHBondContact N-O 3.49Å; R164-F169 PolarHBondContact O-N 3.12Å; L167-F169 HydrophobicContact CB-CD1 3.82Å; L167-F169 HydrophobicContact CB-CE1 3.75Å; L167-F169 HydrophobicContact CD1-CE1 3.89Å; L167-F169 HydrophobicContact CG-CE1 4.47Å; F169-F171 HydrophobicContact CD2-CB 4.16Å; F169-F171 HydrophobicContact CE2-CB 3.99Å; F169-E188 WeakPolarHBondContact CA-O 3.38Å; F169-F194 HydrophobicContact CB-CE1 4.5Å; F169-F194 HydrophobicContact CB-CZ 3.94Å; F169-F382 HydrophobicContact CZ-CE2 4.29Å; F169-F382 HydrophobicContact CZ-CZ 4.19Å
170	R	98.5	Very high	96.5	Very high	72 Å²	72	33.6 Å²	33.6	27%	0.272	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	152.9	161.8	64.8	-177.5	-177.6	177.7	2.5	110.6	L162 I163 S187 E188 L190 F469	L162-R170 CarbonylContact O-C 3.52Å; L162-R170 WeakPolarHBondContact O-CA 3.3Å; I163-R170 HydrophobicContact CG1-CB 4.05Å; R170-S187 CarbonylContact O-C 3.32Å; R170-S187 WeakPolarHBondContact O-CA 3.19Å; R170-S187 WeakPolarHBondContact O-CB 3.42Å; R170-S187 PolarHBondContact O-OG 2.76Å; R170-E188 HydrophobicContact CG-CB 4.18Å; R170-E188 IonicContact CZ-OE2 3.33Å; R170-E188 PolarHBondContact N-O 2.84Å; R170-E188 IonicContact NE-OE2 2.67Å; R170-E188 PolarHBondContact NE-OE2 3.46Å; R170-E188 IonicContact NH2-OE2 2.68Å; R170-E188 PolarHBondContact NH2-OE2 2.84Å; R170-E188 PolarHBondContact O-N 3.02Å; R170-L190 HydrophobicContact CB-CD2 4.12Å; R170-L190 HydrophobicContact CG-CD2 4.19Å; R170-F469 HydrophobicContact CB-CE1 4.29Å; R170-F469 HydrophobicContact CB-CZ 3.99Å; R170-F469 HydrophobicContact CG-CE1 4.5Å; R170-F469 HydrophobicContact CG-CE2 4Å; R170-F469 HydrophobicContact CG-CZ 3.91Å
171	F	98.8	Very high	96.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	140.4	-173.9	-177.5	-79.3	0	0	0	110	I107 T108 M111 E161 L162 F169 F185 H186	I107-F171 HydrophobicContact CG2-CZ 4.28Å; T108-F171 HydrophobicContact CG2-CD1 3.94Å; T108-F171 HydrophobicContact CG2-CD2 4.28Å; T108-F171 HydrophobicContact CG2-CE1 4.14Å; T108-F171 HydrophobicContact CG2-CE2 4.48Å; T108-F171 HydrophobicContact CG2-CG 4.03Å; T108-F171 HydrophobicContact CG2-CZ 4.4Å; T108-F171 WeakPolarHBondContact OG1-CE1 3.43Å; T108-F171 WeakPolarHBondContact OG1-CZ 3.35Å; M111-F171 HydrophobicContact CG-CD2 3.86Å; M111-F171 HydrophobicContact CG-CE2 4.26Å; E161-F171 CarbonylContact C-O 3.55Å; E161-F171 VanDerWaalsContact CA-O 3.29Å; E161-F171 WeakPolarHBondContact CA-O 3.45Å; L162-F171 HydrophobicContact CB-CB 4.31Å; L162-F171 PolarHBondContact N-O 2.92Å; L162-F171 PolarHBondContact O-N 3.06Å; F169-F171 HydrophobicContact CD2-CB 4.16Å; F169-F171 HydrophobicContact CE2-CB 3.99Å; F171-F185 HydrophobicContact CE1-CB 4.17Å; F171-F185 HydrophobicContact CE2-CB 3.95Å; F171-F185 AromaticContact CE2-CD2 3.75Å; F171-F185 HydrophobicContact CE2-CD2 3.75Å; F171-F185 HydrophobicContact CE2-CG 4.11Å; F171-F185 HydrophobicContact CZ-CB 3.44Å; F171-F185 VanDerWaalsContact CZ-CB 3.44Å; F171-F185 HydrophobicContact CZ-CD2 4.1Å; F171-F185 AromaticContact CZ-CG 3.98Å; F171-F185 HydrophobicContact CZ-CG 3.98Å; F171-H186 WeakPolarHBondContact CA-O 3.39Å
172	I	98.8	Very high	96.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142.5	170	179.8	55.4	0	0	0	109.3	Y160 E161 F185 H186 F449 Y464 Y468 F469	Y160-I172 CarbonylContact O-C 3.56Å; Y160-I172 WeakPolarHBondContact O-CA 3.45Å; Y160-I172 WeakPolarHBondContact O-CD1 3.27Å; E161-I172 HydrophobicContact CB-CD1 4.32Å; I172-F185 CarbonylContact O-C 3.47Å; I172-F185 VanDerWaalsContact O-CA 3.3Å; I172-F185 WeakPolarHBondContact O-CA 3.37Å; I172-H186 HydrophobicContact CG2-CB 4.11Å; I172-H186 PolarHBondContact N-O 2.87Å; I172-H186 PolarHBondContact O-N 2.74Å; I172-F449 HydrophobicContact CG2-CZ 4.4Å; I172-Y464 HydrophobicContact CG2-CD2 4.13Å; I172-Y464 HydrophobicContact CG2-CE2 3.84Å; I172-Y468 HydrophobicContact CB-CD1 4.23Å; I172-Y468 HydrophobicContact CB-CE1 4.5Å; I172-Y468 HydrophobicContact CB-CG 4.49Å; I172-Y468 HydrophobicContact CD1-CD1 3.89Å; I172-Y468 HydrophobicContact CD1-CD2 3.66Å; I172-Y468 HydrophobicContact CD1-CE1 3.57Å; I172-Y468 HydrophobicContact CD1-CE2 3.32Å; I172-Y468 HydrophobicContact CD1-CG 3.94Å; I172-Y468 HydrophobicContact CG1-CD1 3.91Å; I172-Y468 HydrophobicContact CG1-CD2 3.85Å; I172-Y468 HydrophobicContact CG1-CE1 4.12Å; I172-Y468 HydrophobicContact CG1-CE2 4.07Å; I172-Y468 HydrophobicContact CG1-CG 3.79Å; I172-F469 HydrophobicContact CB-CE2 4.49Å; I172-F469 HydrophobicContact CB-CZ 4.18Å; I172-F469 HydrophobicContact CG2-CE2 4.2Å; I172-F469 HydrophobicContact CG2-CZ 4.35Å
173	S	98.9	Very high	96.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.3	169.4	55.5	0	0	0	0	111.5	L104 T159 Y160 A184	L104-S173 WeakPolarHBondContact CB-OG 3.34Å; T159-S173 CarbonylContact C-O 3.58Å; T159-S173 WeakPolarHBondContact CA-O 3.4Å; Y160-S173 PolarHBondContact N-O 3.42Å; Y160-S173 PolarHBondContact O-N 3.03Å; Y160-S173 PolarHBondContact O-OG 2.84Å; S173-A184 CarbonylContact C-O 3.58Å; S173-A184 WeakPolarHBondContact CA-O 3.37Å; S173-A184 WeakPolarHBondContact CB-O 3.44Å
174	E	98.8	Very high	96.3	Very high	3 Å²	3	32 Å²	32	1%	0.014	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	141	178	-175.4	-179.8	174.7	0	0	109.6	E158 T159 V176 S183 A184 R447 W448 F449	E158-E174 CarbonylContact O-C 3.58Å; E158-E174 WeakPolarHBondContact O-CA 3.39Å; T159-E174 HydrophobicContact CG2-CB 4.34Å; T159-E174 HydrophobicContact CG2-CG 4.19Å; E174-V176 HydrophobicContact CB-CG1 4.17Å; E174-V176 HydrophobicContact CG-CG1 4.22Å; E174-V176 PolarHBondContact O-N 3.43Å; E174-V176 VanDerWaalsContact O-N 3.13Å; E174-S183 WeakPolarHBondContact O-CA 3.21Å; E174-A184 PolarHBondContact N-O 3.03Å; E174-A184 PolarHBondContact O-N 2.85Å; E174-R447 PolarHBondContact OE1-N 3.33Å; E174-W448 WeakPolarHBondContact OE2-CA 3.49Å; E174-W448 WeakPolarHBondContact OE2-CB 3.21Å; E174-W448 PolarHBondContact OE2-N 3.1Å; E174-F449 HydrophobicContact CB-CD2 3.64Å; E174-F449 HydrophobicContact CB-CE2 3.8Å; E174-F449 PolarHBondContact OE2-N 2.89Å
175	Q	98.7	Very high	96.4	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	92.1	165.9	-170.2	68.7	19.8	0	0	109.6	P154 L155 G157 E158 S177 I182 S183	P154-Q175 HydrophobicContact CB-CB 3.8Å; P154-Q175 HydrophobicContact CB-CG 3.86Å; P154-Q175 VanDerWaalsContact CG-OE1 3.3Å; L155-Q175 WeakPolarHBondContact O-CB 3.34Å; L155-Q175 WeakPolarHBondContact O-CG 3.38Å; G157-Q175 PolarHBondContact N-O 3.26Å; E158-Q175 HydrophobicContact CB-CB 4.39Å; E158-Q175 PolarHBondContact O-N 2.93Å; Q175-S177 PolarHBondContact NE2-O 3.47Å; Q175-I182 PolarHBondContact NE2-O 2.79Å; Q175-S183 PolarHBondContact OE1-OG 2.96Å
176	V	98.1	Very high	96.5	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.024	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	-19.9	-173.1	-66.3	0	0	0	0	113.8	E174 I182 A184 T446 F449 W462	E174-V176 HydrophobicContact CB-CG1 4.17Å; E174-V176 HydrophobicContact CG-CG1 4.22Å; E174-V176 PolarHBondContact O-N 3.43Å; E174-V176 VanDerWaalsContact O-N 3.13Å; V176-I182 HydrophobicContact CG2-CB 3.81Å; V176-I182 HydrophobicContact CG2-CG2 3.61Å; V176-I182 WeakPolarHBondContact CG2-O 3.34Å; V176-I182 PolarHBondContact N-O 3.32Å; V176-A184 HydrophobicContact CG1-CB 3.64Å; V176-A184 HydrophobicContact CG2-CB 4.04Å; V176-T446 HydrophobicContact CB-CG2 3.72Å; V176-T446 HydrophobicContact CG1-CG2 3.97Å; V176-T446 VanDerWaalsContact O-CG2 3.31Å; V176-T446 WeakPolarHBondContact O-CG2 3.25Å; V176-F449 HydrophobicContact CG1-CB 3.78Å; V176-F449 HydrophobicContact CG1-CD2 4.3Å; V176-F449 HydrophobicContact CG1-CG 4.22Å; V176-W462 HydrophobicContact CB-CD2 3.81Å; V176-W462 HydrophobicContact CB-CE3 3.77Å; V176-W462 HydrophobicContact CB-CG 4.45Å; V176-W462 HydrophobicContact CB-CH2 4.04Å; V176-W462 HydrophobicContact CB-CZ2 4.07Å; V176-W462 HydrophobicContact CB-CZ3 3.9Å; V176-W462 HydrophobicContact CG1-CD2 4.13Å; V176-W462 HydrophobicContact CG1-CE3 3.86Å; V176-W462 HydrophobicContact CG1-CZ3 4.26Å; V176-W462 HydrophobicContact CG2-CD2 3.58Å; V176-W462 HydrophobicContact CG2-CE3 4.09Å; V176-W462 HydrophobicContact CG2-CG 3.81Å; V176-W462 HydrophobicContact CG2-CH2 4.48Å; V176-W462 HydrophobicContact CG2-CZ2 4.02Å
177	S	96.3	Very high	96.7	Very high	23 Å²	23	20 Å²	20	16%	0.161	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	147.4	175.9	173.8	0	0	0	0	111	Q175 H179 P180 P181 I182	Q175-S177 PolarHBondContact NE2-O 3.47Å; S177-H179 PolarHBondContact OG-N 2.99Å; S177-P180 CarbonylContact C-O 3.52Å; S177-P180 VanDerWaalsContact CB-O 3.27Å; S177-P180 WeakPolarHBondContact CB-O 3.47Å; S177-P180 PolarHBondContact OG-O 2.65Å; S177-P181 CarbonylContact O-C 3.49Å; S177-P181 WeakPolarHBondContact O-CA 3.48Å; S177-I182 PolarHBondContact N-O 3.36Å; S177-I182 PolarHBondContact O-N 3.14Å
178	H	89.3	Confident	96.8	Very high	36 Å²	36	18.9 Å²	18.9	17%	0.167	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-27	174.4	-158.2	69.4	0	0	0	112.8	N153 L156 P180 P181 Q430	N153-H178 PolarHBondContact ND2-CE1 3.31Å; N153-H178 VanDerWaalsContact ND2-CE1 3.29Å; L156-H178 HydrophobicContact CB-CB 4.3Å; L156-H178 HydrophobicContact CD1-CB 4.45Å; H178-P180 CarbonylContact C-O 3.57Å; H178-P180 CarbonylContact O-C 3.47Å; H178-P180 VanDerWaalsContact O-C 3.32Å; H178-P181 WeakPolarHBondContact O-CD 3.46Å; H178-P181 VanDerWaalsContact O-N 3.16Å; H178-Q430 PolarHBondContact CE1-NE2 3.1Å; H178-Q430 VanDerWaalsContact CE1-NE2 3.35Å; H178-Q430 PolarHBondContact NE2-NE2 2.93Å; H178-Q430 VanDerWaalsContact NE2-NE2 3.15Å
179	H	85.6	Confident	96.8	Very high	89 Å²	89	18.4 Å²	18.4	41%	0.412	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.9	95.5	177.9	-60.1	-75	0	0	0	110.8	D9 S177 R434	D9-H179 IonicContact OD1-CE1 3.5Å; D9-H179 IonicContact OD2-CE1 3.91Å; D9-H179 PolarHBondContact OD2-CE1 3.26Å; D9-H179 IonicContact OD2-NE2 2.77Å; D9-H179 PolarHBondContact OD2-NE2 2.94Å; S177-H179 PolarHBondContact OG-N 2.99Å; H179-R434 PolarHBondContact CD2-NH1 3.49Å; H179-R434 PolarHBondContact NE2-NH1 2.92Å
180	P	90.8	Very high	96.8	Very high	56 Å²	56	21.5 Å²	21.5	36%	0.364	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	cis	-70.1	160.9	-5.2	30.6	-35	0	0	0	112.7	S177 H178 I182 Y201	S177-P180 CarbonylContact C-O 3.52Å; S177-P180 VanDerWaalsContact CB-O 3.27Å; S177-P180 WeakPolarHBondContact CB-O 3.47Å; S177-P180 PolarHBondContact OG-O 2.65Å; H178-P180 CarbonylContact C-O 3.57Å; H178-P180 CarbonylContact O-C 3.47Å; H178-P180 VanDerWaalsContact O-C 3.32Å; P180-I182 HydrophobicContact CG-CD1 4.15Å; P180-I182 HydrophobicContact CG-CG1 4.19Å; P180-I182 PolarHBondContact O-N 3.2Å; P180-I182 VanDerWaalsContact O-N 3.16Å; P180-Y201 HydrophobicContact CB-CD1 4.38Å; P180-Y201 HydrophobicContact CB-CD2 3.95Å; P180-Y201 HydrophobicContact CB-CE1 4.07Å; P180-Y201 HydrophobicContact CB-CE2 3.64Å; P180-Y201 HydrophobicContact CB-CG 4.33Å
181	P	93.1	Very high	96.7	Very high	28 Å²	28	24.3 Å²	24.3	18%	0.182	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	106.6	178.1	28.6	-34.5	0	0	0	110.4	S177 H178 Y201	S177-P181 CarbonylContact O-C 3.49Å; S177-P181 WeakPolarHBondContact O-CA 3.48Å; H178-P181 WeakPolarHBondContact O-CD 3.46Å; H178-P181 VanDerWaalsContact O-N 3.16Å; P181-Y201 HydrophobicContact CG-CD2 4.17Å; P181-Y201 HydrophobicContact CG-CE2 4.12Å; P181-Y201 WeakPolarHBondContact O-CD2 3.32Å
182	I	98	Very high	96.5	Very high	30 Å²	30	30.9 Å²	30.9	15%	0.154	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.7	178.7	-52.5	174.6	0	0	0	108.7	Q175 V176 S177 P180 I200	Q175-I182 PolarHBondContact NE2-O 2.79Å; V176-I182 HydrophobicContact CG2-CB 3.81Å; V176-I182 HydrophobicContact CG2-CG2 3.61Å; V176-I182 WeakPolarHBondContact CG2-O 3.34Å; V176-I182 PolarHBondContact N-O 3.32Å; S177-I182 PolarHBondContact N-O 3.36Å; S177-I182 PolarHBondContact O-N 3.14Å; P180-I182 HydrophobicContact CG-CD1 4.15Å; P180-I182 HydrophobicContact CG-CG1 4.19Å; P180-I182 PolarHBondContact O-N 3.2Å; P180-I182 VanDerWaalsContact O-N 3.16Å; I182-I200 WeakPolarHBondContact CA-O 3.36Å
183	S	98.6	Very high	96.4	Very high	1 Å²	1	32 Å²	32	1%	0.007	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119.4	171.1	-49.4	0	0	0	0	109	F103 I107 E174 Q175 S199 I200	F103-S183 WeakPolarHBondContact CD1-OG 3.38Å; I107-S183 VanDerWaalsContact CD1-CB 3.45Å; E174-S183 WeakPolarHBondContact O-CA 3.21Å; Q175-S183 PolarHBondContact OE1-OG 2.96Å; S183-S199 CarbonylContact O-C 3.6Å; S183-S199 WeakPolarHBondContact O-CA 3.33Å; S183-I200 PolarHBondContact N-O 2.83Å; S183-I200 PolarHBondContact O-N 3.32Å
184	A	98.8	Very high	96.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	148	173.9	0	0	0	0	0	109.9	S173 E174 V176 F449 W462	S173-A184 CarbonylContact C-O 3.58Å; S173-A184 WeakPolarHBondContact CA-O 3.37Å; S173-A184 WeakPolarHBondContact CB-O 3.44Å; E174-A184 PolarHBondContact N-O 3.03Å; E174-A184 PolarHBondContact O-N 2.85Å; V176-A184 HydrophobicContact CG1-CB 3.64Å; V176-A184 HydrophobicContact CG2-CB 4.04Å; A184-F449 HydrophobicContact CB-CB 4.24Å; A184-F449 HydrophobicContact CB-CD1 3.54Å; A184-F449 HydrophobicContact CB-CD2 4.09Å; A184-F449 HydrophobicContact CB-CE1 3.85Å; A184-F449 HydrophobicContact CB-CE2 4.37Å; A184-F449 HydrophobicContact CB-CG 3.69Å; A184-F449 HydrophobicContact CB-CZ 4.26Å; A184-W462 HydrophobicContact CB-CB 3.61Å; A184-W462 HydrophobicContact CB-CG 4.26Å
185	F	98.9	Very high	96.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	153.7	176.7	71.1	-90.2	0	0	0	112.3	I107 Y110 F171 I172 F196 H197 G198 I200 I219	I107-F185 HydrophobicContact CG2-CB 4.31Å; I107-F185 HydrophobicContact CG2-CD1 3.51Å; I107-F185 HydrophobicContact CG2-CE1 3.94Å; I107-F185 HydrophobicContact CG2-CG 3.89Å; Y110-F185 HydrophobicContact CD2-CZ 4.32Å; Y110-F185 HydrophobicContact CE2-CE1 4.48Å; F171-F185 HydrophobicContact CE1-CB 4.17Å; F171-F185 HydrophobicContact CE2-CB 3.95Å; F171-F185 AromaticContact CE2-CD2 3.75Å; F171-F185 HydrophobicContact CE2-CD2 3.75Å; F171-F185 HydrophobicContact CE2-CG 4.11Å; F171-F185 HydrophobicContact CZ-CB 3.44Å; F171-F185 VanDerWaalsContact CZ-CB 3.44Å; F171-F185 HydrophobicContact CZ-CD2 4.1Å; F171-F185 AromaticContact CZ-CG 3.98Å; F171-F185 HydrophobicContact CZ-CG 3.98Å; I172-F185 CarbonylContact O-C 3.47Å; I172-F185 VanDerWaalsContact O-CA 3.3Å; I172-F185 WeakPolarHBondContact O-CA 3.37Å; F185-F196 HydrophobicContact CD2-CD1 4.35Å; F185-F196 HydrophobicContact CD2-CE1 4.26Å; F185-F196 AromaticContact CE2-CD1 3.65Å; F185-F196 HydrophobicContact CE2-CD1 3.65Å; F185-F196 AromaticContact CE2-CE1 3.36Å; F185-F196 HydrophobicContact CE2-CE1 3.36Å; F185-F196 HydrophobicContact CE2-CG 4.38Å; F185-F196 AromaticContact CE2-CZ 3.87Å; F185-F196 HydrophobicContact CE2-CZ 3.87Å; F185-F196 AromaticContact CZ-CE1 3.95Å; F185-F196 HydrophobicContact CZ-CE1 3.95Å; F185-F196 HydrophobicContact CZ-CZ 4.02Å; F185-H197 WeakPolarHBondContact O-CA 3.44Å; F185-H197 WeakPolarHBondContact O-CB 3.31Å; F185-G198 WeakPolarHBondContact CD1-O 3.38Å; F185-G198 PolarHBondContact N-O 2.87Å; F185-G198 PolarHBondContact O-N 2.97Å; F185-G198 VanDerWaalsContact O-N 3.15Å; F185-I200 HydrophobicContact CE1-CG1 4.2Å; F185-I219 HydrophobicContact CE1-CD1 4.03Å; F185-I219 HydrophobicContact CZ-CD1 3.87Å
186	H	98.9	Very high	96.5	Very high	15 Å²	15	33.8 Å²	33.8	7%	0.069	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	136.5	177.3	-179.6	84.1	0	0	0	110.3	F171 I172 E188 F196 H197 F449 Y464	F171-H186 WeakPolarHBondContact CA-O 3.39Å; I172-H186 HydrophobicContact CG2-CB 4.11Å; I172-H186 PolarHBondContact N-O 2.87Å; I172-H186 PolarHBondContact O-N 2.74Å; H186-E188 IonicContact CD2-OE1 3.65Å; H186-E188 IonicContact CE1-OE1 3.82Å; H186-E188 WeakPolarHBondContact NE2-CG 3.05Å; H186-E188 IonicContact NE2-OE1 2.76Å; H186-E188 PolarHBondContact NE2-OE1 3Å; H186-F196 CarbonylContact C-O 3.37Å; H186-H197 HydrophobicContact CB-CB 4.42Å; H186-F449 HydrophobicContact CB-CE1 3.93Å; H186-F449 HydrophobicContact CB-CZ 4.01Å; H186-Y464 HydrophobicContact CB-CD1 4.45Å; H186-Y464 HydrophobicContact CB-CD2 4.35Å; H186-Y464 HydrophobicContact CB-CG 3.95Å; H186-Y464 AromaticContact CD2-CD1 3.34Å; H186-Y464 WeakPolarHBondContact CD2-CD1 3.21Å; H186-Y464 AromaticContact CD2-CE1 3.8Å; H186-Y464 AromaticContact CD2-CG 3.73Å; H186-Y464 AromaticContact CE1-CD1 3.94Å; H186-Y464 AromaticContact CG-CD1 3.77Å; H186-Y464 AromaticContact CG-CG 3.72Å; H186-Y464 AromaticContact NE2-CD1 3.44Å; H186-Y464 WeakPolarHBondContact NE2-CD1 3.42Å; H186-Y464 AromaticContact NE2-CE1 3.98Å
187	S	98.8	Very high	96.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	143.2	-180	-169.9	0	0	0	0	111.1	M111 R170 L195 F196	M111-S187 WeakPolarHBondContact CE-OG 3.24Å; R170-S187 CarbonylContact O-C 3.32Å; R170-S187 WeakPolarHBondContact O-CA 3.19Å; R170-S187 WeakPolarHBondContact O-CB 3.42Å; R170-S187 PolarHBondContact O-OG 2.76Å; S187-L195 CarbonylContact O-C 3.58Å; S187-L195 WeakPolarHBondContact O-CA 3.35Å; S187-F196 WeakPolarHBondContact CA-O 3.41Å; S187-F196 WeakPolarHBondContact CB-O 3.44Å; S187-F196 PolarHBondContact N-O 2.98Å; S187-F196 PolarHBondContact O-N 3.1Å
188	E	98.3	Very high	96.6	Very high	27 Å²	27	33.1 Å²	33.1	13%	0.126	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.5	-176.1	-48.3	-179.7	168.6	0	0	109	F169 R170 H186 L195	F169-E188 WeakPolarHBondContact CA-O 3.38Å; R170-E188 HydrophobicContact CG-CB 4.18Å; R170-E188 IonicContact CZ-OE2 3.33Å; R170-E188 PolarHBondContact N-O 2.84Å; R170-E188 IonicContact NE-OE2 2.67Å; R170-E188 PolarHBondContact NE-OE2 3.46Å; R170-E188 IonicContact NH2-OE2 2.68Å; R170-E188 PolarHBondContact NH2-OE2 2.84Å; R170-E188 PolarHBondContact O-N 3.02Å; H186-E188 IonicContact CD2-OE1 3.65Å; H186-E188 IonicContact CE1-OE1 3.82Å; H186-E188 WeakPolarHBondContact NE2-CG 3.05Å; H186-E188 IonicContact NE2-OE1 2.76Å; H186-E188 PolarHBondContact NE2-OE1 3Å; E188-L195 HydrophobicContact CB-CD2 4.18Å; E188-L195 HydrophobicContact CG-CD2 3.81Å
189	G	98.4	Very high	97	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	133.1	166.7	0	0	0	0	0	110.3	G168 N191 H192 D193 F194	G168-G189 CarbonylContact O-C 3.59Å; G168-G189 WeakPolarHBondContact O-CA 3.29Å; G189-N191 PolarHBondContact O-N 2.82Å; G189-N191 VanDerWaalsContact O-N 3.14Å; G189-H192 WeakPolarHBondContact O-CA 3.48Å; G189-H192 PolarHBondContact O-N 2.95Å; G189-D193 WeakPolarHBondContact CA-OD1 3.48Å; G189-F194 PolarHBondContact N-O 3.34Å; G189-F194 VanDerWaalsContact N-O 3.09Å
190	L	98	Very high	97.6	Very high	65 Å²	65	27.7 Å²	27.7	34%	0.34	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.5	179.8	-64.4	178.2	0	0	0	112.6	E165 G168 R170	E165-L190 HydrophobicContact CB-CD1 4.45Å; E165-L190 HydrophobicContact CG-CD1 4.25Å; G168-L190 PolarHBondContact O-N 2.95Å; R170-L190 HydrophobicContact CB-CD2 4.12Å; R170-L190 HydrophobicContact CG-CD2 4.19Å
191	N	96.3	Very high	97.8	Very high	132 Å²	132	28.2 Å²	28.2	71%	0.706	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	12.2	173.8	-65.5	-39.6	0	0	0	113.1	G189 D193	G189-N191 PolarHBondContact O-N 2.82Å; G189-N191 VanDerWaalsContact O-N 3.14Å; N191-D193 PolarHBondContact O-N 2.88Å
192	H	96.1	Very high	97.8	Very high	138 Å²	138	28.4 Å²	28.4	64%	0.639	14%	0.143	S	C	*	.	S	Bend	trans	53.9	38	-177.1	-53.9	-71	0	0	0	113.3	G189 L224	G189-H192 WeakPolarHBondContact O-CA 3.48Å; G189-H192 PolarHBondContact O-N 2.95Å; H192-L224 WeakPolarHBondContact O-CD1 3.26Å
193	D	96.8	Very high	97.3	Very high	24 Å²	24	30.2 Å²	30.2	13%	0.128	15%	0.149	C	C	.	.			trans	-94.7	-22.8	-178.8	65	-44.8	0	0	0	113.3	H118 G189 N191 L224	H118-D193 IonicContact CE1-OD1 3.85Å; H118-D193 IonicContact CE1-OD2 2.88Å; H118-D193 IonicContact CG-OD2 3.7Å; H118-D193 IonicContact ND1-OD1 3.39Å; H118-D193 IonicContact ND1-OD2 2.91Å; H118-D193 PolarHBondContact ND1-OD2 3.01Å; G189-D193 WeakPolarHBondContact CA-OD1 3.48Å; N191-D193 PolarHBondContact O-N 2.88Å; D193-L224 PolarHBondContact O-N 2.78Å
194	F	98.8	Very high	96.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	159.2	176.4	77.4	-91.3	0	0	0	114	M111 V114 I117 H118 F169 G189 F196 L221 E222 L223	M111-F194 HydrophobicContact CE-CE2 3.89Å; M111-F194 HydrophobicContact CE-CZ 3.82Å; V114-F194 HydrophobicContact CG2-CE1 3.86Å; V114-F194 HydrophobicContact CG2-CZ 3.68Å; I117-F194 HydrophobicContact CB-CD1 4.44Å; I117-F194 HydrophobicContact CD1-CD2 4.25Å; I117-F194 HydrophobicContact CD1-CE2 4.14Å; I117-F194 HydrophobicContact CD1-CZ 4.46Å; I117-F194 HydrophobicContact CG2-CB 3.54Å; I117-F194 HydrophobicContact CG2-CD1 3.53Å; I117-F194 HydrophobicContact CG2-CD2 3.95Å; I117-F194 HydrophobicContact CG2-CE1 4.19Å; I117-F194 HydrophobicContact CG2-CG 3.39Å; H118-F194 AromaticContact CE1-CE1 3.56Å; F169-F194 HydrophobicContact CB-CE1 4.5Å; F169-F194 HydrophobicContact CB-CZ 3.94Å; G189-F194 PolarHBondContact N-O 3.34Å; G189-F194 VanDerWaalsContact N-O 3.09Å; F194-F196 HydrophobicContact CD2-CB 3.96Å; F194-F196 HydrophobicContact CE2-CB 3.86Å; F194-L221 HydrophobicContact CB-CD1 4.24Å; F194-L221 HydrophobicContact CD2-CD1 4.08Å; F194-L221 HydrophobicContact CG-CD1 4.48Å; F194-E222 CarbonylContact C-O 3.53Å; F194-E222 WeakPolarHBondContact CA-O 3.32Å; F194-E222 WeakPolarHBondContact CB-O 3.3Å; F194-L223 HydrophobicContact CB-CD2 4.23Å
195	L	98.8	Very high	95.7	Very high	39 Å²	39	37.1 Å²	37.1	20%	0.204	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.1	160	-57.1	173.5	0	0	0	109	S187 E188 L221 E222 L224	S187-L195 CarbonylContact O-C 3.58Å; S187-L195 WeakPolarHBondContact O-CA 3.35Å; E188-L195 HydrophobicContact CB-CD2 4.18Å; E188-L195 HydrophobicContact CG-CD2 3.81Å; L195-L221 CarbonylContact O-C 3.46Å; L195-L221 WeakPolarHBondContact O-CA 3.46Å; L195-E222 HydrophobicContact CB-CB 4.18Å; L195-E222 PolarHBondContact N-O 2.92Å; L195-E222 PolarHBondContact O-N 3.16Å; L195-L224 HydrophobicContact CD1-CD2 4.07Å; L195-L224 HydrophobicContact CG-CD1 4.15Å; L195-L224 HydrophobicContact CG-CD2 4.09Å; L195-L224 HydrophobicContact CG-CG 4.42Å
196	F	98.9	Very high	94.7	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	116.3	178.1	175.4	-110.3	0	0	0	109.8	Y110 M111 F136 F185 H186 S187 F194 I219 T220 L221 W232	Y110-F196 HydrophobicContact CD2-CE1 4.28Å; Y110-F196 HydrophobicContact CD2-CZ 4.13Å; M111-F196 HydrophobicContact CE-CD1 4.29Å; M111-F196 HydrophobicContact SD-CD1 3.26Å; M111-F196 WeakPolarHBondContact SD-CD1 3.47Å; M111-F196 HydrophobicContact SD-CE1 3.57Å; M111-F196 VanDerWaalsContact SD-CE1 3.57Å; M111-F196 HydrophobicContact SD-CG 4.2Å; F136-F196 HydrophobicContact CE1-CD2 4Å; F136-F196 AromaticContact CE1-CE2 3.58Å; F136-F196 HydrophobicContact CE1-CE2 3.58Å; F136-F196 AromaticContact CE1-CZ 3.86Å; F136-F196 HydrophobicContact CE1-CZ 3.86Å; F136-F196 HydrophobicContact CZ-CD2 4.44Å; F136-F196 HydrophobicContact CZ-CE1 4.24Å; F136-F196 HydrophobicContact CZ-CE2 4.11Å; F136-F196 AromaticContact CZ-CZ 4Å; F136-F196 HydrophobicContact CZ-CZ 4Å; F185-F196 HydrophobicContact CD2-CD1 4.35Å; F185-F196 HydrophobicContact CD2-CE1 4.26Å; F185-F196 AromaticContact CE2-CD1 3.65Å; F185-F196 HydrophobicContact CE2-CD1 3.65Å; F185-F196 AromaticContact CE2-CE1 3.36Å; F185-F196 HydrophobicContact CE2-CE1 3.36Å; F185-F196 HydrophobicContact CE2-CG 4.38Å; F185-F196 AromaticContact CE2-CZ 3.87Å; F185-F196 HydrophobicContact CE2-CZ 3.87Å; F185-F196 AromaticContact CZ-CE1 3.95Å; F185-F196 HydrophobicContact CZ-CE1 3.95Å; F185-F196 HydrophobicContact CZ-CZ 4.02Å; H186-F196 CarbonylContact C-O 3.37Å; S187-F196 WeakPolarHBondContact CA-O 3.41Å; S187-F196 WeakPolarHBondContact CB-O 3.44Å; S187-F196 PolarHBondContact N-O 2.98Å; S187-F196 PolarHBondContact O-N 3.1Å; F194-F196 HydrophobicContact CD2-CB 3.96Å; F194-F196 HydrophobicContact CE2-CB 3.86Å; F196-I219 HydrophobicContact CD2-CG2 4.2Å; F196-I219 HydrophobicContact CE2-CG2 3.24Å; F196-I219 HydrophobicContact CZ-CG2 3.72Å; F196-T220 WeakPolarHBondContact CA-O 3.18Å; F196-L221 HydrophobicContact CB-CD1 4.08Å; F196-L221 HydrophobicContact CD2-CB 4.22Å; F196-L221 HydrophobicContact CD2-CD1 4.26Å; F196-W232 HydrophobicContact CD2-CH2 4.38Å; F196-W232 AromaticContact CE2-CH2 3.8Å; F196-W232 HydrophobicContact CE2-CH2 3.8Å; F196-W232 AromaticContact CE2-CZ2 3.92Å; F196-W232 HydrophobicContact CE2-CZ2 3.92Å
197	H	98.9	Very high	93.8	Very high	14 Å²	14	48.2 Å²	48.2	7%	0.065	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	167.4	-172	62.2	88.2	0	0	0	112.3	F185 H186 T220 E222	F185-H197 WeakPolarHBondContact O-CA 3.44Å; F185-H197 WeakPolarHBondContact O-CB 3.31Å; H186-H197 HydrophobicContact CB-CB 4.42Å; H197-T220 VanDerWaalsContact CE1-CB 3.42Å; H197-T220 WeakPolarHBondContact CE1-CB 3.29Å; H197-T220 PolarHBondContact N-O 3.02Å; H197-T220 PolarHBondContact O-N 3.15Å; H197-E222 IonicContact CD2-OE1 3Å; H197-E222 IonicContact CE1-OE1 3.96Å; H197-E222 IonicContact NE2-OE1 3.18Å; H197-E222 PolarHBondContact NE2-OE1 2.65Å
198	G	98.6	Very high	92.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.1	-176	173.7	0	0	0	0	0	111.3	F185 T218	F185-G198 WeakPolarHBondContact CD1-O 3.38Å; F185-G198 PolarHBondContact N-O 2.87Å; F185-G198 PolarHBondContact O-N 2.97Å; F185-G198 VanDerWaalsContact O-N 3.15Å; G198-T218 WeakPolarHBondContact CA-O 3.31Å
199	S	98.1	Very high	91.9	Very high	10 Å²	10	54.6 Å²	54.6	7%	0.07	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	143.5	175.1	54.4	0	0	0	0	110.3	S183 G217 D461	S183-S199 CarbonylContact O-C 3.6Å; S183-S199 WeakPolarHBondContact O-CA 3.33Å; S199-G217 VanDerWaalsContact O-CA 3.32Å; S199-G217 WeakPolarHBondContact O-CA 3.42Å; S199-D461 PolarHBondContact OG-OD1 3.3Å
200	I	97.9	Very high	91.2	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.9	-177.8	-58.7	-65.2	0	0	0	110.1	F103 I107 I182 S183 F185 P215 R216 I219	F103-I200 HydrophobicContact CE1-CB 4.46Å; F103-I200 HydrophobicContact CE1-CG2 4.02Å; F103-I200 HydrophobicContact CZ-CG2 3.8Å; I107-I200 HydrophobicContact CD1-CB 4.14Å; I107-I200 HydrophobicContact CD1-CG1 4.28Å; I182-I200 WeakPolarHBondContact CA-O 3.36Å; S183-I200 PolarHBondContact N-O 2.83Å; S183-I200 PolarHBondContact O-N 3.32Å; F185-I200 HydrophobicContact CE1-CG1 4.2Å; I200-P215 HydrophobicContact CG2-CB 4.21Å; I200-R216 CarbonylContact C-O 3.59Å; I200-R216 WeakPolarHBondContact CA-O 3.41Å; I200-I219 HydrophobicContact CD1-CD1 3.64Å
201	Y	95.6	Very high	90.6	Very high	66 Å²	66	53.5 Å²	53.5	26%	0.259	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	103.6	164.6	168.2	-144.9	0	0	0	109.5	P180 P181 K203 R216	P180-Y201 HydrophobicContact CB-CD1 4.38Å; P180-Y201 HydrophobicContact CB-CD2 3.95Å; P180-Y201 HydrophobicContact CB-CE1 4.07Å; P180-Y201 HydrophobicContact CB-CE2 3.64Å; P180-Y201 HydrophobicContact CB-CG 4.33Å; P181-Y201 HydrophobicContact CG-CD2 4.17Å; P181-Y201 HydrophobicContact CG-CE2 4.12Å; P181-Y201 WeakPolarHBondContact O-CD2 3.32Å; Y201-K203 HydrophobicContact CE1-CB 4.12Å; Y201-K203 HydrophobicContact CE2-CB 4.43Å; Y201-K203 PolarHBondContact O-N 3.31Å; Y201-K203 VanDerWaalsContact O-N 3.08Å; Y201-R216 HydrophobicContact CD1-CB 4.27Å; Y201-R216 PolarHBondContact N-O 3.45Å; Y201-R216 WeakPolarHBondContact O-CB 3.49Å; Y201-R216 PolarHBondContact O-N 2.92Å
202	P	91.6	Very high	90.2	Very high	32 Å²	32	49 Å²	49	21%	0.208	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	94.3	178.3	31.3	-32.8	0	0	0	110.5	F103 L204	F103-P202 HydrophobicContact CE1-CG 3.89Å; F103-P202 HydrophobicContact CZ-CB 4.26Å; F103-P202 HydrophobicContact CZ-CG 3.96Å; P202-L204 PolarHBondContact O-N 2.92Å
203	K	87.6	Confident	89.9	Confident	68 Å²	68	43.7 Å²	43.7	30%	0.296	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	117.1	177.4	-174.7	173.3	-175.2	170.4	0	110.3	Y201 E214	Y201-K203 HydrophobicContact CE1-CB 4.12Å; Y201-K203 HydrophobicContact CE2-CB 4.43Å; Y201-K203 PolarHBondContact O-N 3.31Å; Y201-K203 VanDerWaalsContact O-N 3.08Å; K203-E214 HydrophobicContact CB-CB 4.4Å; K203-E214 PolarHBondContact N-O 3.04Å; K203-E214 PolarHBondContact O-N 3.33Å
204	L	83.6	Confident	89.8	Confident	73 Å²	73	45 Å²	45	38%	0.382	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	139.5	-178.4	-57.7	-179.4	0	0	0	112.2	P202 V211 E212 A213	P202-L204 PolarHBondContact O-N 2.92Å; L204-V211 HydrophobicContact CD2-CG1 4.39Å; L204-E212 CarbonylContact C-O 3.6Å; L204-E212 VanDerWaalsContact CA-O 3.27Å; L204-E212 WeakPolarHBondContact CA-O 3.48Å; L204-A213 HydrophobicContact CD2-CB 3.67Å
205	K	81.4	Confident	89.6	Confident	73 Å²	73	46 Å²	46	32%	0.317	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	134.7	171.3	-64.5	176.1	-168.3	150.6	0	110.3	W207 V211 E212 E214	K205-W207 HydrophobicContact CD-CZ2 4.48Å; K205-V211 CarbonylContact O-C 3.57Å; K205-V211 WeakPolarHBondContact O-CA 3.42Å; K205-E212 HydrophobicContact CB-CB 4.42Å; K205-E212 PolarHBondContact N-O 2.87Å; K205-E212 PolarHBondContact O-N 3.25Å; K205-E214 IonicContact NZ-OE2 3.9Å; K205-E214 PolarHBondContact NZ-OE2 3.07Å
206	F	77.9	Confident	89.4	Confident	87 Å²	87	48.8 Å²	48.8	38%	0.382	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.7	176.6	-175.8	-117.7	0	0	0	110.9	L80 L88 G208 V211 V242 I243	L80-F206 HydrophobicContact CD1-CE2 3.93Å; L80-F206 HydrophobicContact CD1-CZ 4.26Å; L80-F206 HydrophobicContact CD2-CE2 4.03Å; L80-F206 HydrophobicContact CD2-CZ 4.43Å; L88-F206 HydrophobicContact CD1-CB 3.73Å; L88-F206 HydrophobicContact CD1-CD2 4.34Å; L88-F206 HydrophobicContact CD1-CG 4.37Å; L88-F206 HydrophobicContact CG-CB 4.34Å; F206-G208 WeakPolarHBondContact CE2-O 3.47Å; F206-G208 WeakPolarHBondContact CZ-O 3.47Å; F206-V211 HydrophobicContact CD2-CG2 3.85Å; F206-V242 HydrophobicContact CD2-CG2 4.43Å; F206-V242 HydrophobicContact CE2-CG2 3.78Å; F206-I243 HydrophobicContact CZ-CD1 4.16Å; F206-I243 HydrophobicContact CZ-CG1 4.47Å
207	W	78.8	Confident	89.2	Confident	161 Å²	161	50 Å²	50	61%	0.61	25%	0.245	S	C	*	.			trans	-117.1	33.8	-179	-65.6	102.9	0	0	0	112.2	K205 K209 S210 E212	K205-W207 HydrophobicContact CD-CZ2 4.48Å; W207-K209 VanDerWaalsContact C-N 3.35Å; W207-K209 PolarHBondContact O-N 2.9Å; W207-S210 PolarHBondContact N-O 3.03Å; W207-E212 PolarHBondContact NE1-OE1 3.13Å; W207-E212 PolarHBondContact NE1-OE2 3.01Å
208	G	78.1	Confident	89.2	Confident	30 Å²	30	50.3 Å²	50.3	31%	0.309	25%	0.248	S	C	.	.	S	Bend	trans	77.5	-78.6	-175.8	0	0	0	0	0	111.5	F206 I243	F206-G208 WeakPolarHBondContact CE2-O 3.47Å; F206-G208 WeakPolarHBondContact CZ-O 3.47Å; G208-I243 WeakPolarHBondContact O-CD1 3.19Å; G208-I243 WeakPolarHBondContact O-CG1 3.25Å
209	K	79.9	Confident	89.2	Confident	131 Å²	131	50.3 Å²	50.3	57%	0.57	25%	0.248	S	C	*	.	S	Bend	trans	-88.1	-9.5	-177.5	-67.8	-170.3	176.7	-169	0	114.6	W207 N241 V242	W207-K209 VanDerWaalsContact C-N 3.35Å; W207-K209 PolarHBondContact O-N 2.9Å; K209-N241 WeakPolarHBondContact O-CA 3.5Å; K209-N241 PolarHBondContact O-N 3.1Å; K209-V242 WeakPolarHBondContact O-CG2 3.23Å; K209-V242 PolarHBondContact O-N 3.32Å
210	S	84.1	Confident	89.3	Confident	18 Å²	18	49.8 Å²	49.8	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.5	-174.5	-50.1	0	0	0	0	111.9	W207 V239 H240	W207-S210 PolarHBondContact N-O 3.03Å; S210-V239 CarbonylContact C-O 3.59Å; S210-V239 WeakPolarHBondContact CA-O 3.45Å; S210-V239 WeakPolarHBondContact CB-O 3.28Å; S210-H240 PolarHBondContact OG-ND1 3.19Å
211	V	84.1	Confident	89.3	Confident	25 Å²	25	49.8 Å²	49.8	15%	0.152	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.8	170.3	173.9	0	0	0	0	108.5	L88 L204 K205 F206 C238 V239 V242	L88-V211 HydrophobicContact CD1-CG1 4.19Å; L88-V211 HydrophobicContact CD1-CG2 3.89Å; L204-V211 HydrophobicContact CD2-CG1 4.39Å; K205-V211 CarbonylContact O-C 3.57Å; K205-V211 WeakPolarHBondContact O-CA 3.42Å; F206-V211 HydrophobicContact CD2-CG2 3.85Å; V211-C238 WeakPolarHBondContact O-CA 3.36Å; V211-V239 PolarHBondContact N-O 3.37Å; V211-V239 PolarHBondContact O-N 3.2Å; V211-V242 HydrophobicContact CB-CG1 4.35Å; V211-V242 HydrophobicContact CG2-CB 4.48Å; V211-V242 HydrophobicContact CG2-CG1 4.03Å; V211-V242 HydrophobicContact CG2-CG2 4.09Å
212	E	88.9	Confident	89.5	Confident	39 Å²	39	48.2 Å²	48.2	18%	0.182	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.2	172	-72.6	174.7	-174.7	0	0	110.3	L204 K205 W207 T236 C237 C238 Y252	L204-E212 CarbonylContact C-O 3.6Å; L204-E212 VanDerWaalsContact CA-O 3.27Å; L204-E212 WeakPolarHBondContact CA-O 3.48Å; K205-E212 HydrophobicContact CB-CB 4.42Å; K205-E212 PolarHBondContact N-O 2.87Å; K205-E212 PolarHBondContact O-N 3.25Å; W207-E212 PolarHBondContact NE1-OE1 3.13Å; W207-E212 PolarHBondContact NE1-OE2 3.01Å; E212-T236 HydrophobicContact CB-CG2 4.19Å; E212-T236 HydrophobicContact CG-CG2 4.34Å; E212-C237 CarbonylContact C-O 3.48Å; E212-C237 WeakPolarHBondContact CA-O 3.46Å; E212-C238 HydrophobicContact CG-CB 4.23Å; E212-Y252 WeakPolarHBondContact CG-OH 3.39Å; E212-Y252 PolarHBondContact OE1-OH 3.24Å; E212-Y252 PolarHBondContact OE2-OH 2.74Å
213	A	90.1	Very high	89.8	Confident	25 Å²	25	46.7 Å²	46.7	21%	0.207	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	111	167.8	0	0	0	0	0	108.4	L204 P215 C237	L204-A213 HydrophobicContact CD2-CB 3.67Å; A213-P215 VanDerWaalsContact O-CD 3.25Å; A213-P215 WeakPolarHBondContact O-CD 3.21Å; A213-C237 HydrophobicContact CB-CB 4.46Å; A213-C237 PolarHBondContact N-O 2.75Å; A213-C237 PolarHBondContact O-N 2.98Å
214	E	93.9	Very high	90.3	Very high	51 Å²	51	46.8 Å²	46.8	24%	0.238	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	103.7	174.3	-174.5	-169.7	138.5	0	0	108	K203 K205 R216	K203-E214 HydrophobicContact CB-CB 4.4Å; K203-E214 PolarHBondContact N-O 3.04Å; K203-E214 PolarHBondContact O-N 3.33Å; K205-E214 IonicContact NZ-OE2 3.9Å; K205-E214 PolarHBondContact NZ-OE2 3.07Å; E214-R216 HydrophobicContact CG-CG 4.22Å; E214-R216 PolarHBondContact O-N 3.27Å; E214-R216 IonicContact OE1-CZ 3.59Å; E214-R216 VanDerWaalsContact OE1-CZ 3.28Å; E214-R216 IonicContact OE1-NE 3.73Å; E214-R216 PolarHBondContact OE1-NE 2.83Å; E214-R216 IonicContact OE1-NH2 3.48Å; E214-R216 PolarHBondContact OE1-NH2 3.27Å; E214-R216 IonicContact OE2-NE 3.31Å; E214-R216 IonicContact OE2-NH2 2.83Å
215	P	94.1	Very high	91	Very high	23 Å²	23	50.8 Å²	50.8	15%	0.149	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	94.7	-179.8	31.1	-34	0	0	0	109.9	I200 A213 N234 P235	I200-P215 HydrophobicContact CG2-CB 4.21Å; A213-P215 VanDerWaalsContact O-CD 3.25Å; A213-P215 WeakPolarHBondContact O-CD 3.21Å; P215-N234 HydrophobicContact CB-CB 4.29Å; P215-N234 HydrophobicContact CG-CB 3.66Å; P215-P235 WeakPolarHBondContact CD-O 3.27Å; P215-P235 VanDerWaalsContact CG-O 3.23Å; P215-P235 WeakPolarHBondContact CG-O 3.22Å
216	R	95.2	Very high	91.8	Very high	97 Å²	97	49.4 Å²	49.4	37%	0.366	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.5	-179.2	-65.6	-179	170.2	-153.6	-10.9	110.9	I200 Y201 E214	I200-R216 CarbonylContact C-O 3.59Å; I200-R216 WeakPolarHBondContact CA-O 3.41Å; Y201-R216 HydrophobicContact CD1-CB 4.27Å; Y201-R216 PolarHBondContact N-O 3.45Å; Y201-R216 WeakPolarHBondContact O-CB 3.49Å; Y201-R216 PolarHBondContact O-N 2.92Å; E214-R216 HydrophobicContact CG-CG 4.22Å; E214-R216 PolarHBondContact O-N 3.27Å; E214-R216 IonicContact OE1-CZ 3.59Å; E214-R216 VanDerWaalsContact OE1-CZ 3.28Å; E214-R216 IonicContact OE1-NE 3.73Å; E214-R216 PolarHBondContact OE1-NE 2.83Å; E214-R216 IonicContact OE1-NH2 3.48Å; E214-R216 PolarHBondContact OE1-NH2 3.27Å; E214-R216 IonicContact OE2-NE 3.31Å; E214-R216 IonicContact OE2-NH2 2.83Å
217	G	96.1	Very high	92.7	Very high	25 Å²	25	50.7 Å²	50.7	26%	0.258	25%	0.253	S	S	.	.	S	Bend	trans	135.6	155.4	175.3	0	0	0	0	0	111.5	S199	S199-G217 VanDerWaalsContact O-CA 3.32Å; S199-G217 WeakPolarHBondContact O-CA 3.42Å
218	T	98.3	Very high	93.7	Very high	21 Å²	21	43.6 Å²	43.6	13%	0.129	23%	0.227	C	C	.	.			trans	-87.8	127.6	-179.5	-61.5	0	0	0	0	109.2	G198 T231 T457 T459	G198-T218 WeakPolarHBondContact CA-O 3.31Å; T218-T231 HydrophobicContact CG2-CG2 4.03Å; T218-T457 HydrophobicContact CG2-CG2 4.24Å; T218-T459 PolarHBondContact OG1-OG1 3.16Å
219	I	98.8	Very high	94.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.7	167.4	-52.7	-54.7	0	0	0	108.1	Y110 F185 F196 I200 T231 W232	Y110-I219 HydrophobicContact CE2-CD1 4.41Å; F185-I219 HydrophobicContact CE1-CD1 4.03Å; F185-I219 HydrophobicContact CZ-CD1 3.87Å; F196-I219 HydrophobicContact CD2-CG2 4.2Å; F196-I219 HydrophobicContact CE2-CG2 3.24Å; F196-I219 HydrophobicContact CZ-CG2 3.72Å; I200-I219 HydrophobicContact CD1-CD1 3.64Å; I219-T231 WeakPolarHBondContact O-CA 3.32Å; I219-W232 HydrophobicContact CB-CD2 3.96Å; I219-W232 HydrophobicContact CB-CE3 4.45Å; I219-W232 HydrophobicContact CB-CG 4.34Å; I219-W232 HydrophobicContact CB-CZ2 4.02Å; I219-W232 HydrophobicContact CG2-CD2 4.09Å; I219-W232 HydrophobicContact CG2-CE3 4.37Å; I219-W232 HydrophobicContact CG2-CH2 3.62Å; I219-W232 HydrophobicContact CG2-CZ2 3.27Å; I219-W232 HydrophobicContact CG2-CZ3 4.14Å; I219-W232 PolarHBondContact N-O 2.83Å; I219-W232 PolarHBondContact O-N 2.76Å; I219-W232 VanDerWaalsContact O-N 3.09Å
220	T	98.9	Very high	95.6	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128	-179.8	-52.3	0	0	0	0	110.2	F196 H197 E222 Y230 T231 N454 Y456	F196-T220 WeakPolarHBondContact CA-O 3.18Å; H197-T220 VanDerWaalsContact CE1-CB 3.42Å; H197-T220 WeakPolarHBondContact CE1-CB 3.29Å; H197-T220 PolarHBondContact N-O 3.02Å; H197-T220 PolarHBondContact O-N 3.15Å; T220-E222 HydrophobicContact CG2-CG 4.22Å; T220-Y230 WeakPolarHBondContact CA-O 3.11Å; T220-T231 HydrophobicContact CG2-CG2 4.2Å; T220-N454 PolarHBondContact OG1-ND2 2.99Å; T220-Y456 HydrophobicContact CG2-CD2 3.78Å; T220-Y456 HydrophobicContact CG2-CE2 3.75Å
221	L	98.9	Very high	96.3	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.5	170	174.9	67.5	0	0	0	109.1	I117 V133 F194 L195 F196 L223 A229 Y230 W232	I117-L221 HydrophobicContact CD1-CD1 3.82Å; I117-L221 HydrophobicContact CG1-CD1 4.07Å; I117-L221 HydrophobicContact CG1-CD2 4.13Å; I117-L221 HydrophobicContact CG2-CD1 3.84Å; V133-L221 HydrophobicContact CB-CD2 4.5Å; V133-L221 HydrophobicContact CG1-CD2 4.04Å; V133-L221 HydrophobicContact CG2-CD2 3.83Å; F194-L221 HydrophobicContact CB-CD1 4.24Å; F194-L221 HydrophobicContact CD2-CD1 4.08Å; F194-L221 HydrophobicContact CG-CD1 4.48Å; L195-L221 CarbonylContact O-C 3.46Å; L195-L221 WeakPolarHBondContact O-CA 3.46Å; F196-L221 HydrophobicContact CB-CD1 4.08Å; F196-L221 HydrophobicContact CD2-CB 4.22Å; F196-L221 HydrophobicContact CD2-CD1 4.26Å; L221-L223 HydrophobicContact CD1-CD2 4.42Å; L221-L223 HydrophobicContact CD2-CD2 4.32Å; L221-L223 HydrophobicContact CG-CD2 4.29Å; L221-A229 CarbonylContact O-C 3.6Å; L221-A229 WeakPolarHBondContact O-CA 3.36Å; L221-Y230 PolarHBondContact N-O 3.48Å; L221-Y230 PolarHBondContact O-N 2.89Å; L221-W232 HydrophobicContact CB-CH2 3.95Å; L221-W232 HydrophobicContact CB-CZ3 3.79Å
222	E	98.9	Very high	97	Very high	33 Å²	33	34.9 Å²	34.9	15%	0.154	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.7	175.2	-60.4	173.2	-131.2	0	0	109.3	F194 L195 H197 T220 L224 E228 A229 Y456	F194-E222 CarbonylContact C-O 3.53Å; F194-E222 WeakPolarHBondContact CA-O 3.32Å; F194-E222 WeakPolarHBondContact CB-O 3.3Å; L195-E222 HydrophobicContact CB-CB 4.18Å; L195-E222 PolarHBondContact N-O 2.92Å; L195-E222 PolarHBondContact O-N 3.16Å; H197-E222 IonicContact CD2-OE1 3Å; H197-E222 IonicContact CE1-OE1 3.96Å; H197-E222 IonicContact NE2-OE1 3.18Å; H197-E222 PolarHBondContact NE2-OE1 2.65Å; T220-E222 HydrophobicContact CG2-CG 4.22Å; E222-L224 HydrophobicContact CB-CD2 4.23Å; E222-E228 CarbonylContact C-O 3.58Å; E222-E228 WeakPolarHBondContact CA-O 3.45Å; E222-A229 HydrophobicContact CG-CB 4.09Å; E222-Y456 HydrophobicContact CG-CE2 3.96Å; E222-Y456 WeakPolarHBondContact CG-OH 3.16Å; E222-Y456 PolarHBondContact OE2-OH 3.19Å; E222-Y456 VanDerWaalsContact OE2-OH 3.06Å
223	L	98.8	Very high	97.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	94.7	171.9	-61.6	-175.3	0	0	0	108.3	I117 A120 V133 F194 L221 K225 H226 N227 E228 Y230	I117-L223 HydrophobicContact CG2-CD2 3.92Å; A120-L223 HydrophobicContact CB-CD1 3.87Å; A120-L223 HydrophobicContact CB-CD2 4.49Å; V133-L223 HydrophobicContact CG2-CD1 4.49Å; F194-L223 HydrophobicContact CB-CD2 4.23Å; L221-L223 HydrophobicContact CD1-CD2 4.42Å; L221-L223 HydrophobicContact CD2-CD2 4.32Å; L221-L223 HydrophobicContact CG-CD2 4.29Å; L223-K225 VanDerWaalsContact C-N 3.32Å; L223-K225 PolarHBondContact O-N 3.3Å; L223-H226 PolarHBondContact O-N 3.49Å; L223-N227 PolarHBondContact O-N 2.91Å; L223-N227 VanDerWaalsContact O-N 3.17Å; L223-E228 PolarHBondContact N-O 2.88Å; L223-E228 PolarHBondContact O-N 3.37Å; L223-Y230 HydrophobicContact CB-CE2 4.48Å; L223-Y230 HydrophobicContact CD1-CE2 3.6Å; L223-Y230 HydrophobicContact CG-CD2 4.4Å; L223-Y230 HydrophobicContact CG-CE2 3.81Å
224	L	98.3	Very high	97.8	Very high	69 Å²	69	35.8 Å²	35.8	36%	0.361	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-60	-40.7	-165.7	-61.6	-179.2	0	0	0	112.6	H192 D193 L195 E222 H226 N227	H192-L224 WeakPolarHBondContact O-CD1 3.26Å; D193-L224 PolarHBondContact O-N 2.78Å; L195-L224 HydrophobicContact CD1-CD2 4.07Å; L195-L224 HydrophobicContact CG-CD1 4.15Å; L195-L224 HydrophobicContact CG-CD2 4.09Å; L195-L224 HydrophobicContact CG-CG 4.42Å; E222-L224 HydrophobicContact CB-CD2 4.23Å; L224-H226 PolarHBondContact O-N 2.92Å; L224-H226 VanDerWaalsContact O-N 3.16Å; L224-N227 PolarHBondContact O-N 3.08Å
225	K	97.4	Very high	98	Very high	158 Å²	158	33.7 Å²	33.7	69%	0.687	17%	0.173	S	C	*	.	G	3₁₀ helix	trans	-58.4	-29.1	177.5	-176.3	176.7	179	-179.4	0	113.7	L223	L223-K225 VanDerWaalsContact C-N 3.32Å; L223-K225 PolarHBondContact O-N 3.3Å
226	H	98.1	Very high	98.1	Very high	44 Å²	44	33.9 Å²	33.9	20%	0.204	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-102.2	-8.1	-176.4	-59.9	-81.5	0	0	0	112.7	S121 Q123 R129 L223 L224 E228	S121-H226 PolarHBondContact O-NE2 3.38Å; Q123-H226 PolarHBondContact O-CE1 2.82Å; Q123-H226 VanDerWaalsContact O-CE1 3.24Å; R129-H226 PolarHBondContact NH1-CE1 3.28Å; R129-H226 PolarHBondContact NH1-ND1 2.89Å; L223-H226 PolarHBondContact O-N 3.49Å; L224-H226 PolarHBondContact O-N 2.92Å; L224-H226 VanDerWaalsContact O-N 3.16Å; H226-E228 VanDerWaalsContact C-N 3.26Å; H226-E228 HydrophobicContact CB-CB 4.33Å; H226-E228 HydrophobicContact CB-CG 3.71Å; H226-E228 WeakPolarHBondContact O-CG 3.22Å; H226-E228 PolarHBondContact O-N 3.1Å
227	N	98.1	Very high	98.1	Very high	114 Å²	114	30.6 Å²	30.6	61%	0.61	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	48.7	-170.5	-167.6	21.4	0	0	0	111.1	L223 L224	L223-N227 PolarHBondContact O-N 2.91Å; L223-N227 VanDerWaalsContact O-N 3.17Å; L224-N227 PolarHBondContact O-N 3.08Å
228	E	98.3	Very high	97.8	Very high	11 Å²	11	29.5 Å²	29.5	5%	0.051	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140.7	-179.9	-58.2	-170.6	161.9	0	0	110.3	R129 E222 L223 H226 Y230 N259 R261 T262	R129-E228 IonicContact CZ-OE1 2.67Å; R129-E228 IonicContact CZ-OE2 3.49Å; R129-E228 IonicContact NE-OE1 3.5Å; R129-E228 IonicContact NE-OE2 3.54Å; R129-E228 PolarHBondContact NE-OE2 3.19Å; R129-E228 VanDerWaalsContact NH2-CD 3.28Å; R129-E228 IonicContact NH2-OE1 3.52Å; R129-E228 PolarHBondContact NH2-OE1 3.45Å; R129-E228 IonicContact NH2-OE2 2.75Å; R129-E228 PolarHBondContact NH2-OE2 3.38Å; E222-E228 CarbonylContact C-O 3.58Å; E222-E228 WeakPolarHBondContact CA-O 3.45Å; L223-E228 PolarHBondContact N-O 2.88Å; L223-E228 PolarHBondContact O-N 3.37Å; H226-E228 VanDerWaalsContact C-N 3.26Å; H226-E228 HydrophobicContact CB-CB 4.33Å; H226-E228 HydrophobicContact CB-CG 3.71Å; H226-E228 WeakPolarHBondContact O-CG 3.22Å; H226-E228 PolarHBondContact O-N 3.1Å; E228-Y230 HydrophobicContact CB-CE2 4.03Å; E228-Y230 PolarHBondContact OE2-OH 3.03Å; E228-N259 PolarHBondContact OE2-ND2 3.22Å; E228-R261 HydrophobicContact CB-CB 4.22Å; E228-R261 HydrophobicContact CG-CB 3.81Å; E228-R261 HydrophobicContact CG-CG 3.99Å; E228-T262 VanDerWaalsContact OE1-CG2 3.24Å; E228-T262 WeakPolarHBondContact OE1-CG2 3.46Å
229	A	98.8	Very high	97.4	Very high	3 Å²	3	30.3 Å²	30.3	3%	0.025	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	144.6	171.4	0	0	0	0	0	110.8	L221 E222 N259 H260 Y456	L221-A229 CarbonylContact O-C 3.6Å; L221-A229 WeakPolarHBondContact O-CA 3.36Å; E222-A229 HydrophobicContact CG-CB 4.09Å; A229-N259 WeakPolarHBondContact O-CA 3.45Å; A229-H260 PolarHBondContact O-CD2 3.28Å; A229-H260 PolarHBondContact O-N 3.12Å; A229-Y456 HydrophobicContact CB-CD1 3.61Å; A229-Y456 HydrophobicContact CB-CD2 3.64Å; A229-Y456 HydrophobicContact CB-CE1 3.29Å; A229-Y456 HydrophobicContact CB-CE2 3.32Å; A229-Y456 HydrophobicContact CB-CG 3.78Å
230	Y	98.9	Very high	96.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.3	179.7	-57.8	-102.7	0	0	0	108.7	R129 M130 V133 T220 L221 L223 E228 I257 L258 N259	R129-Y230 VanDerWaalsContact CB-OH 3.29Å; R129-Y230 WeakPolarHBondContact CB-OH 3.41Å; M130-Y230 HydrophobicContact CE-CD1 3.89Å; M130-Y230 HydrophobicContact CE-CE1 3.85Å; M130-Y230 HydrophobicContact SD-CD1 4.11Å; M130-Y230 HydrophobicContact SD-CE1 4.09Å; V133-Y230 HydrophobicContact CB-CD1 4.26Å; V133-Y230 HydrophobicContact CB-CE1 4.37Å; V133-Y230 HydrophobicContact CG1-CD1 3.94Å; V133-Y230 HydrophobicContact CG1-CG 3.99Å; V133-Y230 HydrophobicContact CG2-CD1 4.09Å; V133-Y230 HydrophobicContact CG2-CD2 4.21Å; V133-Y230 HydrophobicContact CG2-CE1 3.94Å; V133-Y230 HydrophobicContact CG2-CE2 4.11Å; V133-Y230 HydrophobicContact CG2-CG 4.21Å; T220-Y230 WeakPolarHBondContact CA-O 3.11Å; L221-Y230 PolarHBondContact N-O 3.48Å; L221-Y230 PolarHBondContact O-N 2.89Å; L223-Y230 HydrophobicContact CB-CE2 4.48Å; L223-Y230 HydrophobicContact CD1-CE2 3.6Å; L223-Y230 HydrophobicContact CG-CD2 4.4Å; L223-Y230 HydrophobicContact CG-CE2 3.81Å; E228-Y230 HydrophobicContact CB-CE2 4.03Å; E228-Y230 PolarHBondContact OE2-OH 3.03Å; Y230-I257 HydrophobicContact CD1-CG2 4.18Å; Y230-L258 VanDerWaalsContact CA-O 3.22Å; Y230-L258 WeakPolarHBondContact CA-O 3.48Å; Y230-N259 HydrophobicContact CD1-CB 3.83Å; Y230-N259 HydrophobicContact CE1-CB 3.69Å; Y230-N259 WeakPolarHBondContact CE1-ND2 3.49Å; Y230-N259 PolarHBondContact OH-ND2 3.15Å; Y230-N259 VanDerWaalsContact OH-ND2 3.12Å
231	T	98.9	Very high	96.2	Very high	11 Å²	11	32.7 Å²	32.7	7%	0.067	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.2	175.4	61.8	0	0	0	0	111.9	T218 I219 T220 I257 L258 H260 Y456 T457	T218-T231 HydrophobicContact CG2-CG2 4.03Å; I219-T231 WeakPolarHBondContact O-CA 3.32Å; T220-T231 HydrophobicContact CG2-CG2 4.2Å; T231-I257 WeakPolarHBondContact O-CA 3.48Å; T231-L258 PolarHBondContact N-O 3.15Å; T231-L258 VanDerWaalsContact N-O 3.11Å; T231-L258 PolarHBondContact O-N 3.22Å; T231-H260 VanDerWaalsContact CG2-NE2 3.32Å; T231-H260 WeakPolarHBondContact CG2-NE2 3.4Å; T231-H260 PolarHBondContact OG1-NE2 3.36Å; T231-Y456 HydrophobicContact CG2-CD2 4.46Å; T231-T457 HydrophobicContact CG2-CG2 4.04Å
232	W	98.8	Very high	95.1	Very high	7 Å²	7	33.1 Å²	33.1	3%	0.027	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	176	173	68	97.8	0	0	0	111.4	V133 F136 A137 F196 I219 L221 N234 V255 E256 I257	V133-W232 HydrophobicContact CG1-CZ3 4.29Å; F136-W232 HydrophobicContact CD1-CH2 4.14Å; F136-W232 HydrophobicContact CD1-CZ2 4.27Å; F136-W232 HydrophobicContact CE1-CH2 4.15Å; F136-W232 HydrophobicContact CE1-CZ2 4.2Å; A137-W232 HydrophobicContact CB-CD2 4.41Å; A137-W232 HydrophobicContact CB-CZ2 4.06Å; F196-W232 HydrophobicContact CD2-CH2 4.38Å; F196-W232 AromaticContact CE2-CH2 3.8Å; F196-W232 HydrophobicContact CE2-CH2 3.8Å; F196-W232 AromaticContact CE2-CZ2 3.92Å; F196-W232 HydrophobicContact CE2-CZ2 3.92Å; I219-W232 HydrophobicContact CB-CD2 3.96Å; I219-W232 HydrophobicContact CB-CE3 4.45Å; I219-W232 HydrophobicContact CB-CG 4.34Å; I219-W232 HydrophobicContact CB-CZ2 4.02Å; I219-W232 HydrophobicContact CG2-CD2 4.09Å; I219-W232 HydrophobicContact CG2-CE3 4.37Å; I219-W232 HydrophobicContact CG2-CH2 3.62Å; I219-W232 HydrophobicContact CG2-CZ2 3.27Å; I219-W232 HydrophobicContact CG2-CZ3 4.14Å; I219-W232 PolarHBondContact N-O 2.83Å; I219-W232 PolarHBondContact O-N 2.76Å; I219-W232 VanDerWaalsContact O-N 3.09Å; L221-W232 HydrophobicContact CB-CH2 3.95Å; L221-W232 HydrophobicContact CB-CZ3 3.79Å; W232-N234 PolarHBondContact NE1-OD1 2.82Å; W232-V255 HydrophobicContact CB-CG1 4.07Å; W232-V255 HydrophobicContact CG-CG1 4.27Å; W232-E256 WeakPolarHBondContact CA-O 3.29Å; W232-E256 VanDerWaalsContact CB-O 3.26Å; W232-E256 WeakPolarHBondContact CB-O 3.24Å; W232-I257 HydrophobicContact CB-CB 4.43Å; W232-I257 HydrophobicContact CB-CG1 3.86Å; W232-I257 HydrophobicContact CD2-CG1 4.45Å; W232-I257 HydrophobicContact CE3-CG2 4.19Å; W232-I257 HydrophobicContact CG-CG1 4.16Å
233	T	98.2	Very high	93.8	Very high	68 Å²	68	33.1 Å²	33.1	42%	0.417	17%	0.174	S	C	.	.			trans	-120	148.4	167.7	58	0	0	0	0	109
234	N	98	Very high	92.5	Very high	15 Å²	15	39 Å²	39	8%	0.08	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-74.3	155.7	179.5	-76.9	-25.7	0	0	0	112.1	Y110 P215 W232	Y110-N234 PolarHBondContact OH-ND2 2.95Å; P215-N234 HydrophobicContact CB-CB 4.29Å; P215-N234 HydrophobicContact CG-CB 3.66Å; W232-N234 PolarHBondContact NE1-OD1 2.82Å
235	P	97.7	Very high	91.5	Very high	7 Å²	7	38.2 Å²	38.2	5%	0.045	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-68.3	159.5	176.3	30.9	-36	0	0	0	111.4	V141 P215 Q251 V255 F270	V141-P235 HydrophobicContact CG2-CG 4.26Å; P215-P235 WeakPolarHBondContact CD-O 3.27Å; P215-P235 VanDerWaalsContact CG-O 3.23Å; P215-P235 WeakPolarHBondContact CG-O 3.22Å; P235-Q251 HydrophobicContact CG-CB 4.35Å; P235-V255 HydrophobicContact CB-CG2 4.17Å; P235-V255 HydrophobicContact CG-CG2 4.41Å; P235-F270 HydrophobicContact CB-CB 4.43Å; P235-F270 HydrophobicContact CB-CD1 4.25Å; P235-F270 HydrophobicContact CB-CD2 4.07Å; P235-F270 HydrophobicContact CB-CE2 4.37Å; P235-F270 HydrophobicContact CB-CG 4.01Å; P235-F270 HydrophobicContact CG-CD1 4.09Å; P235-F270 HydrophobicContact CG-CD2 4.33Å; P235-F270 HydrophobicContact CG-CE1 3.92Å; P235-F270 HydrophobicContact CG-CE2 4.19Å; P235-F270 HydrophobicContact CG-CG 4.29Å; P235-F270 HydrophobicContact CG-CZ 3.96Å
236	T	96.3	Very high	90.7	Very high	28 Å²	28	37.6 Å²	37.6	17%	0.172	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	135.5	171.9	-62.7	0	0	0	0	109.4	E212 Q251 Y252	E212-T236 HydrophobicContact CB-CG2 4.19Å; E212-T236 HydrophobicContact CG-CG2 4.34Å; T236-Q251 VanDerWaalsContact O-CA 3.27Å; T236-Q251 WeakPolarHBondContact O-CA 3.41Å; T236-Y252 HydrophobicContact CG2-CE2 4.08Å; T236-Y252 PolarHBondContact N-O 3.05Å; T236-Y252 PolarHBondContact O-N 3.44Å
237	C	94.8	Very high	90.1	Very high	28 Å²	28	37.2 Å²	37.2	19%	0.189	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.1	171.2	-178.2	0	0	0	0	109.3	E212 A213 E250 Q251	E212-C237 CarbonylContact C-O 3.48Å; E212-C237 WeakPolarHBondContact CA-O 3.46Å; A213-C237 HydrophobicContact CB-CB 4.46Å; A213-C237 PolarHBondContact N-O 2.75Å; A213-C237 PolarHBondContact O-N 2.98Å; C237-E250 CarbonylContact C-O 3.54Å; C237-E250 WeakPolarHBondContact CA-O 3.45Å; C237-Q251 HydrophobicContact CB-CG 4.49Å
238	C	91.5	Very high	89.6	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	126	178	-172.6	0	0	0	0	109.8	V211 E212 H240 I249 E250 Y252	V211-C238 WeakPolarHBondContact O-CA 3.36Å; E212-C238 HydrophobicContact CG-CB 4.23Å; C238-H240 VanDerWaalsContact SG-CE1 3.55Å; C238-I249 CarbonylContact O-C 3.54Å; C238-I249 WeakPolarHBondContact O-CA 3.31Å; C238-E250 HydrophobicContact CB-CB 4.38Å; C238-E250 PolarHBondContact N-O 3.11Å; C238-E250 PolarHBondContact O-N 3.06Å; C238-Y252 HydrophobicContact CB-CD1 4.45Å; C238-Y252 HydrophobicContact CB-CE1 3.71Å
239	V	88.7	Confident	89.2	Confident	37 Å²	37	32.9 Å²	32.9	22%	0.224	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.1	170.5	-171.2	0	0	0	0	107.3	S210 V211 V242 L247 I249	S210-V239 CarbonylContact C-O 3.59Å; S210-V239 WeakPolarHBondContact CA-O 3.45Å; S210-V239 WeakPolarHBondContact CB-O 3.28Å; V211-V239 PolarHBondContact N-O 3.37Å; V211-V239 PolarHBondContact O-N 3.2Å; V239-V242 HydrophobicContact CB-CG1 4.13Å; V239-V242 HydrophobicContact CG1-CG1 3.89Å; V239-V242 WeakPolarHBondContact O-CG1 3.25Å; V239-L247 HydrophobicContact CG1-CD2 4.13Å; V239-I249 HydrophobicContact CG2-CG1 4.24Å
240	H	88	Confident	89	Confident	31 Å²	31	33.1 Å²	33.1	14%	0.144	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	163.2	179.9	-66.8	-80.9	0	0	0	111.7	S210 C238 V242 L247 W248 E250	S210-H240 PolarHBondContact OG-ND1 3.19Å; C238-H240 VanDerWaalsContact SG-CE1 3.55Å; H240-V242 VanDerWaalsContact C-N 3.27Å; H240-V242 PolarHBondContact O-N 2.82Å; H240-L247 WeakPolarHBondContact O-CA 3.42Å; H240-L247 WeakPolarHBondContact O-CD2 3.33Å; H240-W248 HydrophobicContact CB-CD2 3.95Å; H240-W248 HydrophobicContact CB-CG 4.18Å; H240-W248 HydrophobicContact CB-CZ2 3.77Å; H240-W248 VanDerWaalsContact CB-NE1 3.29Å; H240-W248 AromaticContact CD2-CD2 3.78Å; H240-W248 AromaticContact CD2-CE2 3.52Å; H240-W248 AromaticContact CD2-CE3 3.75Å; H240-W248 AromaticContact CD2-CH2 3.22Å; H240-W248 WeakPolarHBondContact CD2-CH2 3.27Å; H240-W248 AromaticContact CD2-CZ2 3.24Å; H240-W248 WeakPolarHBondContact CD2-CZ2 3.41Å; H240-W248 AromaticContact CD2-CZ3 3.5Å; H240-W248 AromaticContact CG-CE2 3.59Å; H240-W248 AromaticContact CG-CH2 3.91Å; H240-W248 AromaticContact CG-CZ2 3.43Å; H240-W248 VanDerWaalsContact CG-CZ2 3.43Å; H240-W248 AromaticContact CG-NE1 4Å; H240-W248 PolarHBondContact N-O 2.6Å; H240-W248 AromaticContact NE2-CH2 3.36Å; H240-W248 WeakPolarHBondContact NE2-CH2 3.48Å; H240-W248 AromaticContact NE2-CZ2 3.69Å; H240-W248 AromaticContact NE2-CZ3 3.85Å; H240-E250 IonicContact CD2-OE2 3.09Å; H240-E250 IonicContact CE1-OE2 2.86Å; H240-E250 IonicContact NE2-OE2 2.65Å; H240-E250 PolarHBondContact NE2-OE2 2.61Å
241	N	84.2	Confident	88.8	Confident	20 Å²	20	33.3 Å²	33.3	11%	0.107	19%	0.186	C	C	.	.			trans	59.1	35	177.2	-63.3	-13.8	0	0	0	113.4	K209 I243 I244 K246 L247	K209-N241 WeakPolarHBondContact O-CA 3.5Å; K209-N241 PolarHBondContact O-N 3.1Å; N241-I243 PolarHBondContact O-N 2.78Å; N241-I243 VanDerWaalsContact O-N 3.15Å; N241-I244 WeakPolarHBondContact CB-O 3.38Å; N241-K246 WeakPolarHBondContact CB-O 3.38Å; N241-K246 PolarHBondContact ND2-O 3.4Å; N241-L247 WeakPolarHBondContact O-CD2 3.27Å
242	V	76.5	Confident	88.7	Confident	10 Å²	10	35 Å²	35	6%	0.061	19%	0.191	C	C	.	.	S	Bend	trans	-68.3	-11.7	-178.9	-60.1	0	0	0	0	113.4	V76 L80 F206 K209 V211 V239 H240 L247	V76-V242 WeakPolarHBondContact CB-O 3.29Å; V76-V242 WeakPolarHBondContact CG1-O 3.34Å; L80-V242 HydrophobicContact CD1-CB 4.1Å; L80-V242 HydrophobicContact CD1-CG2 3.77Å; L80-V242 WeakPolarHBondContact CD1-O 3.35Å; F206-V242 HydrophobicContact CD2-CG2 4.43Å; F206-V242 HydrophobicContact CE2-CG2 3.78Å; K209-V242 WeakPolarHBondContact O-CG2 3.23Å; K209-V242 PolarHBondContact O-N 3.32Å; V211-V242 HydrophobicContact CB-CG1 4.35Å; V211-V242 HydrophobicContact CG2-CB 4.48Å; V211-V242 HydrophobicContact CG2-CG1 4.03Å; V211-V242 HydrophobicContact CG2-CG2 4.09Å; V239-V242 HydrophobicContact CB-CG1 4.13Å; V239-V242 HydrophobicContact CG1-CG1 3.89Å; V239-V242 WeakPolarHBondContact O-CG1 3.25Å; H240-V242 VanDerWaalsContact C-N 3.27Å; H240-V242 PolarHBondContact O-N 2.82Å; V242-L247 HydrophobicContact CB-CD2 4.4Å; V242-L247 HydrophobicContact CG1-CD2 4.1Å
243	I	71.2	Confident	88.6	Confident	32 Å²	32	36 Å²	36	16%	0.164	20%	0.203	C	C	.	.	S	Bend	trans	-99.4	-58.9	176.1	-65.5	175.3	0	0	0	110.9	W77 L80 F206 G208 N241	W77-I243 HydrophobicContact CB-CG2 4.16Å; W77-I243 HydrophobicContact CD2-CG2 3.61Å; W77-I243 HydrophobicContact CE3-CB 3.93Å; W77-I243 HydrophobicContact CE3-CD1 3.88Å; W77-I243 HydrophobicContact CE3-CG1 3.63Å; W77-I243 HydrophobicContact CE3-CG2 3.2Å; W77-I243 HydrophobicContact CG-CG2 4.06Å; W77-I243 HydrophobicContact CH2-CD1 4.43Å; W77-I243 HydrophobicContact CZ3-CB 4.37Å; W77-I243 HydrophobicContact CZ3-CD1 3.47Å; W77-I243 VanDerWaalsContact CZ3-CD1 3.47Å; W77-I243 HydrophobicContact CZ3-CG1 3.79Å; W77-I243 HydrophobicContact CZ3-CG2 3.72Å; L80-I243 HydrophobicContact CD1-CG1 3.76Å; F206-I243 HydrophobicContact CZ-CD1 4.16Å; F206-I243 HydrophobicContact CZ-CG1 4.47Å; G208-I243 WeakPolarHBondContact O-CD1 3.19Å; G208-I243 WeakPolarHBondContact O-CG1 3.25Å; N241-I243 PolarHBondContact O-N 2.78Å; N241-I243 VanDerWaalsContact O-N 3.15Å
244	I	72.8	Confident	88.6	Confident	125 Å²	125	36.4 Å²	36.4	64%	0.641	21%	0.205	S	C	*	.	S	Bend	trans	-138.9	141.1	-174.3	-72.8	156.6	0	0	0	107.8	N241	N241-I244 WeakPolarHBondContact CB-O 3.38Å
245	G	75.4	Confident	88.7	Confident	51 Å²	51	35.8 Å²	35.8	53%	0.526	20%	0.202	S	C	.	.	S	Bend	trans	103	-178.8	178.5	0	0	0	0	0	112.8
246	K	81.4	Confident	88.7	Confident	145 Å²	145	39.7 Å²	39.7	63%	0.63	22%	0.22	S	C	*	.			trans	-78.5	124.1	177.2	179	174.4	172.6	-173.2	0	109.3	N241 V347	N241-K246 WeakPolarHBondContact CB-O 3.38Å; N241-K246 PolarHBondContact ND2-O 3.4Å; K246-V347 HydrophobicContact CB-CG2 3.69Å; K246-V347 HydrophobicContact CD-CG2 3.77Å; K246-V347 HydrophobicContact CG-CG2 3.8Å
247	L	85.1	Confident	88.8	Confident	37 Å²	37	38.4 Å²	38.4	19%	0.194	21%	0.212	C	C	.	.			trans	-59.4	135.9	173.6	-63.7	173.1	0	0	0	110.4	T148 V239 H240 N241 V242	T148-L247 HydrophobicContact CG2-CB 3.69Å; V239-L247 HydrophobicContact CG1-CD2 4.13Å; H240-L247 WeakPolarHBondContact O-CA 3.42Å; H240-L247 WeakPolarHBondContact O-CD2 3.33Å; N241-L247 WeakPolarHBondContact O-CD2 3.27Å; V242-L247 HydrophobicContact CB-CD2 4.4Å; V242-L247 HydrophobicContact CG1-CD2 4.1Å
248	W	87.6	Confident	89	Confident	27 Å²	27	40 Å²	40	10%	0.102	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.7	170.9	64.1	-82.5	0	0	0	110.5	W145 H240 E250 C273 L280 V347	W145-W248 HydrophobicContact CZ3-CB 4.49Å; W145-W248 HydrophobicContact CZ3-CE3 4.5Å; H240-W248 HydrophobicContact CB-CD2 3.95Å; H240-W248 HydrophobicContact CB-CG 4.18Å; H240-W248 HydrophobicContact CB-CZ2 3.77Å; H240-W248 VanDerWaalsContact CB-NE1 3.29Å; H240-W248 AromaticContact CD2-CD2 3.78Å; H240-W248 AromaticContact CD2-CE2 3.52Å; H240-W248 AromaticContact CD2-CE3 3.75Å; H240-W248 AromaticContact CD2-CH2 3.22Å; H240-W248 WeakPolarHBondContact CD2-CH2 3.27Å; H240-W248 AromaticContact CD2-CZ2 3.24Å; H240-W248 WeakPolarHBondContact CD2-CZ2 3.41Å; H240-W248 AromaticContact CD2-CZ3 3.5Å; H240-W248 AromaticContact CG-CE2 3.59Å; H240-W248 AromaticContact CG-CH2 3.91Å; H240-W248 AromaticContact CG-CZ2 3.43Å; H240-W248 VanDerWaalsContact CG-CZ2 3.43Å; H240-W248 AromaticContact CG-NE1 4Å; H240-W248 PolarHBondContact N-O 2.6Å; H240-W248 AromaticContact NE2-CH2 3.36Å; H240-W248 WeakPolarHBondContact NE2-CH2 3.48Å; H240-W248 AromaticContact NE2-CZ2 3.69Å; H240-W248 AromaticContact NE2-CZ3 3.85Å; W248-E250 HydrophobicContact CE3-CB 4.32Å; W248-E250 HydrophobicContact CH2-CB 4.32Å; W248-E250 HydrophobicContact CZ3-CB 3.67Å; W248-E250 HydrophobicContact CZ3-CG 4.2Å; W248-C273 HydrophobicContact CH2-CB 4.33Å; W248-L280 HydrophobicContact CH2-CD1 4.34Å; W248-L280 HydrophobicContact CZ3-CD1 3.69Å; W248-V347 HydrophobicContact CB-CG1 4.3Å
249	I	91.3	Very high	89.4	Confident	6 Å²	6	40 Å²	40	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.9	-174.3	-72.6	168.7	0	0	0	109.7	Q144 W145 R147 T148 C238 V239 W302	Q144-I249 HydrophobicContact CB-CG2 4.44Å; Q144-I249 WeakPolarHBondContact O-CD1 3.27Å; W145-I249 WeakPolarHBondContact CZ3-O 3.44Å; R147-I249 VanDerWaalsContact C-CD1 3.48Å; R147-I249 WeakPolarHBondContact O-CD1 3.36Å; T148-I249 HydrophobicContact CG2-CD1 4.27Å; T148-I249 HydrophobicContact CG2-CG1 4.3Å; C238-I249 CarbonylContact O-C 3.54Å; C238-I249 WeakPolarHBondContact O-CA 3.31Å; V239-I249 HydrophobicContact CG2-CG1 4.24Å; I249-W302 HydrophobicContact CG2-CH2 4.42Å
250	E	93.3	Very high	89.8	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.037	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150.9	170.7	-170.2	171.4	-156.3	0	0	110.4	C237 C238 H240 W248 Y252 P272 C273	C237-E250 CarbonylContact C-O 3.54Å; C237-E250 WeakPolarHBondContact CA-O 3.45Å; C238-E250 HydrophobicContact CB-CB 4.38Å; C238-E250 PolarHBondContact N-O 3.11Å; C238-E250 PolarHBondContact O-N 3.06Å; H240-E250 IonicContact CD2-OE2 3.09Å; H240-E250 IonicContact CE1-OE2 2.86Å; H240-E250 IonicContact NE2-OE2 2.65Å; H240-E250 PolarHBondContact NE2-OE2 2.61Å; W248-E250 HydrophobicContact CE3-CB 4.32Å; W248-E250 HydrophobicContact CH2-CB 4.32Å; W248-E250 HydrophobicContact CZ3-CB 3.67Å; W248-E250 HydrophobicContact CZ3-CG 4.2Å; E250-Y252 HydrophobicContact CG-CD1 4.24Å; E250-P272 VanDerWaalsContact OE1-CA 3.24Å; E250-P272 WeakPolarHBondContact OE1-CA 3.47Å; E250-C273 WeakPolarHBondContact OE1-CA 3.36Å; E250-C273 WeakPolarHBondContact OE1-CB 3.01Å; E250-C273 PolarHBondContact OE1-N 3.12Å
251	Q	96.1	Very high	90.3	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.023	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.4	165.4	-64.8	177.3	39	0	0	109.9	V141 P235 T236 C237 F270 W302	V141-Q251 VanDerWaalsContact CB-OE1 3.27Å; V141-Q251 PolarHBondContact O-NE2 3.46Å; P235-Q251 HydrophobicContact CG-CB 4.35Å; T236-Q251 VanDerWaalsContact O-CA 3.27Å; T236-Q251 WeakPolarHBondContact O-CA 3.41Å; C237-Q251 HydrophobicContact CB-CG 4.49Å; Q251-F270 HydrophobicContact CB-CD1 4.25Å; Q251-W302 HydrophobicContact CB-CZ2 4.23Å; Q251-W302 HydrophobicContact CG-CH2 4.39Å; Q251-W302 HydrophobicContact CG-CZ2 4.13Å
252	Y	96.4	Very high	91	Very high	47 Å²	47	48.7 Å²	48.7	18%	0.184	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	165.4	179.6	64.4	-104.5	0	0	0	111.4	E212 T236 C238 E250 F270 P272	E212-Y252 WeakPolarHBondContact CG-OH 3.39Å; E212-Y252 PolarHBondContact OE1-OH 3.24Å; E212-Y252 PolarHBondContact OE2-OH 2.74Å; T236-Y252 HydrophobicContact CG2-CE2 4.08Å; T236-Y252 PolarHBondContact N-O 3.05Å; T236-Y252 PolarHBondContact O-N 3.44Å; C238-Y252 HydrophobicContact CB-CD1 4.45Å; C238-Y252 HydrophobicContact CB-CE1 3.71Å; E250-Y252 HydrophobicContact CG-CD1 4.24Å; Y252-F270 VanDerWaalsContact CA-O 3.29Å; Y252-F270 WeakPolarHBondContact CA-O 3.45Å; Y252-P272 HydrophobicContact CG-CB 4.42Å
253	G	97	Very high	92	Very high	27 Å²	27	49.5 Å²	49.5	28%	0.278	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	126.2	-175.3	179.4	0	0	0	0	0	112.4	F270	G253-F270 PolarHBondContact N-O 2.99Å; G253-F270 PolarHBondContact O-N 3.26Å
254	T	98.3	Very high	93.3	Very high	76 Å²	76	49.4 Å²	49.4	47%	0.466	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.1	176.7	-60.3	0	0	0	0	109.4	E256 V267 L268 H269	T254-E256 HydrophobicContact CG2-CG 4.18Å; T254-V267 HydrophobicContact CG2-CG1 3.74Å; T254-L268 CarbonylContact C-O 3.53Å; T254-L268 WeakPolarHBondContact CA-O 3.36Å; T254-H269 PolarHBondContact OG1-ND1 3.2Å
255	V	98.6	Very high	94.5	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.7	173.3	175.5	0	0	0	0	107.8	W232 P235 I257 L268 F270	W232-V255 HydrophobicContact CB-CG1 4.07Å; W232-V255 HydrophobicContact CG-CG1 4.27Å; P235-V255 HydrophobicContact CB-CG2 4.17Å; P235-V255 HydrophobicContact CG-CG2 4.41Å; V255-I257 HydrophobicContact CG1-CG1 4.15Å; V255-L268 HydrophobicContact CB-CB 4.31Å; V255-L268 PolarHBondContact N-O 3.42Å; V255-L268 PolarHBondContact O-N 2.95Å; V255-F270 HydrophobicContact CB-CE2 4.15Å; V255-F270 HydrophobicContact CG2-CD2 3.9Å; V255-F270 HydrophobicContact CG2-CE2 3.54Å; V255-F270 HydrophobicContact CG2-CZ 4.49Å
256	E	98.6	Very high	95.6	Very high	89 Å²	89	43.3 Å²	43.3	42%	0.416	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.1	173.1	-60.7	-155.7	149.7	0	0	110	W232 T254 K265 C266 V267	W232-E256 WeakPolarHBondContact CA-O 3.29Å; W232-E256 VanDerWaalsContact CB-O 3.26Å; W232-E256 WeakPolarHBondContact CB-O 3.24Å; T254-E256 HydrophobicContact CG2-CG 4.18Å; E256-K265 IonicContact OE1-NZ 2.91Å; E256-K265 PolarHBondContact OE1-NZ 2.73Å; E256-K265 IonicContact OE2-NZ 2.79Å; E256-K265 PolarHBondContact OE2-NZ 3.4Å; E256-C266 CarbonylContact C-O 3.53Å; E256-C266 WeakPolarHBondContact CA-O 3.46Å; E256-V267 HydrophobicContact CG-CG1 4.45Å; E256-V267 HydrophobicContact CG-CG2 4.33Å
257	I	98.9	Very high	96.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	115.1	176.6	-52.1	166.2	0	0	0	107.7	M130 V133 A134 A137 Y230 T231 W232 V255 K265 C266 L268	M130-I257 HydrophobicContact CE-CG2 4.44Å; M130-I257 HydrophobicContact SD-CB 4.25Å; M130-I257 HydrophobicContact SD-CG2 3.88Å; V133-I257 HydrophobicContact CG1-CG2 3.88Å; A134-I257 HydrophobicContact CB-CD1 4Å; A137-I257 HydrophobicContact CB-CD1 3.75Å; Y230-I257 HydrophobicContact CD1-CG2 4.18Å; T231-I257 WeakPolarHBondContact O-CA 3.48Å; W232-I257 HydrophobicContact CB-CB 4.43Å; W232-I257 HydrophobicContact CB-CG1 3.86Å; W232-I257 HydrophobicContact CD2-CG1 4.45Å; W232-I257 HydrophobicContact CE3-CG2 4.19Å; W232-I257 HydrophobicContact CG-CG1 4.16Å; V255-I257 HydrophobicContact CG1-CG1 4.15Å; I257-K265 CarbonylContact O-C 3.6Å; I257-K265 VanDerWaalsContact O-CA 3.32Å; I257-K265 WeakPolarHBondContact O-CA 3.2Å; I257-C266 HydrophobicContact CB-CB 4.14Å; I257-C266 HydrophobicContact CD1-CB 4.38Å; I257-C266 PolarHBondContact N-O 3.4Å; I257-C266 PolarHBondContact O-N 3.48Å; I257-L268 HydrophobicContact CD1-CD1 4.13Å
258	L	98.9	Very high	97.1	Very high	63 Å²	63	35.1 Å²	35.1	33%	0.33	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.4	179.8	177.6	62.6	0	0	0	110.4	Y230 T231	Y230-L258 VanDerWaalsContact CA-O 3.22Å; Y230-L258 WeakPolarHBondContact CA-O 3.48Å; T231-L258 PolarHBondContact N-O 3.15Å; T231-L258 VanDerWaalsContact N-O 3.11Å; T231-L258 PolarHBondContact O-N 3.22Å
259	N	98.8	Very high	97.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	112.8	165.5	179.7	-52.2	0	0	0	109.4	M130 E228 A229 Y230 R261 T262 G263 H264	M130-N259 HydrophobicContact CE-CB 3.7Å; E228-N259 PolarHBondContact OE2-ND2 3.22Å; A229-N259 WeakPolarHBondContact O-CA 3.45Å; Y230-N259 HydrophobicContact CD1-CB 3.83Å; Y230-N259 HydrophobicContact CE1-CB 3.69Å; Y230-N259 WeakPolarHBondContact CE1-ND2 3.49Å; Y230-N259 PolarHBondContact OH-ND2 3.15Å; Y230-N259 VanDerWaalsContact OH-ND2 3.12Å; N259-R261 VanDerWaalsContact C-N 3.29Å; N259-R261 PolarHBondContact O-N 3.14Å; N259-R261 WeakPolarHBondContact OD1-CB 3.4Å; N259-R261 PolarHBondContact OD1-N 2.75Å; N259-T262 PolarHBondContact ND2-OG1 3.37Å; N259-T262 PolarHBondContact OD1-N 3.45Å; N259-T262 PolarHBondContact OD1-OG1 3.25Å; N259-T262 VanDerWaalsContact OD1-OG1 3.04Å; N259-G263 WeakPolarHBondContact O-CA 3.29Å; N259-G263 PolarHBondContact O-N 3Å; N259-H264 HydrophobicContact CB-CB 4.41Å; N259-H264 PolarHBondContact N-O 3.28Å
260	H	98.5	Very high	98	Very high	65 Å²	65	36.8 Å²	36.8	30%	0.301	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-19.5	-173.8	-69.7	-82.4	0	0	0	114.3	A229 T231 Y456	A229-H260 PolarHBondContact O-CD2 3.28Å; A229-H260 PolarHBondContact O-N 3.12Å; T231-H260 VanDerWaalsContact CG2-NE2 3.32Å; T231-H260 WeakPolarHBondContact CG2-NE2 3.4Å; T231-H260 PolarHBondContact OG1-NE2 3.36Å; H260-Y456 HydrophobicContact CB-CD1 4.24Å; H260-Y456 PolarHBondContact CE1-O 3.22Å
261	R	98.1	Very high	98.1	Very high	168 Å²	168	39.2 Å²	39.2	63%	0.634	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-44	180	-178.5	59.3	166.5	-176.9	-3.2	112.5	E228 N259	E228-R261 HydrophobicContact CB-CB 4.22Å; E228-R261 HydrophobicContact CG-CB 3.81Å; E228-R261 HydrophobicContact CG-CG 3.99Å; N259-R261 VanDerWaalsContact C-N 3.29Å; N259-R261 PolarHBondContact O-N 3.14Å; N259-R261 WeakPolarHBondContact OD1-CB 3.4Å; N259-R261 PolarHBondContact OD1-N 2.75Å
262	T	97.7	Very high	97.9	Very high	39 Å²	39	42.5 Å²	42.5	24%	0.239	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-17.1	-171.8	64.7	0	0	0	0	113.4	P126 E228 N259 H264	P126-T262 HydrophobicContact CB-CG2 4.15Å; P126-T262 HydrophobicContact CG-CG2 4.17Å; E228-T262 VanDerWaalsContact OE1-CG2 3.24Å; E228-T262 WeakPolarHBondContact OE1-CG2 3.46Å; N259-T262 PolarHBondContact ND2-OG1 3.37Å; N259-T262 PolarHBondContact OD1-N 3.45Å; N259-T262 PolarHBondContact OD1-OG1 3.25Å; N259-T262 VanDerWaalsContact OD1-OG1 3.04Å; T262-H264 WeakPolarHBondContact CB-ND1 3.43Å; T262-H264 PolarHBondContact O-N 3.36Å; T262-H264 PolarHBondContact OG1-N 3.24Å; T262-H264 PolarHBondContact OG1-ND1 3.15Å
263	G	98	Very high	97.3	Very high	26 Å²	26	41.1 Å²	41.1	27%	0.268	22%	0.216	S	C	.	.			trans	73.7	8.5	-175.4	0	0	0	0	0	114.2	N259 K290	N259-G263 WeakPolarHBondContact O-CA 3.29Å; N259-G263 PolarHBondContact O-N 3Å; G263-K290 PolarHBondContact O-N 3.38Å
264	H	98.4	Very high	96.4	Very high	31 Å²	31	42.3 Å²	42.3	14%	0.144	23%	0.228	C	C	.	.			trans	-63.4	139.9	168.8	-72	88.8	0	0	0	109.8	M130 N259 T262 Q288	M130-H264 HydrophobicContact CE-CB 3.91Å; M130-H264 VanDerWaalsContact CE-O 3.28Å; M130-H264 WeakPolarHBondContact CE-O 3.28Å; N259-H264 HydrophobicContact CB-CB 4.41Å; N259-H264 PolarHBondContact N-O 3.28Å; T262-H264 WeakPolarHBondContact CB-ND1 3.43Å; T262-H264 PolarHBondContact O-N 3.36Å; T262-H264 PolarHBondContact OG1-N 3.24Å; T262-H264 PolarHBondContact OG1-ND1 3.15Å; H264-Q288 WeakPolarHBondContact CA-O 3.29Å
265	K	98.8	Very high	94.9	Very high	48 Å²	48	46.2 Å²	46.2	21%	0.209	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.9	176.4	-168.1	169.1	80.9	153	0	110.2	E256 I257 V267 I287 Q288	E256-K265 IonicContact OE1-NZ 2.91Å; E256-K265 PolarHBondContact OE1-NZ 2.73Å; E256-K265 IonicContact OE2-NZ 2.79Å; E256-K265 PolarHBondContact OE2-NZ 3.4Å; I257-K265 CarbonylContact O-C 3.6Å; I257-K265 VanDerWaalsContact O-CA 3.32Å; I257-K265 WeakPolarHBondContact O-CA 3.2Å; K265-V267 HydrophobicContact CD-CG2 4.42Å; K265-V267 HydrophobicContact CG-CG2 4.29Å; K265-I287 CarbonylContact O-C 3.59Å; K265-I287 WeakPolarHBondContact O-CA 3.5Å; K265-Q288 HydrophobicContact CB-CG 4.02Å; K265-Q288 PolarHBondContact N-O 3.46Å; K265-Q288 VanDerWaalsContact O-CG 3.31Å; K265-Q288 WeakPolarHBondContact O-CG 3.35Å; K265-Q288 PolarHBondContact O-N 3.06Å
266	C	98.9	Very high	93.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.2	164.8	-172.8	0	0	0	0	109	M130 A134 E256 I257 H286 I287	M130-C266 HydrophobicContact CG-CB 3.99Å; M130-C266 HydrophobicContact SD-CB 3.77Å; A134-C266 HydrophobicContact CB-CB 4.44Å; E256-C266 CarbonylContact C-O 3.53Å; E256-C266 WeakPolarHBondContact CA-O 3.46Å; I257-C266 HydrophobicContact CB-CB 4.14Å; I257-C266 HydrophobicContact CD1-CB 4.38Å; I257-C266 PolarHBondContact N-O 3.4Å; I257-C266 PolarHBondContact O-N 3.48Å; C266-H286 WeakPolarHBondContact CA-O 3.49Å; C266-I287 HydrophobicContact CB-CG1 4.02Å
267	V	98.8	Very high	92.6	Very high	9 Å²	9	52.4 Å²	52.4	6%	0.055	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	119.9	173.8	-177	0	0	0	0	107.3	T254 E256 K265 G285 H286	T254-V267 HydrophobicContact CG2-CG1 3.74Å; E256-V267 HydrophobicContact CG-CG1 4.45Å; E256-V267 HydrophobicContact CG-CG2 4.33Å; K265-V267 HydrophobicContact CD-CG2 4.42Å; K265-V267 HydrophobicContact CG-CG2 4.29Å; V267-G285 CarbonylContact O-C 3.54Å; V267-G285 WeakPolarHBondContact O-CA 3.38Å; V267-H286 PolarHBondContact N-O 3.08Å; V267-H286 PolarHBondContact O-N 3.1Å
268	L	98.8	Very high	91.7	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127	-179.7	-63.3	169.5	0	0	0	109.2	A134 V138 T254 V255 I257 F270 V283 I298	A134-L268 HydrophobicContact CB-CD1 4.33Å; V138-L268 HydrophobicContact CG2-CD1 3.69Å; T254-L268 CarbonylContact C-O 3.53Å; T254-L268 WeakPolarHBondContact CA-O 3.36Å; V255-L268 HydrophobicContact CB-CB 4.31Å; V255-L268 PolarHBondContact N-O 3.42Å; V255-L268 PolarHBondContact O-N 2.95Å; I257-L268 HydrophobicContact CD1-CD1 4.13Å; L268-F270 HydrophobicContact CB-CE2 4.38Å; L268-V283 HydrophobicContact CB-CG1 4.26Å; L268-V283 HydrophobicContact CD2-CG1 4.19Å; L268-I298 HydrophobicContact CD2-CB 4.14Å; L268-I298 HydrophobicContact CD2-CD1 4.21Å; L268-I298 HydrophobicContact CD2-CG2 3.97Å
269	H	98.4	Very high	91.1	Very high	63 Å²	63	60 Å²	60	29%	0.292	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	109.3	175.5	-57	-67.6	0	0	0	109.3	T254 K271 V283 E284	T254-H269 PolarHBondContact OG1-ND1 3.2Å; H269-K271 HydrophobicContact CB-CD 4.43Å; H269-K271 PolarHBondContact O-N 2.82Å; H269-V283 WeakPolarHBondContact O-CA 3.38Å; H269-E284 WeakPolarHBondContact CA-O 3.12Å; H269-E284 WeakPolarHBondContact CB-O 3.03Å; H269-E284 PolarHBondContact N-O 2.92Å; H269-E284 PolarHBondContact O-N 3.06Å; H269-E284 VanDerWaalsContact O-N 3.08Å
270	F	98.1	Very high	90.6	Very high	5 Å²	5	60.4 Å²	60.4	2%	0.022	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	107.8	166.5	-70.6	-110.4	0	0	0	106.9	V138 V141 P235 Q251 Y252 G253 V255 L268 V283 W302	V138-F270 HydrophobicContact CB-CZ 4.4Å; V138-F270 HydrophobicContact CG1-CE1 4.47Å; V138-F270 HydrophobicContact CG1-CZ 4.33Å; V138-F270 HydrophobicContact CG2-CE2 4.33Å; V138-F270 HydrophobicContact CG2-CZ 3.83Å; V141-F270 HydrophobicContact CG2-CE1 4.13Å; V141-F270 HydrophobicContact CG2-CZ 4.27Å; P235-F270 HydrophobicContact CB-CB 4.43Å; P235-F270 HydrophobicContact CB-CD1 4.25Å; P235-F270 HydrophobicContact CB-CD2 4.07Å; P235-F270 HydrophobicContact CB-CE2 4.37Å; P235-F270 HydrophobicContact CB-CG 4.01Å; P235-F270 HydrophobicContact CG-CD1 4.09Å; P235-F270 HydrophobicContact CG-CD2 4.33Å; P235-F270 HydrophobicContact CG-CE1 3.92Å; P235-F270 HydrophobicContact CG-CE2 4.19Å; P235-F270 HydrophobicContact CG-CG 4.29Å; P235-F270 HydrophobicContact CG-CZ 3.96Å; Q251-F270 HydrophobicContact CB-CD1 4.25Å; Y252-F270 VanDerWaalsContact CA-O 3.29Å; Y252-F270 WeakPolarHBondContact CA-O 3.45Å; G253-F270 PolarHBondContact N-O 2.99Å; G253-F270 PolarHBondContact O-N 3.26Å; V255-F270 HydrophobicContact CB-CE2 4.15Å; V255-F270 HydrophobicContact CG2-CD2 3.9Å; V255-F270 HydrophobicContact CG2-CE2 3.54Å; V255-F270 HydrophobicContact CG2-CZ 4.49Å; L268-F270 HydrophobicContact CB-CE2 4.38Å; F270-V283 HydrophobicContact CD1-CG2 3.74Å; F270-V283 HydrophobicContact CE1-CG2 3.85Å; F270-V283 HydrophobicContact CE2-CG1 4.48Å; F270-V283 HydrophobicContact CG-CG2 4.12Å; F270-V283 HydrophobicContact CZ-CG2 4.32Å; F270-W302 HydrophobicContact CD1-CB 4.37Å; F270-W302 AromaticContact CD1-CD1 3.8Å; F270-W302 HydrophobicContact CD1-CG 4.23Å; F270-W302 HydrophobicContact CE1-CB 3.89Å; F270-W302 HydrophobicContact CE1-CG 4.16Å
271	K	95.3	Very high	90.4	Very high	60 Å²	60	57.5 Å²	57.5	26%	0.261	30%	0.298	S	S	.	.			trans	-77	131.7	-172.8	-58.6	-67.6	-174.8	174.6	0	109.6	H269 E279 K282	H269-K271 HydrophobicContact CB-CD 4.43Å; H269-K271 PolarHBondContact O-N 2.82Å; K271-E279 HydrophobicContact CB-CB 3.97Å; K271-K282 HydrophobicContact CB-CB 4.16Å; K271-K282 HydrophobicContact CG-CB 4.01Å; K271-K282 PolarHBondContact N-O 3.38Å
272	P	91.8	Very high	90.3	Very high	73 Å²	73	52.2 Å²	52.2	47%	0.474	28%	0.28	S	S	.	.			trans	-66.3	153.3	165.3	31.1	-34.1	0	0	0	109.5	E250 Y252 G274 E279	E250-P272 VanDerWaalsContact OE1-CA 3.24Å; E250-P272 WeakPolarHBondContact OE1-CA 3.47Å; Y252-P272 HydrophobicContact CG-CB 4.42Å; P272-G274 PolarHBondContact O-N 3.37Å; P272-E279 VanDerWaalsContact O-CB 3.29Å; P272-E279 WeakPolarHBondContact O-CB 3.29Å
273	C	84.6	Confident	90.3	Very high	18 Å²	18	50.4 Å²	50.4	12%	0.122	27%	0.268	C	S	.	.			trans	-51.3	-36.3	-175.5	-174.1	0	0	0	0	111.2	W248 E250 G277 E279 L280	W248-C273 HydrophobicContact CH2-CB 4.33Å; E250-C273 WeakPolarHBondContact OE1-CA 3.36Å; E250-C273 WeakPolarHBondContact OE1-CB 3.01Å; E250-C273 PolarHBondContact OE1-N 3.12Å; C273-G277 CarbonylContact O-C 3.55Å; C273-G277 VanDerWaalsContact O-CA 3.29Å; C273-G277 WeakPolarHBondContact O-CA 3.21Å; C273-G277 WeakPolarHBondContact SG-CA 3.5Å; C273-E279 PolarHBondContact O-N 2.95Å; C273-L280 HydrophobicContact CB-CB 4.49Å; C273-L280 HydrophobicContact CB-CD1 3.89Å
274	G	78.3	Confident	90.3	Very high	52 Å²	52	51.2 Å²	51.2	54%	0.536	27%	0.265	S	S	.	.			trans	69.2	179.4	178.7	0	0	0	0	0	112.5	P272 F276 G277	P272-G274 PolarHBondContact O-N 3.37Å; G274-F276 PolarHBondContact O-N 2.99Å; G274-G277 PolarHBondContact O-N 3.4Å
275	L	67	Low	90.3	Very high	158 Å²	158	50.1 Å²	50.1	83%	0.827	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	130.4	170.5	-62.9	168.5	0	0	0	108.1	G277	L275-G277 PolarHBondContact O-N 2.79Å
276	F	71.9	Confident	90.3	Very high	197 Å²	197	49.1 Å²	49.1	86%	0.864	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	7.7	-178.4	-42.8	-76.5	0	0	0	117.3	G274 K278	G274-F276 PolarHBondContact O-N 2.99Å; F276-K278 PolarHBondContact O-N 3.02Å
277	G	76.3	Confident	90.3	Very high	25 Å²	25	49.1 Å²	49.1	26%	0.258	26%	0.258	S	S	.	.	S	Bend	trans	66.5	9.9	167.6	0	0	0	0	0	117.8	C273 G274 L275 E279 L280	C273-G277 CarbonylContact O-C 3.55Å; C273-G277 VanDerWaalsContact O-CA 3.29Å; C273-G277 WeakPolarHBondContact O-CA 3.21Å; C273-G277 WeakPolarHBondContact SG-CA 3.5Å; G274-G277 PolarHBondContact O-N 3.4Å; L275-G277 PolarHBondContact O-N 2.79Å; G277-E279 PolarHBondContact O-N 2.78Å; G277-L280 WeakPolarHBondContact O-CB 3.48Å; G277-L280 PolarHBondContact O-N 2.84Å
278	K	79.7	Confident	90.3	Very high	160 Å²	160	49.9 Å²	49.9	70%	0.696	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.3	-177.3	-67.7	-174.2	178.9	-178.3	0	113.9	F276 K282	F276-K278 PolarHBondContact O-N 3.02Å; K278-K282 WeakPolarHBondContact O-CE 3.41Å; K278-K282 PolarHBondContact O-NZ 2.94Å
279	E	86.4	Confident	90.2	Very high	62 Å²	62	51.3 Å²	51.3	29%	0.29	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	3	-174.9	-62.6	-58.5	117.3	0	0	112.7	K271 P272 C273 G277 H281 K282	K271-E279 HydrophobicContact CB-CB 3.97Å; P272-E279 VanDerWaalsContact O-CB 3.29Å; P272-E279 WeakPolarHBondContact O-CB 3.29Å; C273-E279 PolarHBondContact O-N 2.95Å; G277-E279 PolarHBondContact O-N 2.78Å; E279-H281 PolarHBondContact O-N 2.82Å; E279-K282 WeakPolarHBondContact O-CB 3.42Å; E279-K282 PolarHBondContact O-N 2.93Å; E279-K282 IonicContact OE1-NZ 2.89Å; E279-K282 PolarHBondContact OE1-NZ 2.91Å; E279-K282 WeakPolarHBondContact OE2-CD 3.33Å; E279-K282 IonicContact OE2-NZ 3.61Å
280	L	89.4	Confident	90.1	Very high	10 Å²	10	55.7 Å²	55.7	5%	0.052	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	125.9	-175.5	-176	67.7	0	0	0	112	W248 C273 G277 K282 K301 P348	W248-L280 HydrophobicContact CH2-CD1 4.34Å; W248-L280 HydrophobicContact CZ3-CD1 3.69Å; C273-L280 HydrophobicContact CB-CB 4.49Å; C273-L280 HydrophobicContact CB-CD1 3.89Å; G277-L280 WeakPolarHBondContact O-CB 3.48Å; G277-L280 PolarHBondContact O-N 2.84Å; L280-K282 PolarHBondContact O-N 3.5Å; L280-K282 VanDerWaalsContact O-N 3.11Å; L280-K301 WeakPolarHBondContact O-CE 3.02Å; L280-P348 HydrophobicContact CD2-CB 3.42Å; L280-P348 VanDerWaalsContact CD2-CB 3.42Å; L280-P348 HydrophobicContact CD2-CG 3.76Å
281	H	93.8	Very high	90	Very high	3 Å²	3	61.2 Å²	61.2	1%	0.014	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	63	3.7	-179.1	-47.6	154.6	0	0	0	115.9	W145 E279 V283 K301 W302 T303	W145-H281 AromaticContact CD2-CE1 3.79Å; W145-H281 AromaticContact CE3-CE1 3.37Å; W145-H281 AromaticContact CE3-NE2 3.51Å; W145-H281 AromaticContact CH2-CE1 3.63Å; W145-H281 AromaticContact CZ3-CE1 3.29Å; W145-H281 WeakPolarHBondContact CZ3-CE1 3.19Å; W145-H281 AromaticContact CZ3-NE2 3.32Å; W145-H281 VanDerWaalsContact CZ3-NE2 3.32Å; W145-H281 WeakPolarHBondContact CZ3-NE2 3.24Å; E279-H281 PolarHBondContact O-N 2.82Å; H281-V283 PolarHBondContact O-N 3.28Å; H281-K301 HydrophobicContact CB-CB 4.34Å; H281-K301 HydrophobicContact CB-CG 4.43Å; H281-K301 WeakPolarHBondContact O-CA 3.28Å; H281-W302 HydrophobicContact CB-CG 4.46Å; H281-W302 AromaticContact CD2-CE2 3.73Å; H281-W302 AromaticContact CD2-CZ2 3.46Å; H281-W302 VanDerWaalsContact CD2-CZ2 3.46Å; H281-W302 WeakPolarHBondContact CD2-CZ2 3.12Å; H281-W302 AromaticContact CD2-NE1 3.75Å; H281-W302 AromaticContact CG-CE2 3.94Å; H281-W302 AromaticContact CG-NE1 3.9Å; H281-W302 AromaticContact NE2-CZ2 3.88Å; H281-W302 PolarHBondContact O-N 3.05Å; H281-W302 VanDerWaalsContact O-N 3.1Å; H281-T303 HydrophobicContact CB-CG2 4.03Å; H281-T303 VanDerWaalsContact ND1-CG2 3.27Å; H281-T303 WeakPolarHBondContact ND1-CG2 3.47Å; H281-T303 PolarHBondContact ND1-OG1 3.23Å
282	K	95.9	Very high	90.1	Very high	58 Å²	58	66.1 Å²	66.1	25%	0.252	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	137.6	-178.6	-72.2	-171.9	-171.6	163.6	0	110.7	K271 K278 E279 L280 G300 K301	K271-K282 HydrophobicContact CB-CB 4.16Å; K271-K282 HydrophobicContact CG-CB 4.01Å; K271-K282 PolarHBondContact N-O 3.38Å; K278-K282 WeakPolarHBondContact O-CE 3.41Å; K278-K282 PolarHBondContact O-NZ 2.94Å; E279-K282 WeakPolarHBondContact O-CB 3.42Å; E279-K282 PolarHBondContact O-N 2.93Å; E279-K282 IonicContact OE1-NZ 2.89Å; E279-K282 PolarHBondContact OE1-NZ 2.91Å; E279-K282 WeakPolarHBondContact OE2-CD 3.33Å; E279-K282 IonicContact OE2-NZ 3.61Å; L280-K282 PolarHBondContact O-N 3.5Å; L280-K282 VanDerWaalsContact O-N 3.11Å; K282-G300 WeakPolarHBondContact CA-O 3.25Å; K282-K301 HydrophobicContact CG-CG 4.3Å
283	V	98	Very high	90.4	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.8	168.1	-176.9	0	0	0	0	107	V138 L268 H269 F270 H281 Y299 G300 W302 L306	V138-V283 HydrophobicContact CG1-CG2 4.43Å; V138-V283 HydrophobicContact CG2-CG1 4.34Å; L268-V283 HydrophobicContact CB-CG1 4.26Å; L268-V283 HydrophobicContact CD2-CG1 4.19Å; H269-V283 WeakPolarHBondContact O-CA 3.38Å; F270-V283 HydrophobicContact CD1-CG2 3.74Å; F270-V283 HydrophobicContact CE1-CG2 3.85Å; F270-V283 HydrophobicContact CE2-CG1 4.48Å; F270-V283 HydrophobicContact CG-CG2 4.12Å; F270-V283 HydrophobicContact CZ-CG2 4.32Å; H281-V283 PolarHBondContact O-N 3.28Å; V283-Y299 CarbonylContact O-C 3.57Å; V283-Y299 VanDerWaalsContact O-CA 3.24Å; V283-Y299 WeakPolarHBondContact O-CA 3.43Å; V283-G300 PolarHBondContact N-O 3.35Å; V283-G300 PolarHBondContact O-N 2.95Å; V283-W302 HydrophobicContact CG2-CB 3.87Å; V283-W302 HydrophobicContact CG2-CG 4.42Å; V283-L306 HydrophobicContact CB-CD2 4.16Å; V283-L306 HydrophobicContact CG1-CD2 4.29Å
284	E	97.6	Very high	91	Very high	43 Å²	43	73.4 Å²	73.4	20%	0.201	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	141.7	173.5	-71.5	-171.5	152.3	0	0	109.4	H269 I298 Y314 K318	H269-E284 WeakPolarHBondContact CA-O 3.12Å; H269-E284 WeakPolarHBondContact CB-O 3.03Å; H269-E284 PolarHBondContact N-O 2.92Å; H269-E284 PolarHBondContact O-N 3.06Å; H269-E284 VanDerWaalsContact O-N 3.08Å; E284-I298 CarbonylContact C-O 3.34Å; E284-I298 WeakPolarHBondContact CA-O 3.38Å; E284-Y314 PolarHBondContact OE1-OH 3.45Å; E284-K318 IonicContact OE1-NZ 2.78Å; E284-K318 PolarHBondContact OE1-NZ 2.96Å; E284-K318 VanDerWaalsContact OE1-NZ 3.12Å
285	G	98.3	Very high	92	Very high	9 Å²	9	73 Å²	73	9%	0.093	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	-172.8	-175.2	0	0	0	0	0	113.5	V267 I298	V267-G285 CarbonylContact O-C 3.54Å; V267-G285 WeakPolarHBondContact O-CA 3.38Å; G285-I298 PolarHBondContact N-O 3.06Å; G285-I298 PolarHBondContact O-N 3.14Å
286	H	98.8	Very high	93.5	Very high	26 Å²	26	66.5 Å²	66.5	12%	0.12	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	157.6	177.7	64.6	-91.2	0	0	0	111.8	C266 V267 Q288 K294 F296	C266-H286 WeakPolarHBondContact CA-O 3.49Å; V267-H286 PolarHBondContact N-O 3.08Å; V267-H286 PolarHBondContact O-N 3.1Å; H286-Q288 PolarHBondContact NE2-OE1 3.28Å; H286-K294 HydrophobicContact CB-CD 4.45Å; H286-F296 CarbonylContact C-O 3.55Å; H286-F296 WeakPolarHBondContact CA-O 3.48Å; H286-F296 VanDerWaalsContact CB-O 3.28Å; H286-F296 WeakPolarHBondContact CB-O 3.44Å
287	I	98.9	Very high	94.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136	166.2	-55.8	169.8	0	0	0	107.9	L127 M130 Q131 K265 C266 L295 F296 I298	L127-I287 HydrophobicContact CD1-CB 3.99Å; L127-I287 HydrophobicContact CD1-CD1 3.99Å; L127-I287 HydrophobicContact CD1-CG2 3.61Å; M130-I287 HydrophobicContact CB-CD1 4.12Å; M130-I287 HydrophobicContact CB-CG2 4.28Å; M130-I287 HydrophobicContact CG-CB 4.46Å; M130-I287 HydrophobicContact CG-CD1 3.8Å; M130-I287 HydrophobicContact CG-CG1 3.93Å; M130-I287 HydrophobicContact CG-CG2 3.7Å; Q131-I287 HydrophobicContact CB-CD1 4.35Å; Q131-I287 HydrophobicContact CG-CD1 3.63Å; K265-I287 CarbonylContact O-C 3.59Å; K265-I287 WeakPolarHBondContact O-CA 3.5Å; C266-I287 HydrophobicContact CB-CG1 4.02Å; I287-L295 PolarHBondContact O-N 3.02Å; I287-F296 HydrophobicContact CB-CB 4.17Å; I287-F296 HydrophobicContact CD1-CB 4.23Å; I287-F296 HydrophobicContact CD1-CD1 4.09Å; I287-F296 HydrophobicContact CG1-CB 4.45Å; I287-F296 PolarHBondContact N-O 3.08Å; I287-F296 PolarHBondContact O-N 3.25Å; I287-I298 HydrophobicContact CD1-CD1 4.09Å; I287-I298 HydrophobicContact CG1-CD1 4.07Å
288	Q	98.6	Very high	95.8	Very high	26 Å²	26	56.5 Å²	56.5	12%	0.121	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.4	177	57.4	-179.4	58.3	0	0	111.4	H264 K265 H286 K293	H264-Q288 WeakPolarHBondContact CA-O 3.29Å; K265-Q288 HydrophobicContact CB-CG 4.02Å; K265-Q288 PolarHBondContact N-O 3.46Å; K265-Q288 VanDerWaalsContact O-CG 3.31Å; K265-Q288 WeakPolarHBondContact O-CG 3.35Å; K265-Q288 PolarHBondContact O-N 3.06Å; H286-Q288 PolarHBondContact NE2-OE1 3.28Å; Q288-K293 WeakPolarHBondContact CA-O 3.41Å; Q288-K293 WeakPolarHBondContact CB-O 3.42Å
289	D	97.4	Very high	96.7	Very high	29 Å²	29	49.5 Å²	49.5	16%	0.155	23%	0.23	C	C	.	.			trans	-76.9	178.7	169.3	69.6	13.5	0	0	0	112	N291 K292 K293 L295	D289-N291 PolarHBondContact O-N 3.41Å; D289-N291 VanDerWaalsContact O-N 3.15Å; D289-N291 VanDerWaalsContact OD1-C 3.25Å; D289-N291 VanDerWaalsContact OD1-CA 3.26Å; D289-N291 WeakPolarHBondContact OD1-CA 3.49Å; D289-N291 WeakPolarHBondContact OD1-CB 3.38Å; D289-N291 PolarHBondContact OD1-N 2.96Å; D289-K292 PolarHBondContact O-N 3.15Å; D289-K292 PolarHBondContact OD1-N 3.25Å; D289-K292 VanDerWaalsContact OD1-N 3.08Å; D289-K293 PolarHBondContact N-O 3.3Å; D289-K293 VanDerWaalsContact N-O 3.07Å; D289-K293 WeakPolarHBondContact OD1-CB 3.27Å; D289-K293 PolarHBondContact OD1-N 2.65Å; D289-K293 WeakPolarHBondContact OD2-CB 3.48Å; D289-L295 HydrophobicContact CB-CD1 4.09Å
290	K	95.8	Very high	97.2	Very high	156 Å²	156	46.8 Å²	46.8	68%	0.678	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-23	175.8	68.1	179.8	-176.4	178.1	0	114.2	G263 K292	G263-K290 PolarHBondContact O-N 3.38Å; K290-K292 VanDerWaalsContact C-N 3.28Å
291	N	96.8	Very high	97.6	Very high	121 Å²	121	47.7 Å²	47.7	65%	0.647	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	10	177.9	-57.4	-41.7	0	0	0	112	D289 K293	D289-N291 PolarHBondContact O-N 3.41Å; D289-N291 VanDerWaalsContact O-N 3.15Å; D289-N291 VanDerWaalsContact OD1-C 3.25Å; D289-N291 VanDerWaalsContact OD1-CA 3.26Å; D289-N291 WeakPolarHBondContact OD1-CA 3.49Å; D289-N291 WeakPolarHBondContact OD1-CB 3.38Å; D289-N291 PolarHBondContact OD1-N 2.96Å; N291-K293 PolarHBondContact O-N 3.37Å
292	K	96.8	Very high	97.7	Very high	162 Å²	162	47.5 Å²	47.5	70%	0.704	22%	0.222	S	C	*	.			trans	63.8	17.3	-177.3	-48.9	-178.7	-180	178.3	0	113.8	D289 K290 K294	D289-K292 PolarHBondContact O-N 3.15Å; D289-K292 PolarHBondContact OD1-N 3.25Å; D289-K292 VanDerWaalsContact OD1-N 3.08Å; K290-K292 VanDerWaalsContact C-N 3.28Å; K292-K294 PolarHBondContact O-N 3.19Å
293	K	97.7	Very high	97.7	Very high	138 Å²	138	45.4 Å²	45.4	60%	0.6	21%	0.214	S	C	*	.			trans	-72.6	122.3	172	-177.3	-175.8	175.2	-177.3	0	108.6	Q288 D289 N291 L295	Q288-K293 WeakPolarHBondContact CA-O 3.41Å; Q288-K293 WeakPolarHBondContact CB-O 3.42Å; D289-K293 PolarHBondContact N-O 3.3Å; D289-K293 VanDerWaalsContact N-O 3.07Å; D289-K293 WeakPolarHBondContact OD1-CB 3.27Å; D289-K293 PolarHBondContact OD1-N 2.65Å; D289-K293 WeakPolarHBondContact OD2-CB 3.48Å; N291-K293 PolarHBondContact O-N 3.37Å; K293-L295 HydrophobicContact CD-CD2 4.2Å; K293-L295 HydrophobicContact CG-CD2 4.27Å; K293-L295 PolarHBondContact O-N 3.27Å
294	K	98.1	Very high	97.6	Very high	107 Å²	107	46.2 Å²	46.2	47%	0.465	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	125.9	173.6	-65	-173	178.7	-177.7	0	109.8	H286 K292 P311	H286-K294 HydrophobicContact CB-CD 4.45Å; K292-K294 PolarHBondContact O-N 3.19Å; K294-P311 HydrophobicContact CB-CG 4.2Å
295	L	98.4	Very high	97.6	Very high	44 Å²	44	44.3 Å²	44.3	23%	0.23	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-29.6	-178.6	-58.8	-176.6	0	0	0	112.4	L127 I287 D289 K293 P311	L127-L295 HydrophobicContact CD1-CB 3.9Å; L127-L295 HydrophobicContact CD1-CD1 4.16Å; L127-L295 HydrophobicContact CD2-CB 4.08Å; L127-L295 HydrophobicContact CD2-CD1 4.47Å; I287-L295 PolarHBondContact O-N 3.02Å; D289-L295 HydrophobicContact CB-CD1 4.09Å; K293-L295 HydrophobicContact CD-CD2 4.2Å; K293-L295 HydrophobicContact CG-CD2 4.27Å; K293-L295 PolarHBondContact O-N 3.27Å; L295-P311 WeakPolarHBondContact O-CD 3.43Å
296	F	98.6	Very high	97.6	Very high	20 Å²	20	43.9 Å²	43.9	9%	0.088	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	141.6	-173.7	-160.9	-114.1	0	0	0	110.1	L127 Q131 H286 I287 I298 G308 I309 L363	L127-F296 HydrophobicContact CD1-CB 4.11Å; Q131-F296 HydrophobicContact CG-CD1 3.7Å; Q131-F296 HydrophobicContact CG-CE1 3.63Å; Q131-F296 HydrophobicContact CG-CG 4.38Å; Q131-F296 HydrophobicContact CG-CZ 4.31Å; H286-F296 CarbonylContact C-O 3.55Å; H286-F296 WeakPolarHBondContact CA-O 3.48Å; H286-F296 VanDerWaalsContact CB-O 3.28Å; H286-F296 WeakPolarHBondContact CB-O 3.44Å; I287-F296 HydrophobicContact CB-CB 4.17Å; I287-F296 HydrophobicContact CD1-CB 4.23Å; I287-F296 HydrophobicContact CD1-CD1 4.09Å; I287-F296 HydrophobicContact CG1-CB 4.45Å; I287-F296 PolarHBondContact N-O 3.08Å; I287-F296 PolarHBondContact O-N 3.25Å; F296-I298 HydrophobicContact CD1-CG1 3.97Å; F296-I298 HydrophobicContact CE1-CG1 4.27Å; F296-G308 VanDerWaalsContact CE1-CA 3.47Å; F296-G308 VanDerWaalsContact CZ-CA 3.48Å; F296-I309 WeakPolarHBondContact CD2-O 3.37Å; F296-L363 HydrophobicContact CE1-CD1 4.08Å; F296-L363 HydrophobicContact CE1-CD2 4.2Å; F296-L363 HydrophobicContact CZ-CD2 4.42Å
297	V	98.7	Very high	97.6	Very high	12 Å²	12	44.3 Å²	44.3	7%	0.073	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.8	174.8	177.2	0	0	0	0	108.6	G308 I309 P311 Y314	V297-G308 CarbonylContact O-C 3.54Å; V297-G308 WeakPolarHBondContact O-CA 3.22Å; V297-I309 HydrophobicContact CB-CG2 4.31Å; V297-I309 PolarHBondContact N-O 3.47Å; V297-I309 PolarHBondContact O-N 3Å; V297-P311 HydrophobicContact CG2-CB 4.16Å; V297-P311 HydrophobicContact CG2-CG 4.26Å; V297-Y314 HydrophobicContact CB-CD2 4.22Å; V297-Y314 HydrophobicContact CB-CG 4.11Å; V297-Y314 HydrophobicContact CG1-CD1 3.93Å; V297-Y314 HydrophobicContact CG1-CD2 3.57Å; V297-Y314 HydrophobicContact CG1-CE1 3.99Å; V297-Y314 HydrophobicContact CG1-CE2 3.63Å; V297-Y314 HydrophobicContact CG1-CG 3.71Å; V297-Y314 HydrophobicContact CG2-CD1 4.29Å; V297-Y314 HydrophobicContact CG2-CG 4.17Å
298	I	98.7	Very high	97.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135	176.5	-62.2	177.4	0	0	0	107.9	A134 L268 E284 G285 I287 F296 L306 W307 L363	A134-I298 HydrophobicContact CB-CD1 3.69Å; L268-I298 HydrophobicContact CD2-CB 4.14Å; L268-I298 HydrophobicContact CD2-CD1 4.21Å; L268-I298 HydrophobicContact CD2-CG2 3.97Å; E284-I298 CarbonylContact C-O 3.34Å; E284-I298 WeakPolarHBondContact CA-O 3.38Å; G285-I298 PolarHBondContact N-O 3.06Å; G285-I298 PolarHBondContact O-N 3.14Å; I287-I298 HydrophobicContact CD1-CD1 4.09Å; I287-I298 HydrophobicContact CG1-CD1 4.07Å; F296-I298 HydrophobicContact CD1-CG1 3.97Å; F296-I298 HydrophobicContact CE1-CG1 4.27Å; I298-L306 HydrophobicContact CG2-CD1 4.37Å; I298-L306 HydrophobicContact CG2-CD2 3.92Å; I298-W307 WeakPolarHBondContact CA-O 3.32Å; I298-L363 HydrophobicContact CD1-CD1 4.17Å; I298-L363 HydrophobicContact CG1-CD1 3.96Å; I298-L363 HydrophobicContact CG2-CD1 4.19Å
299	Y	98.4	Very high	97.5	Very high	13 Å²	13	43.2 Å²	43.2	5%	0.051	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	154.4	176.2	72.7	-83.6	0	0	0	111.4	V283 W307 I309 Y314 V354 I357 S360	V283-Y299 CarbonylContact O-C 3.57Å; V283-Y299 VanDerWaalsContact O-CA 3.24Å; V283-Y299 WeakPolarHBondContact O-CA 3.43Å; Y299-W307 HydrophobicContact CD1-CB 4.24Å; Y299-W307 HydrophobicContact CE1-CB 3.67Å; Y299-W307 HydrophobicContact CE2-CB 3.99Å; Y299-W307 HydrophobicContact CE2-CG 4.36Å; Y299-W307 PolarHBondContact N-O 2.96Å; Y299-W307 PolarHBondContact O-N 2.91Å; Y299-I309 HydrophobicContact CE1-CG2 4.25Å; Y299-Y314 HydrophobicContact CD1-CD2 4.37Å; Y299-Y314 HydrophobicContact CD1-CE2 4.03Å; Y299-Y314 HydrophobicContact CG-CE2 4.28Å; Y299-V354 HydrophobicContact CD2-CG1 4.22Å; Y299-V354 HydrophobicContact CE2-CG1 3.97Å; Y299-I357 HydrophobicContact CD1-CD1 4.38Å; Y299-I357 HydrophobicContact CE1-CB 4.48Å; Y299-I357 HydrophobicContact CE1-CD1 3.94Å; Y299-I357 HydrophobicContact CE1-CG1 4.28Å; Y299-I357 HydrophobicContact CE2-CD1 4.42Å; Y299-I357 HydrophobicContact CE2-CG1 4.32Å; Y299-I357 PolarHBondContact OH-N 3.39Å; Y299-S360 WeakPolarHBondContact OH-CB 3.39Å; Y299-S360 PolarHBondContact OH-OG 3.47Å
300	G	97.5	Very high	97.5	Very high	6 Å²	6	45 Å²	45	6%	0.062	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.5	-149.8	176.8	0	0	0	0	0	112.1	K282 V283 C305	K282-G300 WeakPolarHBondContact CA-O 3.25Å; V283-G300 PolarHBondContact N-O 3.35Å; V283-G300 PolarHBondContact O-N 2.95Å; G300-C305 CarbonylContact C-O 3.56Å; G300-C305 WeakPolarHBondContact CA-O 3.38Å
301	K	97	Very high	97.6	Very high	28 Å²	28	38.9 Å²	38.9	12%	0.122	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	133	175.7	-74.2	179	167.4	-165	0	110.2	L280 H281 K282 T303 E304 C305 T353 V354	L280-K301 WeakPolarHBondContact O-CE 3.02Å; H281-K301 HydrophobicContact CB-CB 4.34Å; H281-K301 HydrophobicContact CB-CG 4.43Å; H281-K301 WeakPolarHBondContact O-CA 3.28Å; K282-K301 HydrophobicContact CG-CG 4.3Å; K301-T303 PolarHBondContact O-N 3.09Å; K301-T303 VanDerWaalsContact O-N 3.1Å; K301-E304 HydrophobicContact CB-CB 4.22Å; K301-E304 HydrophobicContact CB-CG 4.43Å; K301-E304 WeakPolarHBondContact CD-OE1 3.41Å; K301-E304 IonicContact NZ-OE1 3.85Å; K301-E304 PolarHBondContact O-N 3.16Å; K301-C305 PolarHBondContact N-O 2.86Å; K301-C305 PolarHBondContact O-N 3.16Å; K301-C305 VanDerWaalsContact O-O 3.07Å; K301-T353 PolarHBondContact NZ-OG1 2.77Å; K301-V354 HydrophobicContact CB-CG2 4.06Å; K301-V354 HydrophobicContact CD-CG2 3.92Å; K301-V354 HydrophobicContact CG-CG2 3.79Å
302	W	96.9	Very high	97.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.3	-178.9	65.4	-99.7	0	0	0	113.2	V138 A142 Q144 W145 I249 Q251 F270 H281 V283 W364	V138-W302 HydrophobicContact CG1-CB 3.81Å; A142-W302 VanDerWaalsContact CB-O 3.25Å; A142-W302 WeakPolarHBondContact CB-O 3.27Å; Q144-W302 HydrophobicContact CB-CZ3 4.41Å; W145-W302 HydrophobicContact CB-CH2 4.01Å; W145-W302 HydrophobicContact CB-CZ3 3.94Å; W145-W302 HydrophobicContact CE3-CH2 4.39Å; I249-W302 HydrophobicContact CG2-CH2 4.42Å; Q251-W302 HydrophobicContact CB-CZ2 4.23Å; Q251-W302 HydrophobicContact CG-CH2 4.39Å; Q251-W302 HydrophobicContact CG-CZ2 4.13Å; F270-W302 HydrophobicContact CD1-CB 4.37Å; F270-W302 AromaticContact CD1-CD1 3.8Å; F270-W302 HydrophobicContact CD1-CG 4.23Å; F270-W302 HydrophobicContact CE1-CB 3.89Å; F270-W302 HydrophobicContact CE1-CG 4.16Å; H281-W302 HydrophobicContact CB-CG 4.46Å; H281-W302 AromaticContact CD2-CE2 3.73Å; H281-W302 AromaticContact CD2-CZ2 3.46Å; H281-W302 VanDerWaalsContact CD2-CZ2 3.46Å; H281-W302 WeakPolarHBondContact CD2-CZ2 3.12Å; H281-W302 AromaticContact CD2-NE1 3.75Å; H281-W302 AromaticContact CG-CE2 3.94Å; H281-W302 AromaticContact CG-NE1 3.9Å; H281-W302 AromaticContact NE2-CZ2 3.88Å; H281-W302 PolarHBondContact O-N 3.05Å; H281-W302 VanDerWaalsContact O-N 3.1Å; V283-W302 HydrophobicContact CG2-CB 3.87Å; V283-W302 HydrophobicContact CG2-CG 4.42Å; W302-W364 VanDerWaalsContact O-CH2 3.28Å; W302-W364 WeakPolarHBondContact O-CH2 3.46Å
303	T	95.7	Very high	97.6	Very high	13 Å²	13	32.9 Å²	32.9	8%	0.08	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-5.4	174.1	55.7	0	0	0	0	114.5	W145 H281 K301	W145-T303 HydrophobicContact CB-CG2 3.78Å; W145-T303 HydrophobicContact CD2-CG2 4.23Å; W145-T303 HydrophobicContact CG-CG2 3.87Å; H281-T303 HydrophobicContact CB-CG2 4.03Å; H281-T303 VanDerWaalsContact ND1-CG2 3.27Å; H281-T303 WeakPolarHBondContact ND1-CG2 3.47Å; H281-T303 PolarHBondContact ND1-OG1 3.23Å; K301-T303 PolarHBondContact O-N 3.09Å; K301-T303 VanDerWaalsContact O-N 3.1Å
304	E	95.4	Very high	97.6	Very high	18 Å²	18	27.3 Å²	27.3	8%	0.084	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.4	-67.8	-170.6	-65.8	170.7	-138.5	0	0	112	K301 E352 T353 R365 I366	K301-E304 HydrophobicContact CB-CB 4.22Å; K301-E304 HydrophobicContact CB-CG 4.43Å; K301-E304 WeakPolarHBondContact CD-OE1 3.41Å; K301-E304 IonicContact NZ-OE1 3.85Å; K301-E304 PolarHBondContact O-N 3.16Å; E304-E352 WeakPolarHBondContact OE2-CA 3.33Å; E304-T353 PolarHBondContact OE2-N 3.05Å; E304-R365 WeakPolarHBondContact O-CA 3.31Å; E304-I366 WeakPolarHBondContact O-CG2 3.43Å; E304-I366 PolarHBondContact O-N 3.07Å
305	C	97.1	Very high	97.4	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.02	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	164	-172.3	61.7	0	0	0	0	112.8	G300 K301 W307 L362 W364 R365	G300-C305 CarbonylContact C-O 3.56Å; G300-C305 WeakPolarHBondContact CA-O 3.38Å; K301-C305 PolarHBondContact N-O 2.86Å; K301-C305 PolarHBondContact O-N 3.16Å; K301-C305 VanDerWaalsContact O-O 3.07Å; C305-W307 PolarHBondContact SG-NE1 3.06Å; C305-L362 HydrophobicContact CB-CD1 4.33Å; C305-W364 CarbonylContact C-O 3.45Å; C305-W364 VanDerWaalsContact CA-O 3.25Å; C305-W364 WeakPolarHBondContact CA-O 3.5Å; C305-W364 VanDerWaalsContact CB-O 3.28Å; C305-W364 WeakPolarHBondContact CB-O 3.4Å; C305-R365 HydrophobicContact CB-CB 4.2Å; C305-R365 HydrophobicContact CB-CG 4.32Å
306	L	98.4	Very high	97.2	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.6	169.1	-77.2	-179.9	0	0	0	111.1	V138 V283 I298 L363 W364	V138-L306 HydrophobicContact CB-CD1 3.57Å; V138-L306 HydrophobicContact CB-CG 4.42Å; V138-L306 HydrophobicContact CG1-CD1 3.81Å; V138-L306 HydrophobicContact CG1-CD2 4.43Å; V138-L306 HydrophobicContact CG1-CG 4.12Å; V138-L306 HydrophobicContact CG2-CD1 3.7Å; V283-L306 HydrophobicContact CB-CD2 4.16Å; V283-L306 HydrophobicContact CG1-CD2 4.29Å; I298-L306 HydrophobicContact CG2-CD1 4.37Å; I298-L306 HydrophobicContact CG2-CD2 3.92Å; L306-L363 HydrophobicContact CB-CB 4.2Å; L306-L363 PolarHBondContact O-N 2.97Å; L306-W364 HydrophobicContact CB-CE3 4.18Å; L306-W364 HydrophobicContact CD1-CE3 4.37Å; L306-W364 HydrophobicContact CG-CE3 3.93Å; L306-W364 HydrophobicContact CG-CZ3 4.44Å; L306-W364 PolarHBondContact N-O 2.76Å; L306-W364 PolarHBondContact O-N 3.46Å
307	W	98.6	Very high	97	Very high	35 Å²	35	27.6 Å²	27.6	13%	0.133	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	160.4	172.9	-63.8	87.5	0	0	0	109.7	I298 Y299 C305 V356 K361 L362	I298-W307 WeakPolarHBondContact CA-O 3.32Å; Y299-W307 HydrophobicContact CD1-CB 4.24Å; Y299-W307 HydrophobicContact CE1-CB 3.67Å; Y299-W307 HydrophobicContact CE2-CB 3.99Å; Y299-W307 HydrophobicContact CE2-CG 4.36Å; Y299-W307 PolarHBondContact N-O 2.96Å; Y299-W307 PolarHBondContact O-N 2.91Å; C305-W307 PolarHBondContact SG-NE1 3.06Å; W307-V356 HydrophobicContact CD2-CG1 4.09Å; W307-V356 HydrophobicContact CD2-CG2 4.37Å; W307-V356 HydrophobicContact CE3-CG1 3.94Å; W307-V356 HydrophobicContact CH2-CG1 4.07Å; W307-V356 HydrophobicContact CH2-CG2 4.23Å; W307-V356 HydrophobicContact CZ2-CG1 4.2Å; W307-V356 HydrophobicContact CZ2-CG2 3.63Å; W307-V356 HydrophobicContact CZ3-CG1 3.94Å; W307-K361 CarbonylContact C-O 3.55Å; W307-K361 WeakPolarHBondContact CA-O 3.37Å; W307-L362 HydrophobicContact CD2-CD1 4.03Å; W307-L362 HydrophobicContact CE3-CB 3.95Å; W307-L362 HydrophobicContact CE3-CD1 4.31Å; W307-L362 HydrophobicContact CH2-CB 3.98Å; W307-L362 HydrophobicContact CH2-CD1 4.06Å; W307-L362 HydrophobicContact CH2-CG 4.49Å; W307-L362 HydrophobicContact CZ2-CD1 3.75Å; W307-L362 HydrophobicContact CZ3-CB 3.66Å; W307-L362 HydrophobicContact CZ3-CD1 4.32Å
308	G	98.1	Very high	96.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	157.1	166.2	0	0	0	0	0	113.6	F296 V297 S360 K361	F296-G308 VanDerWaalsContact CE1-CA 3.47Å; F296-G308 VanDerWaalsContact CZ-CA 3.48Å; V297-G308 CarbonylContact O-C 3.54Å; V297-G308 WeakPolarHBondContact O-CA 3.22Å; G308-S360 CarbonylContact O-C 3.53Å; G308-S360 WeakPolarHBondContact O-CA 3.3Å; G308-K361 PolarHBondContact N-O 2.73Å; G308-K361 PolarHBondContact O-N 2.91Å
309	I	98.3	Very high	96.3	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	160.4	-171.7	-169.2	170.4	0	0	0	109.3	F296 V297 Y299 Y314 I357 P358	F296-I309 WeakPolarHBondContact CD2-O 3.37Å; V297-I309 HydrophobicContact CB-CG2 4.31Å; V297-I309 PolarHBondContact N-O 3.47Å; V297-I309 PolarHBondContact O-N 3Å; Y299-I309 HydrophobicContact CE1-CG2 4.25Å; I309-Y314 HydrophobicContact CG2-CD2 3.81Å; I309-Y314 HydrophobicContact CG2-CG 4.27Å; I309-I357 HydrophobicContact CD1-CB 4.29Å; I309-I357 HydrophobicContact CD1-CG2 3.66Å; I309-P358 WeakPolarHBondContact CD1-O 3.29Å
310	D	97.3	Very high	95.8	Very high	66 Å²	66	41.2 Å²	41.2	35%	0.353	21%	0.213	S	C	.	.			trans	-64.2	149.3	172.2	78	88.8	0	0	0	111.4	V312 S313 Y314	D310-V312 VanDerWaalsContact C-N 3.3Å; D310-V312 PolarHBondContact O-N 3Å; D310-V312 WeakPolarHBondContact OD1-CA 3.42Å; D310-V312 WeakPolarHBondContact OD1-CB 3.19Å; D310-V312 PolarHBondContact OD1-N 3.15Å; D310-S313 VanDerWaalsContact CG-OG 3.31Å; D310-S313 PolarHBondContact O-N 3.18Å; D310-S313 PolarHBondContact OD1-N 3.29Å; D310-S313 PolarHBondContact OD1-OG 3.35Å; D310-S313 WeakPolarHBondContact OD2-CB 3.24Å; D310-S313 PolarHBondContact OD2-OG 3Å; D310-Y314 PolarHBondContact O-N 3.49Å
311	P	97.7	Very high	95.2	Very high	28 Å²	28	44.1 Å²	44.1	18%	0.182	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-30.5	-176.4	-24.7	34.3	0	0	0	114.9	K294 L295 V297 E315	K294-P311 HydrophobicContact CB-CG 4.2Å; L295-P311 WeakPolarHBondContact O-CD 3.43Å; V297-P311 HydrophobicContact CG2-CB 4.16Å; V297-P311 HydrophobicContact CG2-CG 4.26Å; P311-E315 WeakPolarHBondContact O-CB 3.28Å; P311-E315 VanDerWaalsContact O-CG 3.29Å; P311-E315 WeakPolarHBondContact O-CG 3.38Å; P311-E315 PolarHBondContact O-N 2.78Å; P311-E315 VanDerWaalsContact O-N 3.07Å
312	V	96.9	Very high	94.6	Very high	108 Å²	108	50.7 Å²	50.7	66%	0.655	25%	0.249	S	C	*	.	H	α-helix	trans	-71.9	-44.4	-175.7	178.8	0	0	0	0	110.1	D310 S316	D310-V312 VanDerWaalsContact C-N 3.3Å; D310-V312 PolarHBondContact O-N 3Å; D310-V312 WeakPolarHBondContact OD1-CA 3.42Å; D310-V312 WeakPolarHBondContact OD1-CB 3.19Å; D310-V312 PolarHBondContact OD1-N 3.15Å; V312-S316 WeakPolarHBondContact O-CB 3.4Å; V312-S316 PolarHBondContact O-N 3.01Å; V312-S316 PolarHBondContact O-OG 3.1Å
313	S	96.9	Very high	93.7	Very high	48 Å²	48	59.6 Å²	59.6	34%	0.336	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-41.7	175.9	-59.9	0	0	0	0	111.6	D310 S316 F317	D310-S313 VanDerWaalsContact CG-OG 3.31Å; D310-S313 PolarHBondContact O-N 3.18Å; D310-S313 PolarHBondContact OD1-N 3.29Å; D310-S313 PolarHBondContact OD1-OG 3.35Å; D310-S313 WeakPolarHBondContact OD2-CB 3.24Å; D310-S313 PolarHBondContact OD2-OG 3Å; S313-S316 PolarHBondContact O-N 3.25Å; S313-F317 WeakPolarHBondContact O-CB 3.45Å; S313-F317 PolarHBondContact O-N 3.01Å
314	Y	96.1	Very high	92.5	Very high	22 Å²	22	60.4 Å²	60.4	9%	0.086	29%	0.293	C	S	.	.	H	α-helix	trans	-59.9	-48.5	176.4	-171.1	-96.1	0	0	0	112.9	E284 V297 Y299 I309 D310 S316 F317 K318 I357	E284-Y314 PolarHBondContact OE1-OH 3.45Å; V297-Y314 HydrophobicContact CB-CD2 4.22Å; V297-Y314 HydrophobicContact CB-CG 4.11Å; V297-Y314 HydrophobicContact CG1-CD1 3.93Å; V297-Y314 HydrophobicContact CG1-CD2 3.57Å; V297-Y314 HydrophobicContact CG1-CE1 3.99Å; V297-Y314 HydrophobicContact CG1-CE2 3.63Å; V297-Y314 HydrophobicContact CG1-CG 3.71Å; V297-Y314 HydrophobicContact CG2-CD1 4.29Å; V297-Y314 HydrophobicContact CG2-CG 4.17Å; Y299-Y314 HydrophobicContact CD1-CD2 4.37Å; Y299-Y314 HydrophobicContact CD1-CE2 4.03Å; Y299-Y314 HydrophobicContact CG-CE2 4.28Å; I309-Y314 HydrophobicContact CG2-CD2 3.81Å; I309-Y314 HydrophobicContact CG2-CG 4.27Å; D310-Y314 PolarHBondContact O-N 3.49Å; Y314-S316 VanDerWaalsContact C-N 3.31Å; Y314-S316 PolarHBondContact O-N 2.94Å; Y314-F317 PolarHBondContact O-N 2.91Å; Y314-K318 HydrophobicContact CD1-CG 4.08Å; Y314-K318 HydrophobicContact CE1-CD 4.4Å; Y314-K318 HydrophobicContact CE1-CG 3.72Å; Y314-K318 PolarHBondContact O-N 2.86Å; Y314-K318 WeakPolarHBondContact OH-CE 3.36Å; Y314-K318 PolarHBondContact OH-NZ 3.17Å; Y314-I357 HydrophobicContact CD2-CD1 3.47Å; Y314-I357 VanDerWaalsContact CD2-CD1 3.47Å; Y314-I357 HydrophobicContact CE2-CD1 3.62Å
315	E	94.7	Very high	91.2	Very high	88 Å²	88	64.3 Å²	64.3	41%	0.411	32%	0.315	S	S	.	.	H	α-helix	trans	-65.2	-37.3	179.6	-72.7	-66.9	171.3	0	0	111.8	P311 F317 K319	P311-E315 WeakPolarHBondContact O-CB 3.28Å; P311-E315 VanDerWaalsContact O-CG 3.29Å; P311-E315 WeakPolarHBondContact O-CG 3.38Å; P311-E315 PolarHBondContact O-N 2.78Å; P311-E315 VanDerWaalsContact O-N 3.07Å; E315-F317 VanDerWaalsContact C-N 3.35Å; E315-K319 WeakPolarHBondContact O-CB 2.87Å; E315-K319 VanDerWaalsContact O-CG 3.25Å; E315-K319 WeakPolarHBondContact O-CG 3.36Å; E315-K319 PolarHBondContact O-N 3.39Å
316	S	95.1	Very high	89.5	Confident	55 Å²	55	71 Å²	71	39%	0.385	35%	0.346	S	S	.	.	H	α-helix	trans	-62.3	-43.7	175.6	-60.3	0	0	0	0	111.2	V312 S313 Y314 Q320	V312-S316 WeakPolarHBondContact O-CB 3.4Å; V312-S316 PolarHBondContact O-N 3.01Å; V312-S316 PolarHBondContact O-OG 3.1Å; S313-S316 PolarHBondContact O-N 3.25Å; Y314-S316 VanDerWaalsContact C-N 3.31Å; Y314-S316 PolarHBondContact O-N 2.94Å; S316-Q320 WeakPolarHBondContact O-CG 3.22Å; S316-Q320 PolarHBondContact O-N 3.49Å
317	F	93.5	Very high	87.7	Confident	33 Å²	33	76.8 Å²	76.8	15%	0.145	38%	0.376	C	S	.	.	H	α-helix	trans	-64.8	-51.2	176.5	-178.3	-93.1	0	0	0	112.3	S313 Y314 E315 K319 Q320 E321 I357	S313-F317 WeakPolarHBondContact O-CB 3.45Å; S313-F317 PolarHBondContact O-N 3.01Å; Y314-F317 PolarHBondContact O-N 2.91Å; E315-F317 VanDerWaalsContact C-N 3.35Å; F317-K319 PolarHBondContact O-N 3.03Å; F317-Q320 WeakPolarHBondContact O-CB 3.44Å; F317-Q320 PolarHBondContact O-N 3.09Å; F317-E321 HydrophobicContact CD1-CG 4.08Å; F317-E321 VanDerWaalsContact CE1-CD 3.46Å; F317-E321 HydrophobicContact CE1-CG 3.55Å; F317-E321 WeakPolarHBondContact CE1-OE2 3.26Å; F317-E321 HydrophobicContact CE2-CG 4.45Å; F317-E321 HydrophobicContact CZ-CG 3.76Å; F317-E321 PolarHBondContact O-N 3.3Å; F317-I357 HydrophobicContact CB-CG2 3.8Å; F317-I357 HydrophobicContact CD1-CD1 3.69Å; F317-I357 HydrophobicContact CD1-CG1 3.68Å; F317-I357 HydrophobicContact CD1-CG2 4.16Å; F317-I357 HydrophobicContact CD2-CG1 4.48Å; F317-I357 HydrophobicContact CD2-CG2 3.82Å; F317-I357 HydrophobicContact CE1-CD1 4.12Å; F317-I357 HydrophobicContact CE1-CG1 3.75Å; F317-I357 HydrophobicContact CE2-CG2 4.45Å; F317-I357 HydrophobicContact CG-CB 4.42Å; F317-I357 HydrophobicContact CG-CD1 4.24Å; F317-I357 HydrophobicContact CG-CG1 4.06Å; F317-I357 HydrophobicContact CG-CG2 3.65Å; F317-I357 HydrophobicContact CZ-CG1 4.18Å
318	K	90.4	Very high	85.9	Confident	55 Å²	55	83.7 Å²	83.7	24%	0.239	40%	0.402	C	S	.	.	H	α-helix	trans	-59.7	-33.3	179	-73.2	-71.5	-167.6	175.8	0	112.5	E284 Y314 R322	E284-K318 IonicContact OE1-NZ 2.78Å; E284-K318 PolarHBondContact OE1-NZ 2.96Å; E284-K318 VanDerWaalsContact OE1-NZ 3.12Å; Y314-K318 HydrophobicContact CD1-CG 4.08Å; Y314-K318 HydrophobicContact CE1-CD 4.4Å; Y314-K318 HydrophobicContact CE1-CG 3.72Å; Y314-K318 PolarHBondContact O-N 2.86Å; Y314-K318 WeakPolarHBondContact OH-CE 3.36Å; Y314-K318 PolarHBondContact OH-NZ 3.17Å; K318-R322 VanDerWaalsContact O-CG 3.32Å; K318-R322 WeakPolarHBondContact O-CG 3.34Å; K318-R322 PolarHBondContact O-N 2.91Å; K318-R322 VanDerWaalsContact O-N 3.16Å
319	K	91.4	Very high	84	Confident	126 Å²	126	90.7 Å²	90.7	55%	0.548	43%	0.432	S	S	.	.	H	α-helix	trans	-67	-39.7	173.3	-75.8	173.3	-175	175.3	0	112.6	E315 F317 R323	E315-K319 WeakPolarHBondContact O-CB 2.87Å; E315-K319 VanDerWaalsContact O-CG 3.25Å; E315-K319 WeakPolarHBondContact O-CG 3.36Å; E315-K319 PolarHBondContact O-N 3.39Å; F317-K319 PolarHBondContact O-N 3.03Å; K319-R323 WeakPolarHBondContact O-CG 3.04Å; K319-R323 PolarHBondContact O-N 2.84Å
320	Q	88.8	Confident	81.9	Confident	131 Å²	131	93.9 Å²	93.9	61%	0.612	46%	0.459	S	S	*	.	H	α-helix	trans	-67.5	-43.2	177.1	-70.8	174.5	12.5	0	0	111.5	S316 F317 R322 R323 G324	S316-Q320 WeakPolarHBondContact O-CG 3.22Å; S316-Q320 PolarHBondContact O-N 3.49Å; F317-Q320 WeakPolarHBondContact O-CB 3.44Å; F317-Q320 PolarHBondContact O-N 3.09Å; Q320-R322 PolarHBondContact O-N 2.8Å; Q320-R323 PolarHBondContact O-N 2.71Å; Q320-G324 PolarHBondContact O-N 3.49Å
321	E	85.6	Confident	79.7	Confident	66 Å²	66	99 Å²	99	31%	0.308	48%	0.478	S	S	.	.	H	α-helix	trans	-60.3	-46.8	176.7	-72.5	-136.6	116.7	0	0	112.2	F317 R323 G324 D325 Q355	F317-E321 HydrophobicContact CD1-CG 4.08Å; F317-E321 VanDerWaalsContact CE1-CD 3.46Å; F317-E321 HydrophobicContact CE1-CG 3.55Å; F317-E321 WeakPolarHBondContact CE1-OE2 3.26Å; F317-E321 HydrophobicContact CE2-CG 4.45Å; F317-E321 HydrophobicContact CZ-CG 3.76Å; F317-E321 PolarHBondContact O-N 3.3Å; E321-R323 VanDerWaalsContact C-N 3.29Å; E321-R323 PolarHBondContact O-N 2.68Å; E321-G324 CarbonylContact O-C 3.5Å; E321-G324 WeakPolarHBondContact O-CA 3.34Å; E321-G324 PolarHBondContact O-N 3.49Å; E321-D325 PolarHBondContact O-N 2.83Å; E321-Q355 PolarHBondContact OE1-NE2 3.22Å; E321-Q355 VanDerWaalsContact OE1-NE2 3.1Å; E321-Q355 PolarHBondContact OE1-OE1 3.46Å
322	R	84.4	Confident	77.6	Confident	167 Å²	167	103.3 Å²	103.3	63%	0.63	50%	0.499	S	S	*	.	H	α-helix	trans	-58	-41.2	176.4	-71.4	175.3	-173.4	176.3	4.5	112	K318 Q320 D325 H326	K318-R322 VanDerWaalsContact O-CG 3.32Å; K318-R322 WeakPolarHBondContact O-CG 3.34Å; K318-R322 PolarHBondContact O-N 2.91Å; K318-R322 VanDerWaalsContact O-N 3.16Å; Q320-R322 PolarHBondContact O-N 2.8Å; R322-D325 PolarHBondContact O-N 2.86Å; R322-H326 PolarHBondContact O-CD2 3.01Å; R322-H326 PolarHBondContact O-N 3.05Å
323	R	77.6	Confident	75.2	Confident	186 Å²	186	104.6 Å²	104.6	70%	0.702	50%	0.503	S	S	*	.	H	α-helix	trans	-64.1	-41.8	175	-73	176.9	177.9	-175.1	-0.8	111.7	K319 Q320 E321 H326 L327	K319-R323 WeakPolarHBondContact O-CG 3.04Å; K319-R323 PolarHBondContact O-N 2.84Å; Q320-R323 PolarHBondContact O-N 2.71Å; E321-R323 VanDerWaalsContact C-N 3.29Å; E321-R323 PolarHBondContact O-N 2.68Å; R323-H326 PolarHBondContact O-N 3.13Å; R323-L327 WeakPolarHBondContact O-CD1 3.21Å; R323-L327 WeakPolarHBondContact O-CG 3.25Å; R323-L327 PolarHBondContact O-N 2.97Å; R323-L327 VanDerWaalsContact O-N 3.1Å
324	G	71.1	Confident	72.9	Confident	31 Å²	31	109.6 Å²	109.6	32%	0.32	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-41.4	176.3	0	0	0	0	0	113.1	Q320 E321 L327 R328	Q320-G324 PolarHBondContact O-N 3.49Å; E321-G324 CarbonylContact O-C 3.5Å; E321-G324 WeakPolarHBondContact O-CA 3.34Å; E321-G324 PolarHBondContact O-N 3.49Å; G324-L327 PolarHBondContact O-N 3.26Å; G324-R328 WeakPolarHBondContact O-CG 3.44Å; G324-R328 PolarHBondContact O-N 2.89Å
325	D	66.9	Low	70.4	Confident	100 Å²	100	112.6 Å²	112.6	54%	0.535	55%	0.549	S	S	.	.	H	α-helix	trans	-66.2	-40.6	175.5	-84.1	-8.8	0	0	0	112.1	E321 R322 L327 R328 K329	E321-D325 PolarHBondContact O-N 2.83Å; R322-D325 PolarHBondContact O-N 2.86Å; D325-L327 VanDerWaalsContact C-N 3.32Å; D325-L327 PolarHBondContact O-N 2.77Å; D325-R328 PolarHBondContact O-N 2.94Å; D325-K329 WeakPolarHBondContact O-CB 3.44Å; D325-K329 PolarHBondContact O-N 3.31Å
326	H	61.8	Low	67.8	Low	143 Å²	143	114.5 Å²	114.5	66%	0.662	57%	0.573	S	S	*	*	H	α-helix	trans	-60.2	-41.2	173.3	-81	-66.4	0	0	0	112.1	R322 R323 A330	R322-H326 PolarHBondContact O-CD2 3.01Å; R322-H326 PolarHBondContact O-N 3.05Å; R323-H326 PolarHBondContact O-N 3.13Å; H326-A330 VanDerWaalsContact O-CB 3.31Å; H326-A330 WeakPolarHBondContact O-CB 3.27Å; H326-A330 PolarHBondContact O-N 3.16Å
327	L	60.4	Low	65	Low	122 Å²	122	115.2 Å²	115.2	64%	0.639	59%	0.589	S	S	*	*	H	α-helix	trans	-68.5	-35.5	176.2	-76.3	157.6	0	0	0	112.8	R323 G324 D325 K331	R323-L327 WeakPolarHBondContact O-CD1 3.21Å; R323-L327 WeakPolarHBondContact O-CG 3.25Å; R323-L327 PolarHBondContact O-N 2.97Å; R323-L327 VanDerWaalsContact O-N 3.1Å; G324-L327 PolarHBondContact O-N 3.26Å; D325-L327 VanDerWaalsContact C-N 3.32Å; D325-L327 PolarHBondContact O-N 2.77Å; L327-K331 PolarHBondContact O-N 2.93Å
328	R	59.9	Low	62.7	Low	179 Å²	179	124 Å²	124	68%	0.675	63%	0.627	S	S	*	*	H	α-helix	trans	-69.6	-44.3	174.7	-76.9	177.7	174.6	177.9	-2.1	111.5	G324 D325 A330 K331 L332	G324-R328 WeakPolarHBondContact O-CG 3.44Å; G324-R328 PolarHBondContact O-N 2.89Å; D325-R328 PolarHBondContact O-N 2.94Å; R328-A330 VanDerWaalsContact C-N 3.35Å; R328-A330 PolarHBondContact O-N 2.76Å; R328-K331 PolarHBondContact O-N 3.49Å; R328-K331 VanDerWaalsContact O-N 3.12Å; R328-L332 WeakPolarHBondContact O-CD1 3.29Å; R328-L332 PolarHBondContact O-N 2.75Å; R328-L332 VanDerWaalsContact O-N 3.15Å
329	K	59.5	Low	60	Low	148 Å²	148	126.1 Å²	126.1	64%	0.643	66%	0.655	S	S	*	*	H	α-helix	trans	-64.6	-39.3	178.4	-157.6	172.5	-176.9	-179.8	0	111.7	D325 K331 L332 D333	D325-K329 WeakPolarHBondContact O-CB 3.44Å; D325-K329 PolarHBondContact O-N 3.31Å; K329-K331 PolarHBondContact O-N 3.19Å; K329-L332 PolarHBondContact O-N 3.41Å; K329-L332 VanDerWaalsContact O-N 3.15Å; K329-D333 PolarHBondContact O-N 3.11Å
330	A	54.2	Low	57.3	Low	70 Å²	70	128.2 Å²	128.2	58%	0.579	67%	0.672	S	S	*	*	H	α-helix	trans	-64.2	-23.2	173.4	0	0	0	0	0	114.2	H326 R328	H326-A330 VanDerWaalsContact O-CB 3.31Å; H326-A330 WeakPolarHBondContact O-CB 3.27Å; H326-A330 PolarHBondContact O-N 3.16Å; R328-A330 VanDerWaalsContact C-N 3.35Å; R328-A330 PolarHBondContact O-N 2.76Å
331	K	51.7	Low	54.9	Low	172 Å²	172	127.1 Å²	127.1	75%	0.748	68%	0.678	S	S	*	*	H	α-helix	trans	-85.6	-24.9	173	-78.1	-174.9	176.2	-174.4	0	113.7	L327 R328 K329	L327-K331 PolarHBondContact O-N 2.93Å; R328-K331 PolarHBondContact O-N 3.49Å; R328-K331 VanDerWaalsContact O-N 3.12Å; K329-K331 PolarHBondContact O-N 3.19Å
332	L	51.8	Low	52.7	Low	119 Å²	119	131.5 Å²	131.5	62%	0.623	70%	0.704	S	S	*	*	H	α-helix	trans	-80.7	-24.2	178	-94.5	126.7	0	0	0	112.9	R328 K329 D334 S335	R328-L332 WeakPolarHBondContact O-CD1 3.29Å; R328-L332 PolarHBondContact O-N 2.75Å; R328-L332 VanDerWaalsContact O-N 3.15Å; K329-L332 PolarHBondContact O-N 3.41Å; K329-L332 VanDerWaalsContact O-N 3.15Å; L332-D334 PolarHBondContact O-N 2.67Å; L332-D334 VanDerWaalsContact O-N 3.14Å; L332-S335 PolarHBondContact O-N 3.41Å
333	D	48.3	Very low	50.8	Low	136 Å²	136	129.7 Å²	129.7	73%	0.727	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-5.5	174.5	-76	-19	0	0	0	113.8	K329	K329-D333 PolarHBondContact O-N 3.11Å
334	D	47.5	Very low	49.4	Very low	152 Å²	152	125.1 Å²	125.1	81%	0.813	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	4.9	174.7	-152.2	25.4	0	0	0	113.2	L332	L332-D334 PolarHBondContact O-N 2.67Å; L332-D334 VanDerWaalsContact O-N 3.14Å
335	S	44.9	Very low	48.3	Very low	85 Å²	85	128.1 Å²	128.1	59%	0.594	72%	0.722	S	S	*	*	S	Bend	trans	-146.8	80.8	177	46.5	0	0	0	0	111.8	L332 G337	L332-S335 PolarHBondContact O-N 3.41Å; S335-G337 PolarHBondContact O-N 3.04Å
336	S	39.5	Very low	47.8	Very low	129 Å²	129	130 Å²	130	90%	0.902	73%	0.732	S	S	*	*			trans	-74.1	108.4	177.5	61.1	0	0	0	0	112
337	G	36.5	Very low	47.6	Very low	70 Å²	70	124.9 Å²	124.9	72%	0.722	71%	0.711	S	S	*	*			trans	-124	119.1	162	0	0	0	0	0	109.6	S335	S335-G337 PolarHBondContact O-N 3.04Å
338	K	43.6	Very low	47.6	Very low	218 Å²	218	120.9 Å²	120.9	95%	0.948	69%	0.692	S	S	*	*			trans	-62.2	137.5	175.7	-72.3	178.6	173.8	-179.9	0	110.2
339	A	34.8	Very low	47.4	Very low	99 Å²	99	118.1 Å²	118.1	82%	0.818	70%	0.695	S	S	*	*			trans	-123	126.3	164.2	0	0	0	0	0	109
340	D	33.6	Very low	47	Very low	169 Å²	169	113.5 Å²	113.5	90%	0.904	68%	0.684	S	S	*	*			trans	-61	142	176.3	-84.1	-43	0	0	0	111.7
341	S	39.3	Very low	46.9	Very low	108 Å²	108	116.5 Å²	116.5	76%	0.755	69%	0.686	S	S	*	*			trans	-91.1	99.9	174	55.9	0	0	0	0	109.8
342	D	39.5	Very low	47.1	Very low	158 Å²	158	115.8 Å²	115.8	85%	0.845	69%	0.686	S	S	*	*			trans	-145.5	93	157.9	-89.6	-30.1	0	0	0	108.4
343	V	43.7	Very low	48.3	Very low	130 Å²	130	113.4 Å²	113.4	79%	0.788	68%	0.676	S	S	*	*			trans	-147.9	97	166.6	-122.3	0	0	0	0	108.7
344	A	48.6	Very low	50	Low	90 Å²	90	108.3 Å²	108.3	74%	0.744	65%	0.65	S	S	*	*			trans	-145	102.9	166.1	0	0	0	0	0	108.3
345	D	47.9	Very low	52	Low	93 Å²	93	106.3 Å²	106.3	50%	0.497	64%	0.636	S	S	.	*	S	Bend	trans	145.1	0.1	153.6	-80.3	-11	0	0	0	114.5
346	D	56.5	Low	54.3	Low	141 Å²	141	105.4 Å²	105.4	75%	0.754	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-75	135.4	175.9	-81.9	-26.4	0	0	0	113.3	P348	D346-P348 WeakPolarHBondContact O-CD 3.47Å
347	V	57.8	Low	56.9	Low	34 Å²	34	99.7 Å²	99.7	21%	0.206	59%	0.586	C	S	.	*	P	Polyproline II helix	trans	-66.2	122.8	171	176.1	0	0	0	0	108.6	K246 W248 V349	K246-V347 HydrophobicContact CB-CG2 3.69Å; K246-V347 HydrophobicContact CD-CG2 3.77Å; K246-V347 HydrophobicContact CG-CG2 3.8Å; W248-V347 HydrophobicContact CB-CG1 4.3Å; V347-V349 PolarHBondContact O-N 3.01Å
348	P	60.5	Low	59.6	Low	38 Å²	38	101.3 Å²	101.3	25%	0.247	58%	0.584	C	S	.	*	P	Polyproline II helix	trans	-64.7	132.5	179.8	-17.9	30	0	0	0	110.5	L280 D346 A350	L280-P348 HydrophobicContact CD2-CB 3.42Å; L280-P348 VanDerWaalsContact CD2-CB 3.42Å; L280-P348 HydrophobicContact CD2-CG 3.76Å; D346-P348 WeakPolarHBondContact O-CD 3.47Å; P348-A350 PolarHBondContact O-N 3.03Å
349	V	55.2	Low	62.1	Low	122 Å²	122	94.6 Å²	94.6	74%	0.739	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-74.2	125.9	-178.9	-176.8	0	0	0	0	110.1	V347 Q351	V347-V349 PolarHBondContact O-N 3.01Å; V349-Q351 HydrophobicContact CG1-CG 4.21Å; V349-Q351 PolarHBondContact O-N 3.18Å
350	A	51.8	Low	65.1	Low	51 Å²	51	91 Å²	91	42%	0.421	55%	0.545	S	S	.	.			trans	-79.4	107.6	171.4	0	0	0	0	0	110	W145 P348	W145-A350 HydrophobicContact CZ2-CB 4.25Å; P348-A350 PolarHBondContact O-N 3.03Å
351	Q	51.7	Low	68.1	Low	132 Å²	132	87.6 Å²	87.6	62%	0.617	52%	0.522	S	S	*	.			trans	-110.3	145.9	168.5	-71.1	176.4	-16.8	0	0	108.5	V349 T353	V349-Q351 HydrophobicContact CG1-CG 4.21Å; V349-Q351 PolarHBondContact O-N 3.18Å; Q351-T353 HydrophobicContact CB-CG2 3.64Å; Q351-T353 VanDerWaalsContact O-CB 3.28Å; Q351-T353 WeakPolarHBondContact O-CB 3.27Å; Q351-T353 WeakPolarHBondContact O-CG2 3.4Å; Q351-T353 PolarHBondContact O-N 3Å; Q351-T353 PolarHBondContact O-OG1 3.43Å
352	E	56.8	Low	70.9	Confident	158 Å²	158	85.9 Å²	85.9	74%	0.738	50%	0.504	S	S	*	.			trans	-57.5	106.3	168.2	-86.4	-162.1	140	0	0	108.6	E304 R365	E304-E352 WeakPolarHBondContact OE2-CA 3.33Å; E352-R365 IonicContact OE1-NH1 3.52Å; E352-R365 PolarHBondContact OE1-NH1 2.85Å
353	T	75.7	Confident	73.7	Confident	68 Å²	68	78.4 Å²	78.4	42%	0.417	46%	0.464	S	S	.	.			trans	-137.2	0.3	-162.5	41.2	0	0	0	0	112.8	K301 E304 Q351 Q355	K301-T353 PolarHBondContact NZ-OG1 2.77Å; E304-T353 PolarHBondContact OE2-N 3.05Å; Q351-T353 HydrophobicContact CB-CG2 3.64Å; Q351-T353 VanDerWaalsContact O-CB 3.28Å; Q351-T353 WeakPolarHBondContact O-CB 3.27Å; Q351-T353 WeakPolarHBondContact O-CG2 3.4Å; Q351-T353 PolarHBondContact O-N 3Å; Q351-T353 PolarHBondContact O-OG1 3.43Å; T353-Q355 PolarHBondContact O-N 3.22Å
354	V	84.3	Confident	76.3	Confident	29 Å²	29	72.4 Å²	72.4	18%	0.176	43%	0.427	C	S	.	.			trans	-70.4	105.5	175.3	-176.5	0	0	0	0	109.1	Y299 K301 V356	Y299-V354 HydrophobicContact CD2-CG1 4.22Å; Y299-V354 HydrophobicContact CE2-CG1 3.97Å; K301-V354 HydrophobicContact CB-CG2 4.06Å; K301-V354 HydrophobicContact CD-CG2 3.92Å; K301-V354 HydrophobicContact CG-CG2 3.79Å; V354-V356 PolarHBondContact O-N 3.09Å
355	Q	89	Confident	78.7	Confident	110 Å²	110	72.6 Å²	72.6	51%	0.514	41%	0.409	S	S	.	.			trans	-65.6	114.1	171.2	-174.9	-178.9	6.6	0	0	109.5	E321 T353 I357	E321-Q355 PolarHBondContact OE1-NE2 3.22Å; E321-Q355 VanDerWaalsContact OE1-NE2 3.1Å; E321-Q355 PolarHBondContact OE1-OE1 3.46Å; T353-Q355 PolarHBondContact O-N 3.22Å; Q355-I357 PolarHBondContact O-N 2.83Å
356	V	93.4	Very high	81	Confident	67 Å²	67	70.2 Å²	70.2	41%	0.406	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-77.6	118.7	179.7	-173.6	0	0	0	0	109.2	W307 V354	W307-V356 HydrophobicContact CD2-CG1 4.09Å; W307-V356 HydrophobicContact CD2-CG2 4.37Å; W307-V356 HydrophobicContact CE3-CG1 3.94Å; W307-V356 HydrophobicContact CH2-CG1 4.07Å; W307-V356 HydrophobicContact CH2-CG2 4.23Å; W307-V356 HydrophobicContact CZ2-CG1 4.2Å; W307-V356 HydrophobicContact CZ2-CG2 3.63Å; W307-V356 HydrophobicContact CZ3-CG1 3.94Å; V354-V356 PolarHBondContact O-N 3.09Å
357	I	94.8	Very high	82.8	Confident	8 Å²	8	67.3 Å²	67.3	4%	0.041	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-72.5	127.1	174.9	-57.3	175.1	0	0	0	107.7	Y299 I309 Y314 F317 Q355 G359 S360	Y299-I357 HydrophobicContact CD1-CD1 4.38Å; Y299-I357 HydrophobicContact CE1-CB 4.48Å; Y299-I357 HydrophobicContact CE1-CD1 3.94Å; Y299-I357 HydrophobicContact CE1-CG1 4.28Å; Y299-I357 HydrophobicContact CE2-CD1 4.42Å; Y299-I357 HydrophobicContact CE2-CG1 4.32Å; Y299-I357 PolarHBondContact OH-N 3.39Å; I309-I357 HydrophobicContact CD1-CB 4.29Å; I309-I357 HydrophobicContact CD1-CG2 3.66Å; Y314-I357 HydrophobicContact CD2-CD1 3.47Å; Y314-I357 VanDerWaalsContact CD2-CD1 3.47Å; Y314-I357 HydrophobicContact CE2-CD1 3.62Å; F317-I357 HydrophobicContact CB-CG2 3.8Å; F317-I357 HydrophobicContact CD1-CD1 3.69Å; F317-I357 HydrophobicContact CD1-CG1 3.68Å; F317-I357 HydrophobicContact CD1-CG2 4.16Å; F317-I357 HydrophobicContact CD2-CG1 4.48Å; F317-I357 HydrophobicContact CD2-CG2 3.82Å; F317-I357 HydrophobicContact CE1-CD1 4.12Å; F317-I357 HydrophobicContact CE1-CG1 3.75Å; F317-I357 HydrophobicContact CE2-CG2 4.45Å; F317-I357 HydrophobicContact CG-CB 4.42Å; F317-I357 HydrophobicContact CG-CD1 4.24Å; F317-I357 HydrophobicContact CG-CG1 4.06Å; F317-I357 HydrophobicContact CG-CG2 3.65Å; F317-I357 HydrophobicContact CZ-CG1 4.18Å; Q355-I357 PolarHBondContact O-N 2.83Å; I357-G359 PolarHBondContact O-N 3.37Å; I357-S360 WeakPolarHBondContact O-CB 3.4Å; I357-S360 PolarHBondContact O-N 3.43Å; I357-S360 PolarHBondContact O-OG 3.36Å
358	P	93.9	Very high	84.5	Confident	105 Å²	105	72 Å²	72	68%	0.682	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	134.6	177.6	-28	35.6	0	0	0	112.4	I309	I309-P358 WeakPolarHBondContact CD1-O 3.29Å
359	G	94.8	Very high	86.1	Confident	77 Å²	77	72.5 Å²	72.5	79%	0.794	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	-0.7	-175	0	0	0	0	0	114.9	I357	I357-G359 PolarHBondContact O-N 3.37Å
360	S	97.8	Very high	88	Confident	22 Å²	22	67.6 Å²	67.6	15%	0.154	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-73.1	144.9	176	-60	0	0	0	0	113	Y299 G308 I357	Y299-S360 WeakPolarHBondContact OH-CB 3.39Å; Y299-S360 PolarHBondContact OH-OG 3.47Å; G308-S360 CarbonylContact O-C 3.53Å; G308-S360 WeakPolarHBondContact O-CA 3.3Å; I357-S360 WeakPolarHBondContact O-CB 3.4Å; I357-S360 PolarHBondContact O-N 3.43Å; I357-S360 PolarHBondContact O-OG 3.36Å
361	K	97.5	Very high	89.9	Confident	98 Å²	98	71.9 Å²	71.9	43%	0.426	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.7	173.1	177.4	-176.6	175.7	-174.1	0	109.7	Q131 W307 G308 L363	Q131-K361 VanDerWaalsContact OE1-NZ 3.07Å; W307-K361 CarbonylContact C-O 3.55Å; W307-K361 WeakPolarHBondContact CA-O 3.37Å; G308-K361 PolarHBondContact N-O 2.73Å; G308-K361 PolarHBondContact O-N 2.91Å; K361-L363 HydrophobicContact CD-CD2 4.31Å; K361-L363 HydrophobicContact CG-CD2 4.35Å; K361-L363 PolarHBondContact O-N 3.05Å
362	L	98.3	Very high	91.9	Very high	72 Å²	72	68 Å²	68	38%	0.377	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	127	171.6	-176.8	67	0	0	0	109.5	C305 W307 W364	C305-L362 HydrophobicContact CB-CD1 4.33Å; W307-L362 HydrophobicContact CD2-CD1 4.03Å; W307-L362 HydrophobicContact CE3-CB 3.95Å; W307-L362 HydrophobicContact CE3-CD1 4.31Å; W307-L362 HydrophobicContact CH2-CB 3.98Å; W307-L362 HydrophobicContact CH2-CD1 4.06Å; W307-L362 HydrophobicContact CH2-CG 4.49Å; W307-L362 HydrophobicContact CZ2-CD1 3.75Å; W307-L362 HydrophobicContact CZ3-CB 3.66Å; W307-L362 HydrophobicContact CZ3-CD1 4.32Å; L362-W364 WeakPolarHBondContact CD1-O 3.22Å
363	L	98.5	Very high	93.7	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-42.6	177.8	-55.8	-178.7	0	0	0	111.5	R119 Q131 A135 F296 I298 L306 K361	R119-L363 PolarHBondContact NH1-O 2.84Å; R119-L363 PolarHBondContact NH2-O 2.79Å; Q131-L363 HydrophobicContact CB-CD2 4.21Å; A135-L363 HydrophobicContact CB-CB 4.04Å; F296-L363 HydrophobicContact CE1-CD1 4.08Å; F296-L363 HydrophobicContact CE1-CD2 4.2Å; F296-L363 HydrophobicContact CZ-CD2 4.42Å; I298-L363 HydrophobicContact CD1-CD1 4.17Å; I298-L363 HydrophobicContact CG1-CD1 3.96Å; I298-L363 HydrophobicContact CG2-CD1 4.19Å; L306-L363 HydrophobicContact CB-CB 4.2Å; L306-L363 PolarHBondContact O-N 2.97Å; K361-L363 HydrophobicContact CD-CD2 4.31Å; K361-L363 HydrophobicContact CG-CD2 4.35Å; K361-L363 PolarHBondContact O-N 3.05Å
364	W	98.6	Very high	94.5	Very high	3 Å²	3	60.7 Å²	60.7	1%	0.011	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	152.3	-179.7	160.8	79.4	0	0	0	110.6	H113 L116 A135 V138 S139 A142 W302 C305 L306 L362 I366	H113-W364 AromaticContact CD2-CD1 3.69Å; H113-W364 AromaticContact CD2-NE1 3.16Å; H113-W364 PolarHBondContact CD2-NE1 3.14Å; H113-W364 AromaticContact CE1-NE1 3.74Å; H113-W364 AromaticContact CG-NE1 3.7Å; H113-W364 AromaticContact NE2-NE1 3.16Å; H113-W364 PolarHBondContact NE2-NE1 3.09Å; H113-W364 VanDerWaalsContact NE2-NE1 3.16Å; L116-W364 HydrophobicContact CD1-CB 4.25Å; L116-W364 HydrophobicContact CD1-CG 4.25Å; A135-W364 HydrophobicContact CB-CB 3.96Å; V138-W364 HydrophobicContact CG1-CZ3 4.28Å; S139-W364 VanDerWaalsContact CB-NE1 3.31Å; A142-W364 HydrophobicContact CB-CH2 3.58Å; A142-W364 HydrophobicContact CB-CZ2 3.47Å; A142-W364 VanDerWaalsContact CB-CZ2 3.47Å; W302-W364 VanDerWaalsContact O-CH2 3.28Å; W302-W364 WeakPolarHBondContact O-CH2 3.46Å; C305-W364 CarbonylContact C-O 3.45Å; C305-W364 VanDerWaalsContact CA-O 3.25Å; C305-W364 WeakPolarHBondContact CA-O 3.5Å; C305-W364 VanDerWaalsContact CB-O 3.28Å; C305-W364 WeakPolarHBondContact CB-O 3.4Å; L306-W364 HydrophobicContact CB-CE3 4.18Å; L306-W364 HydrophobicContact CD1-CE3 4.37Å; L306-W364 HydrophobicContact CG-CE3 3.93Å; L306-W364 HydrophobicContact CG-CZ3 4.44Å; L306-W364 PolarHBondContact N-O 2.76Å; L306-W364 PolarHBondContact O-N 3.46Å; L362-W364 WeakPolarHBondContact CD1-O 3.22Å; W364-I366 HydrophobicContact CH2-CB 3.99Å; W364-I366 HydrophobicContact CH2-CG1 4.49Å; W364-I366 HydrophobicContact CZ2-CB 3.66Å; W364-I366 HydrophobicContact CZ2-CG1 4.02Å
365	R	97.5	Very high	95	Very high	94 Å²	94	65.2 Å²	65.2	36%	0.355	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	139.7	170.2	-179.8	173	-68	-88.6	-0.1	108.2	E304 C305 E352	E304-R365 WeakPolarHBondContact O-CA 3.31Å; C305-R365 HydrophobicContact CB-CB 4.2Å; C305-R365 HydrophobicContact CB-CG 4.32Å; E352-R365 IonicContact OE1-NH1 3.52Å; E352-R365 PolarHBondContact OE1-NH1 2.85Å
366	I	96	Very high	95.3	Very high	44 Å²	44	60.3 Å²	60.3	23%	0.226	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-64.5	145.4	178	-159.6	168.4	0	0	0	110.6	A142 E304 W364	A142-I366 HydrophobicContact CB-CD1 4.07Å; A142-I366 HydrophobicContact CB-CG1 4.44Å; E304-I366 WeakPolarHBondContact O-CG2 3.43Å; E304-I366 PolarHBondContact O-N 3.07Å; W364-I366 HydrophobicContact CH2-CB 3.99Å; W364-I366 HydrophobicContact CH2-CG1 4.49Å; W364-I366 HydrophobicContact CZ2-CB 3.66Å; W364-I366 HydrophobicContact CZ2-CG1 4.02Å
367	N	94.2	Very high	95.3	Very high	80 Å²	80	57.6 Å²	57.6	43%	0.428	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-69.8	140.1	169.4	-64	-38.5	0	0	0	110.2	E112 R369	E112-N367 PolarHBondContact OE1-ND2 2.99Å; N367-R369 PolarHBondContact O-N 2.6Å
368	T	93.6	Very high	95.4	Very high	133 Å²	133	58.8 Å²	58.8	82%	0.816	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-64.7	130.6	172.3	-51.6	0	0	0	0	109.6
369	R	94.8	Very high	95.6	Very high	48 Å²	48	53.8 Å²	53.8	18%	0.181	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-62.2	147.8	173	-78	177.6	168.4	164.5	1.6	111.2	S143 W145 E146 N367 S373 N378	S143-R369 PolarHBondContact O-NH2 3.11Å; W145-R369 PolarHBondContact O-NH1 3.45Å; W145-R369 PolarHBondContact O-NH2 2.88Å; E146-R369 IonicContact OE2-NH1 2.86Å; E146-R369 PolarHBondContact OE2-NH1 3.06Å; N367-R369 PolarHBondContact O-N 2.6Å; R369-S373 WeakPolarHBondContact CD-OG 3.27Å; R369-N378 VanDerWaalsContact CZ-O 3.27Å; R369-N378 PolarHBondContact NE-O 3.15Å; R369-N378 PolarHBondContact NH2-O 2.91Å
370	P	94.4	Very high	95.7	Very high	18 Å²	18	50.4 Å²	50.4	12%	0.117	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-61.4	147.8	175	26.8	-33.4	0	0	0	110.3	N372 S373 M376 F379	P370-N372 PolarHBondContact O-N 3Å; P370-N372 VanDerWaalsContact O-N 3.09Å; P370-S373 WeakPolarHBondContact O-CB 3.43Å; P370-S373 PolarHBondContact O-N 3.25Å; P370-M376 HydrophobicContact CG-CE 4.22Å; P370-F379 WeakPolarHBondContact CD-O 3.19Å
371	P	93.4	Very high	95.7	Very high	141 Å²	141	52.8 Å²	52.8	92%	0.916	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.1	-174.8	-27.9	35.5	0	0	0	114.8	S373	P371-S373 VanDerWaalsContact C-N 3.34Å
372	N	92.4	Very high	95.7	Very high	51 Å²	51	48.9 Å²	48.9	27%	0.273	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	7.4	177	60.7	-25.7	0	0	0	113.7	P370 A374 Q375 M376	P370-N372 PolarHBondContact O-N 3Å; P370-N372 VanDerWaalsContact O-N 3.09Å; N372-A374 PolarHBondContact O-N 3.05Å; N372-Q375 WeakPolarHBondContact O-CB 3.37Å; N372-Q375 PolarHBondContact O-N 3.14Å; N372-M376 HydrophobicContact CB-CE 4.24Å; N372-M376 WeakPolarHBondContact ND2-CE 3.43Å; N372-M376 PolarHBondContact ND2-SD 2.85Å; N372-M376 PolarHBondContact O-N 2.64Å; N372-M376 VanDerWaalsContact OD1-CE 3.25Å; N372-M376 WeakPolarHBondContact OD1-CE 3.46Å
373	S	95.5	Very high	95.7	Very high	5 Å²	5	45.4 Å²	45.4	4%	0.035	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-51.4	-40.6	-179.3	170.4	0	0	0	0	113.1	R369 P370 P371 Q375 M376 N378 F379	R369-S373 WeakPolarHBondContact CD-OG 3.27Å; P370-S373 WeakPolarHBondContact O-CB 3.43Å; P370-S373 PolarHBondContact O-N 3.25Å; P371-S373 VanDerWaalsContact C-N 3.34Å; S373-Q375 PolarHBondContact O-N 3.42Å; S373-M376 CarbonylContact O-C 3.56Å; S373-M376 VanDerWaalsContact O-C 3.23Å; S373-M376 WeakPolarHBondContact O-CA 3.31Å; S373-M376 PolarHBondContact O-N 2.78Å; S373-N378 VanDerWaalsContact O-CA 3.23Å; S373-N378 WeakPolarHBondContact O-CA 3.46Å; S373-N378 PolarHBondContact O-N 3.43Å; S373-N378 WeakPolarHBondContact OG-CA 3.43Å; S373-F379 PolarHBondContact OG-O 3.19Å
374	A	93	Very high	95.6	Very high	68 Å²	68	45.3 Å²	45.3	56%	0.562	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-63	-24.8	178.2	0	0	0	0	0	113.8	M68 N372 M376 N378	M68-A374 VanDerWaalsContact SD-O 3.38Å; N372-A374 PolarHBondContact O-N 3.05Å; A374-M376 VanDerWaalsContact C-N 3.3Å; A374-N378 WeakPolarHBondContact CA-OD1 3.47Å
375	Q	93.4	Very high	95.5	Very high	124 Å²	124	45.6 Å²	45.6	58%	0.579	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-85.2	-7.1	173.9	-57.7	172.8	18.4	0	0	111.8	P67 M68 N372 S373	P67-Q375 CarbonylContact C-O 3.5Å; P67-Q375 VanDerWaalsContact CA-O 3.32Å; P67-Q375 WeakPolarHBondContact CA-O 3.26Å; P67-Q375 HydrophobicContact CB-CB 4.48Å; M68-Q375 PolarHBondContact N-O 3.3Å; N372-Q375 WeakPolarHBondContact O-CB 3.37Å; N372-Q375 PolarHBondContact O-N 3.14Å; S373-Q375 PolarHBondContact O-N 3.42Å
376	M	94.9	Very high	95.6	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.03	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.9	50.9	-173.9	-58.8	-177.1	-56.1	0	0	110	S63 L64 P370 N372 S373 A374 N378 F379 V384	S63-M376 WeakPolarHBondContact CA-SD 3.36Å; L64-M376 HydrophobicContact CB-CG 4.34Å; L64-M376 HydrophobicContact CB-SD 4.31Å; L64-M376 HydrophobicContact CD1-CB 3.87Å; L64-M376 HydrophobicContact CD1-CG 4.27Å; L64-M376 HydrophobicContact CG-CB 4.11Å; L64-M376 HydrophobicContact CG-CG 4.15Å; L64-M376 HydrophobicContact CG-SD 4.17Å; L64-M376 PolarHBondContact N-SD 3.38Å; P370-M376 HydrophobicContact CG-CE 4.22Å; N372-M376 HydrophobicContact CB-CE 4.24Å; N372-M376 WeakPolarHBondContact ND2-CE 3.43Å; N372-M376 PolarHBondContact ND2-SD 2.85Å; N372-M376 PolarHBondContact O-N 2.64Å; N372-M376 VanDerWaalsContact OD1-CE 3.25Å; N372-M376 WeakPolarHBondContact OD1-CE 3.46Å; S373-M376 CarbonylContact O-C 3.56Å; S373-M376 VanDerWaalsContact O-C 3.23Å; S373-M376 WeakPolarHBondContact O-CA 3.31Å; S373-M376 PolarHBondContact O-N 2.78Å; A374-M376 VanDerWaalsContact C-N 3.3Å; M376-N378 PolarHBondContact O-N 2.95Å; M376-F379 VanDerWaalsContact O-CB 3.29Å; M376-F379 WeakPolarHBondContact O-CB 3.16Å; M376-F379 WeakPolarHBondContact O-CD1 3.4Å; M376-F379 WeakPolarHBondContact O-CG 3.2Å; M376-F379 PolarHBondContact O-N 3.02Å; M376-V384 HydrophobicContact CE-CG2 4Å
377	Y	94.8	Very high	95.6	Very high	10 Å²	10	39.1 Å²	39.1	4%	0.039	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	20.6	175.2	-56.9	-90.3	0	0	0	114.9	L64 M68 E99 P100 R147 F379 M411	L64-Y377 HydrophobicContact CD1-CD2 3.9Å; L64-Y377 HydrophobicContact CD1-CE2 4.2Å; M68-Y377 HydrophobicContact CB-CD1 3.83Å; M68-Y377 HydrophobicContact CB-CD2 3.7Å; M68-Y377 HydrophobicContact CB-CE1 3.6Å; M68-Y377 HydrophobicContact CB-CE2 3.43Å; M68-Y377 VanDerWaalsContact CB-CE2 3.43Å; M68-Y377 HydrophobicContact CB-CG 3.88Å; M68-Y377 HydrophobicContact CE-CD1 4.11Å; M68-Y377 HydrophobicContact CE-CE1 4.35Å; M68-Y377 HydrophobicContact SD-CD1 4.37Å; M68-Y377 HydrophobicContact SD-CG 4.48Å; E99-Y377 HydrophobicContact CB-CD1 3.98Å; E99-Y377 HydrophobicContact CB-CG 4.22Å; P100-Y377 VanDerWaalsContact CD-CD2 3.47Å; P100-Y377 HydrophobicContact CG-CD2 3.91Å; P100-Y377 HydrophobicContact CG-CE2 3.69Å; R147-Y377 VanDerWaalsContact CD-O 3.23Å; R147-Y377 WeakPolarHBondContact CD-O 3.28Å; Y377-F379 VanDerWaalsContact C-N 3.34Å; Y377-F379 HydrophobicContact CD2-CZ 4.47Å; Y377-F379 HydrophobicContact CG-CE1 4.42Å; Y377-F379 HydrophobicContact CG-CZ 4.44Å; Y377-M411 HydrophobicContact CE1-CE 3.86Å; Y377-M411 WeakPolarHBondContact OH-CE 3.49Å
378	N	95.8	Very high	95.7	Very high	33 Å²	33	37 Å²	37	18%	0.176	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	31.7	-173.2	-60.1	-52.9	0	0	0	114.9	E146 R147 R369 S373 A374 M376	E146-N378 HydrophobicContact CB-CB 4.13Å; E146-N378 PolarHBondContact O-ND2 3.24Å; R147-N378 WeakPolarHBondContact CD-O 3.31Å; R369-N378 VanDerWaalsContact CZ-O 3.27Å; R369-N378 PolarHBondContact NE-O 3.15Å; R369-N378 PolarHBondContact NH2-O 2.91Å; S373-N378 VanDerWaalsContact O-CA 3.23Å; S373-N378 WeakPolarHBondContact O-CA 3.46Å; S373-N378 PolarHBondContact O-N 3.43Å; S373-N378 WeakPolarHBondContact OG-CA 3.43Å; A374-N378 WeakPolarHBondContact CA-OD1 3.47Å; M376-N378 PolarHBondContact O-N 2.95Å
379	F	97.8	Very high	95.7	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	19%	0.192	C	C	.	.			trans	-68.8	143.2	179.4	-73.7	1.6	0	0	0	112.9	L64 E99 P100 L101 P370 S373 M376 Y377 T383 V384	L64-F379 HydrophobicContact CD1-CD2 4.11Å; L64-F379 HydrophobicContact CD1-CE2 4.06Å; L64-F379 HydrophobicContact CD2-CD2 4.37Å; L64-F379 HydrophobicContact CD2-CE2 4.44Å; E99-F379 HydrophobicContact CB-CE1 4.11Å; E99-F379 HydrophobicContact CB-CZ 4.09Å; E99-F379 HydrophobicContact CG-CE1 4.47Å; P100-F379 HydrophobicContact CG-CE2 4.14Å; P100-F379 HydrophobicContact CG-CZ 4.16Å; L101-F379 HydrophobicContact CD1-CE1 3.96Å; L101-F379 HydrophobicContact CD1-CE2 4Å; L101-F379 HydrophobicContact CD1-CZ 3.54Å; L101-F379 HydrophobicContact CG-CE2 4.08Å; L101-F379 HydrophobicContact CG-CZ 3.73Å; P370-F379 WeakPolarHBondContact CD-O 3.19Å; S373-F379 PolarHBondContact OG-O 3.19Å; M376-F379 VanDerWaalsContact O-CB 3.29Å; M376-F379 WeakPolarHBondContact O-CB 3.16Å; M376-F379 WeakPolarHBondContact O-CD1 3.4Å; M376-F379 WeakPolarHBondContact O-CG 3.2Å; M376-F379 PolarHBondContact O-N 3.02Å; Y377-F379 VanDerWaalsContact C-N 3.34Å; Y377-F379 HydrophobicContact CD2-CZ 4.47Å; Y377-F379 HydrophobicContact CG-CE1 4.42Å; Y377-F379 HydrophobicContact CG-CZ 4.44Å; F379-T383 HydrophobicContact CB-CG2 3.87Å; F379-T383 HydrophobicContact CD1-CG2 3.64Å; F379-T383 HydrophobicContact CD2-CG2 3.78Å; F379-T383 HydrophobicContact CE1-CG2 4.04Å; F379-T383 HydrophobicContact CE2-CG2 4.17Å; F379-T383 HydrophobicContact CG-CG2 3.48Å; F379-T383 VanDerWaalsContact CG-CG2 3.48Å; F379-T383 HydrophobicContact CZ-CG2 4.29Å; F379-V384 HydrophobicContact CB-CG2 3.71Å; F379-V384 HydrophobicContact CD2-CG2 4.37Å
380	T	97.8	Very high	95.5	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.031	20%	0.197	C	C	.	.			trans	-74.8	166.3	166.5	76	0	0	0	0	109.6	E112 F382 T383 V384	E112-T380 PolarHBondContact OE2-OG1 3.48Å; E112-T380 VanDerWaalsContact OE2-OG1 3.05Å; T380-F382 PolarHBondContact O-N 3.38Å; T380-F382 PolarHBondContact OG1-N 2.67Å; T380-T383 PolarHBondContact N-OG1 3.18Å; T380-T383 PolarHBondContact O-N 2.65Å; T380-T383 VanDerWaalsContact O-N 3.12Å; T380-T383 PolarHBondContact OG1-N 2.76Å; T380-T383 VanDerWaalsContact OG1-N 3.14Å; T380-T383 PolarHBondContact OG1-OG1 3.09Å; T380-V384 WeakPolarHBondContact O-CG2 3.11Å; T380-V384 PolarHBondContact O-N 2.91Å
381	S	96.8	Very high	95.2	Very high	73 Å²	73	40.4 Å²	40.4	51%	0.51	24%	0.237	S	C	.	.	H	α-helix	trans	-59.3	-31.9	174.1	-55.4	0	0	0	0	112.3
382	F	97.7	Very high	95	Very high	15 Å²	15	35 Å²	35	7%	0.066	21%	0.208	C	C	.	.	H	α-helix	trans	-67.8	-47.6	173.3	-176.6	-89.7	0	0	0	111	M111 E112 L162 L167 F169 T380 V384 S385 L386	M111-F382 HydrophobicContact CB-CZ 4.39Å; E112-F382 HydrophobicContact CB-CB 4.26Å; E112-F382 HydrophobicContact CB-CD1 3.98Å; E112-F382 HydrophobicContact CB-CD2 4.32Å; E112-F382 HydrophobicContact CB-CE1 4.4Å; E112-F382 HydrophobicContact CB-CG 3.94Å; E112-F382 HydrophobicContact CG-CB 3.73Å; E112-F382 HydrophobicContact CG-CD1 4.4Å; E112-F382 HydrophobicContact CG-CD2 4.36Å; E112-F382 HydrophobicContact CG-CG 3.94Å; L162-F382 HydrophobicContact CD2-CE2 4.4Å; L162-F382 HydrophobicContact CD2-CZ 3.78Å; L167-F382 HydrophobicContact CD1-CD2 4.21Å; L167-F382 HydrophobicContact CD1-CE2 3.91Å; F169-F382 HydrophobicContact CZ-CE2 4.29Å; F169-F382 HydrophobicContact CZ-CZ 4.19Å; T380-F382 PolarHBondContact O-N 3.38Å; T380-F382 PolarHBondContact OG1-N 2.67Å; F382-V384 VanDerWaalsContact C-N 3.31Å; F382-V384 PolarHBondContact O-N 3.12Å; F382-S385 PolarHBondContact O-N 3.43Å; F382-S385 PolarHBondContact O-OG 3.21Å; F382-S385 VanDerWaalsContact O-OG 3.05Å; F382-L386 HydrophobicContact CD1-CD2 4.15Å; F382-L386 HydrophobicContact CD1-CG 4.48Å; F382-L386 HydrophobicContact CE1-CD1 4.49Å; F382-L386 HydrophobicContact CE1-CD2 3.66Å; F382-L386 HydrophobicContact CE1-CG 4.41Å; F382-L386 HydrophobicContact CZ-CD2 4.18Å
383	T	98.1	Very high	94.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.9	-40.5	178.6	-48.4	0	0	0	0	112.2	L101 E109 F379 T380 S385 L386	L101-T383 HydrophobicContact CD1-CG2 3.46Å; L101-T383 VanDerWaalsContact CD1-CG2 3.46Å; E109-T383 PolarHBondContact OE2-OG1 2.86Å; F379-T383 HydrophobicContact CB-CG2 3.87Å; F379-T383 HydrophobicContact CD1-CG2 3.64Å; F379-T383 HydrophobicContact CD2-CG2 3.78Å; F379-T383 HydrophobicContact CE1-CG2 4.04Å; F379-T383 HydrophobicContact CE2-CG2 4.17Å; F379-T383 HydrophobicContact CG-CG2 3.48Å; F379-T383 VanDerWaalsContact CG-CG2 3.48Å; F379-T383 HydrophobicContact CZ-CG2 4.29Å; T380-T383 PolarHBondContact N-OG1 3.18Å; T380-T383 PolarHBondContact O-N 2.65Å; T380-T383 VanDerWaalsContact O-N 3.12Å; T380-T383 PolarHBondContact OG1-N 2.76Å; T380-T383 VanDerWaalsContact OG1-N 3.14Å; T380-T383 PolarHBondContact OG1-OG1 3.09Å; T383-S385 PolarHBondContact O-N 2.86Å; T383-L386 HydrophobicContact CG2-CD1 4.39Å; T383-L386 WeakPolarHBondContact O-CB 3.14Å; T383-L386 PolarHBondContact O-N 2.91Å; T383-L386 VanDerWaalsContact O-N 3.17Å
384	V	97.5	Very high	94.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.8	-35.7	180	169.3	0	0	0	0	111.3	R61 L64 M376 F379 T380 F382	R61-V384 HydrophobicContact CG-CG1 4.06Å; R61-V384 PolarHBondContact NE-O 3.36Å; R61-V384 PolarHBondContact NH2-O 2.65Å; L64-V384 HydrophobicContact CD2-CG1 4.48Å; M376-V384 HydrophobicContact CE-CG2 4Å; F379-V384 HydrophobicContact CB-CG2 3.71Å; F379-V384 HydrophobicContact CD2-CG2 4.37Å; T380-V384 WeakPolarHBondContact O-CG2 3.11Å; T380-V384 PolarHBondContact O-N 2.91Å; F382-V384 VanDerWaalsContact C-N 3.31Å; F382-V384 PolarHBondContact O-N 3.12Å
385	S	96.8	Very high	94.6	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-82	-12.2	-178.6	70.7	0	0	0	0	115.1	F382 T383 N387 E388	F382-S385 PolarHBondContact O-N 3.43Å; F382-S385 PolarHBondContact O-OG 3.21Å; F382-S385 VanDerWaalsContact O-OG 3.05Å; T383-S385 PolarHBondContact O-N 2.86Å; S385-N387 VanDerWaalsContact C-N 3.34Å; S385-N387 PolarHBondContact O-N 3.15Å; S385-E388 VanDerWaalsContact O-CB 3.29Å; S385-E388 WeakPolarHBondContact O-CB 3.47Å; S385-E388 PolarHBondContact O-N 3.35Å
386	L	98.1	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-39.6	-170.1	-68.8	179.3	0	0	0	114.1	L101 Q105 T108 E109 Y160 L162 F382 T383 R403	L101-L386 HydrophobicContact CD2-CB 4.23Å; Q105-L386 HydrophobicContact CB-CD1 4.29Å; Q105-L386 WeakPolarHBondContact O-CD1 3.24Å; T108-L386 HydrophobicContact CG2-CD2 4.23Å; E109-L386 HydrophobicContact CG-CD1 3.76Å; Y160-L386 WeakPolarHBondContact CE2-O 3.34Å; Y160-L386 WeakPolarHBondContact OH-CA 3.18Å; Y160-L386 WeakPolarHBondContact OH-CD2 3.42Å; Y160-L386 PolarHBondContact OH-O 3.04Å; L162-L386 HydrophobicContact CD2-CD2 3.77Å; F382-L386 HydrophobicContact CD1-CD2 4.15Å; F382-L386 HydrophobicContact CD1-CG 4.48Å; F382-L386 HydrophobicContact CE1-CD1 4.49Å; F382-L386 HydrophobicContact CE1-CD2 3.66Å; F382-L386 HydrophobicContact CE1-CG 4.41Å; F382-L386 HydrophobicContact CZ-CD2 4.18Å; T383-L386 HydrophobicContact CG2-CD1 4.39Å; T383-L386 WeakPolarHBondContact O-CB 3.14Å; T383-L386 PolarHBondContact O-N 2.91Å; T383-L386 VanDerWaalsContact O-N 3.17Å; L386-R403 PolarHBondContact O-NE 2.97Å; L386-R403 PolarHBondContact O-NH2 2.8Å
387	N	97.9	Very high	94.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	14.6	-176.5	-161.9	48.2	0	0	0	113.2	L101 Q105 S385 L389 R403 R409 E412	L101-N387 HydrophobicContact CD2-CB 3.94Å; Q105-N387 PolarHBondContact NE2-OD1 2.86Å; S385-N387 VanDerWaalsContact C-N 3.34Å; S385-N387 PolarHBondContact O-N 3.15Å; N387-L389 PolarHBondContact O-N 2.9Å; N387-R403 WeakPolarHBondContact OD1-CA 3.25Å; N387-R409 PolarHBondContact O-NH1 2.81Å; N387-R409 PolarHBondContact O-NH2 2.7Å; N387-E412 WeakPolarHBondContact CB-OE1 3.3Å; N387-E412 PolarHBondContact ND2-OE1 3.4Å
388	E	96.1	Very high	94.8	Very high	37 Å²	37	43.7 Å²	43.7	17%	0.173	24%	0.237	C	C	.	.			trans	-63.1	128.6	170.3	-173.9	165.3	-148.2	0	0	109.8	R61 S385 E390 R403	R61-E388 VanDerWaalsContact CB-OE1 3.26Å; R61-E388 WeakPolarHBondContact CB-OE1 3.49Å; R61-E388 HydrophobicContact CG-CB 4.1Å; R61-E388 HydrophobicContact CG-CG 4.11Å; R61-E388 PolarHBondContact N-OE1 3.29Å; R61-E388 VanDerWaalsContact N-OE1 3.16Å; R61-E388 PolarHBondContact N-OE2 3.08Å; S385-E388 VanDerWaalsContact O-CB 3.29Å; S385-E388 WeakPolarHBondContact O-CB 3.47Å; S385-E388 PolarHBondContact O-N 3.35Å; E388-E390 HydrophobicContact CG-CG 4.17Å; E388-R403 VanDerWaalsContact O-CD 3.25Å; E388-R403 WeakPolarHBondContact O-CD 3.11Å; E388-R403 PolarHBondContact O-NE 2.88Å
389	L	93.8	Very high	94.8	Very high	50 Å²	50	45.3 Å²	45.3	26%	0.262	25%	0.25	S	S	.	.			trans	-118.8	98.5	175.9	-177.5	67.5	0	0	0	107.9	N387 M393 E394 L397 R403 L404	N387-L389 PolarHBondContact O-N 2.9Å; L389-M393 HydrophobicContact CD1-CB 3.9Å; L389-E394 HydrophobicContact CD1-CG 4.14Å; L389-E394 HydrophobicContact CD2-CG 4.11Å; L389-E394 HydrophobicContact CG-CG 4.36Å; L389-L397 HydrophobicContact CD1-CD1 3.66Å; L389-R403 HydrophobicContact CD1-CB 4.09Å; L389-L404 HydrophobicContact CD1-CD2 4.21Å; L389-L404 HydrophobicContact CD2-CD2 4.13Å
390	E	89.3	Confident	94.9	Very high	63 Å²	63	45.3 Å²	45.3	29%	0.294	25%	0.25	S	S	.	.			trans	-78.5	153	179.6	-59.3	-179.6	-174.6	0	0	111.5	Q58 E388 G392 M393	Q58-E390 PolarHBondContact NE2-OE1 2.91Å; Q58-E390 PolarHBondContact NE2-OE2 2.85Å; E388-E390 HydrophobicContact CG-CG 4.17Å; E390-G392 PolarHBondContact O-N 3.49Å; E390-G392 VanDerWaalsContact O-N 3.09Å; E390-M393 HydrophobicContact CB-CG 3.96Å; E390-M393 HydrophobicContact CB-SD 3.74Å; E390-M393 HydrophobicContact CG-SD 4Å; E390-M393 PolarHBondContact N-SD 3Å; E390-M393 WeakPolarHBondContact O-CB 3.5Å; E390-M393 PolarHBondContact O-N 3.35Å
391	T	88.3	Confident	94.9	Very high	156 Å²	156	45.1 Å²	45.1	96%	0.957	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	118.1	177.6	-54.8	0	0	0	0	111.1
392	G	88.7	Confident	95	Very high	29 Å²	29	41.6 Å²	41.6	30%	0.299	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.6	-11.4	178.6	0	0	0	0	0	115.2	E390 E394 K395	E390-G392 PolarHBondContact O-N 3.49Å; E390-G392 VanDerWaalsContact O-N 3.09Å; G392-E394 PolarHBondContact O-N 3.38Å; G392-K395 WeakPolarHBondContact O-CB 3.44Å; G392-K395 PolarHBondContact O-N 2.99Å; G392-K395 VanDerWaalsContact O-N 3.13Å
393	M	91.1	Very high	95	Very high	44 Å²	44	41.4 Å²	41.4	22%	0.217	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59.1	-34.5	172	-75.8	-177.3	69.1	0	0	111.9	L389 E390 K395 T396 L397	L389-M393 HydrophobicContact CD1-CB 3.9Å; E390-M393 HydrophobicContact CB-CG 3.96Å; E390-M393 HydrophobicContact CB-SD 3.74Å; E390-M393 HydrophobicContact CG-SD 4Å; E390-M393 PolarHBondContact N-SD 3Å; E390-M393 WeakPolarHBondContact O-CB 3.5Å; E390-M393 PolarHBondContact O-N 3.35Å; M393-K395 PolarHBondContact O-N 2.98Å; M393-T396 PolarHBondContact O-N 3.35Å; M393-T396 PolarHBondContact O-OG1 3.37Å; M393-L397 HydrophobicContact CB-CD1 4.15Å; M393-L397 HydrophobicContact CB-CG 4.4Å; M393-L397 HydrophobicContact CE-CD1 4.33Å; M393-L397 HydrophobicContact CE-CD2 4.38Å; M393-L397 WeakPolarHBondContact O-CG 3.41Å; M393-L397 PolarHBondContact O-N 3.47Å
394	E	90.5	Very high	95	Very high	125 Å²	125	43.8 Å²	43.8	58%	0.584	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-55	-24.2	176.9	-59.8	168.4	159.6	0	0	113.3	L389 G392 L404	L389-E394 HydrophobicContact CD1-CG 4.14Å; L389-E394 HydrophobicContact CD2-CG 4.11Å; L389-E394 HydrophobicContact CG-CG 4.36Å; G392-E394 PolarHBondContact O-N 3.38Å; E394-L404 HydrophobicContact CG-CD2 4.01Å
395	K	91	Very high	95.1	Very high	190 Å²	190	43.9 Å²	43.9	83%	0.826	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-81.6	-16.3	178	-59.6	-179.3	-179.5	178.5	0	113.2	G392 M393	G392-K395 WeakPolarHBondContact O-CB 3.44Å; G392-K395 PolarHBondContact O-N 2.99Å; G392-K395 VanDerWaalsContact O-N 3.13Å; M393-K395 PolarHBondContact O-N 2.98Å
396	T	93.4	Very high	95.1	Very high	76 Å²	76	45 Å²	45	47%	0.466	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116	-19.9	-174.8	57.5	0	0	0	0	113.3	M393 R471 F473	M393-T396 PolarHBondContact O-N 3.35Å; M393-T396 PolarHBondContact O-OG1 3.37Å; T396-R471 PolarHBondContact O-NH1 3.31Å; T396-R471 VanDerWaalsContact O-NH1 3.16Å; T396-F473 WeakPolarHBondContact O-CE2 3.43Å
397	L	96.6	Very high	95.1	Very high	10 Å²	10	45 Å²	45	5%	0.052	24%	0.243	C	C	.	.	S	Bend	trans	-75.3	146.6	174.4	-67.6	174.7	0	0	0	110.3	E161 L389 M393 D401 R403 L404	E161-L397 HydrophobicContact CG-CD2 3.86Å; E161-L397 VanDerWaalsContact OE1-CD2 3.26Å; E161-L397 WeakPolarHBondContact OE1-CD2 3.43Å; L389-L397 HydrophobicContact CD1-CD1 3.66Å; M393-L397 HydrophobicContact CB-CD1 4.15Å; M393-L397 HydrophobicContact CB-CG 4.4Å; M393-L397 HydrophobicContact CE-CD1 4.33Å; M393-L397 HydrophobicContact CE-CD2 4.38Å; M393-L397 WeakPolarHBondContact O-CG 3.41Å; M393-L397 PolarHBondContact O-N 3.47Å; L397-D401 HydrophobicContact CB-CB 4.04Å; L397-D401 HydrophobicContact CD1-CB 4.26Å; L397-D401 HydrophobicContact CD2-CB 4.07Å; L397-D401 HydrophobicContact CG-CB 4.35Å; L397-R403 HydrophobicContact CD1-CB 4.35Å; L397-L404 HydrophobicContact CB-CD1 4.5Å; L397-L404 HydrophobicContact CD1-CD2 4.42Å; L397-L404 HydrophobicContact CD1-CG 4.5Å
398	P	97.3	Very high	95.1	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.			trans	-64.3	154.5	163.4	31	-35.8	0	0	0	110	T400 D401 L404 Y468 F473	P398-T400 PolarHBondContact O-N 3.37Å; P398-D401 HydrophobicContact CG-CB 4.15Å; P398-D401 PolarHBondContact O-N 3.41Å; P398-L404 WeakPolarHBondContact O-CD1 2.9Å; P398-Y468 VanDerWaalsContact CD-OH 3.29Å; P398-Y468 WeakPolarHBondContact CD-OH 3.29Å; P398-Y468 HydrophobicContact CG-CE2 4.01Å; P398-Y468 VanDerWaalsContact CG-OH 3.28Å; P398-Y468 WeakPolarHBondContact CG-OH 3.46Å; P398-F473 HydrophobicContact CB-CB 4.23Å; P398-F473 HydrophobicContact CB-CD1 3.77Å; P398-F473 HydrophobicContact CB-CD2 3.97Å; P398-F473 HydrophobicContact CB-CE1 4.04Å; P398-F473 HydrophobicContact CB-CE2 4.23Å; P398-F473 HydrophobicContact CB-CG 3.72Å; P398-F473 HydrophobicContact CB-CZ 4.25Å; P398-F473 HydrophobicContact CG-CE1 4.4Å; P398-F473 HydrophobicContact CG-CZ 4.37Å
399	P	97.3	Very high	95.1	Very high	68 Å²	68	45.4 Å²	45.4	44%	0.442	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-14.3	176.2	28.3	-36.2	0	0	0	112.9	C476 Y480	P399-C476 HydrophobicContact CG-CB 3.49Å; P399-C476 VanDerWaalsContact CG-CB 3.49Å; P399-Y480 VanDerWaalsContact O-CD2 3.27Å; P399-Y480 WeakPolarHBondContact O-CD2 3.42Å; P399-Y480 WeakPolarHBondContact O-CE2 3.36Å
400	T	98.2	Very high	95.3	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.9	177.7	53.5	0	0	0	0	114	T159 P398 C402 C476 P477 I479 Y480	T159-T400 PolarHBondContact N-O 2.95Å; T159-T400 VanDerWaalsContact O-O 3.11Å; T159-T400 WeakPolarHBondContact OG1-CB 3.44Å; T159-T400 PolarHBondContact OG1-O 3.05Å; T159-T400 PolarHBondContact OG1-OG1 3.38Å; P398-T400 PolarHBondContact O-N 3.37Å; T400-C402 PolarHBondContact O-N 2.94Å; T400-C476 HydrophobicContact CG2-CB 4.26Å; T400-P477 HydrophobicContact CG2-CG 3.72Å; T400-P477 WeakPolarHBondContact CG2-O 3.1Å; T400-I479 HydrophobicContact CG2-CD1 3.86Å; T400-I479 HydrophobicContact CG2-CG1 4.13Å; T400-Y480 PolarHBondContact O-OH 3.14Å; T400-Y480 VanDerWaalsContact O-OH 3.09Å
401	D	98.7	Very high	95.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-69.7	128.7	179	-170.3	-90	0	0	0	111.1	T159 Y160 E161 L397 P398 R403 L404 Y480	T159-D401 CarbonylContact O-C 3.48Å; T159-D401 VanDerWaalsContact O-CA 3.29Å; T159-D401 WeakPolarHBondContact O-CA 3.45Å; T159-D401 PolarHBondContact OG1-N 2.79Å; Y160-D401 WeakPolarHBondContact CA-OD2 3.37Å; E161-D401 PolarHBondContact N-OD2 3.25Å; L397-D401 HydrophobicContact CB-CB 4.04Å; L397-D401 HydrophobicContact CD1-CB 4.26Å; L397-D401 HydrophobicContact CD2-CB 4.07Å; L397-D401 HydrophobicContact CG-CB 4.35Å; P398-D401 HydrophobicContact CG-CB 4.15Å; P398-D401 PolarHBondContact O-N 3.41Å; D401-R403 PolarHBondContact O-N 3.16Å; D401-R403 VanDerWaalsContact OD1-CB 3.25Å; D401-R403 WeakPolarHBondContact OD1-CB 3.45Å; D401-R403 WeakPolarHBondContact OD1-CG 3.32Å; D401-R403 IonicContact OD1-CZ 3.53Å; D401-R403 PolarHBondContact OD1-N 3.16Å; D401-R403 IonicContact OD1-NH1 3.3Å; D401-R403 PolarHBondContact OD1-NH1 3.48Å; D401-R403 IonicContact OD2-NH1 3.86Å; D401-R403 PolarHBondContact OD2-NH1 3.13Å; D401-L404 WeakPolarHBondContact O-CB 3.5Å; D401-L404 PolarHBondContact O-N 3.48Å; D401-Y480 WeakPolarHBondContact O-CE2 3.32Å; D401-Y480 PolarHBondContact O-OH 3.28Å
402	C	98.4	Very high	96	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-66.7	-8.2	-172.8	75.3	0	0	0	0	115	Q105 E158 T159 Y160 T400 L404 R405 Y480	Q105-C402 PolarHBondContact NE2-SG 2.98Å; Q105-C402 VanDerWaalsContact NE2-SG 3.36Å; E158-C402 HydrophobicContact CG-CB 3.95Å; E158-C402 VanDerWaalsContact OE1-CB 3.3Å; E158-C402 WeakPolarHBondContact OE1-CB 3.37Å; T159-C402 PolarHBondContact O-N 3.32Å; Y160-C402 WeakPolarHBondContact CD2-SG 3.27Å; T400-C402 PolarHBondContact O-N 2.94Å; C402-L404 PolarHBondContact O-N 3.22Å; C402-R405 VanDerWaalsContact O-CB 3.28Å; C402-R405 WeakPolarHBondContact O-CB 3.18Å; C402-R405 PolarHBondContact O-N 3.4Å; C402-Y480 VanDerWaalsContact CA-OH 3.27Å; C402-Y480 WeakPolarHBondContact CA-OH 3.49Å; C402-Y480 PolarHBondContact N-OH 3.39Å
403	R	98.4	Very high	96.4	Very high	11 Å²	11	35.4 Å²	35.4	4%	0.042	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-65.2	-25.6	166.8	-67.3	174.9	-175.1	87	-2.6	113.1	Y160 E161 L386 N387 E388 L389 L397 D401 R405 R409	Y160-R403 HydrophobicContact CE2-CG 4.43Å; Y160-R403 VanDerWaalsContact CE2-NH1 3.3Å; Y160-R403 VanDerWaalsContact CE2-NH2 3.32Å; Y160-R403 PolarHBondContact OH-NH2 3.26Å; E161-R403 VanDerWaalsContact O-CZ 3.25Å; E161-R403 PolarHBondContact O-NH1 3.01Å; E161-R403 PolarHBondContact O-NH2 3Å; L386-R403 PolarHBondContact O-NE 2.97Å; L386-R403 PolarHBondContact O-NH2 2.8Å; N387-R403 WeakPolarHBondContact OD1-CA 3.25Å; E388-R403 VanDerWaalsContact O-CD 3.25Å; E388-R403 WeakPolarHBondContact O-CD 3.11Å; E388-R403 PolarHBondContact O-NE 2.88Å; L389-R403 HydrophobicContact CD1-CB 4.09Å; L397-R403 HydrophobicContact CD1-CB 4.35Å; D401-R403 PolarHBondContact O-N 3.16Å; D401-R403 VanDerWaalsContact OD1-CB 3.25Å; D401-R403 WeakPolarHBondContact OD1-CB 3.45Å; D401-R403 WeakPolarHBondContact OD1-CG 3.32Å; D401-R403 IonicContact OD1-CZ 3.53Å; D401-R403 PolarHBondContact OD1-N 3.16Å; D401-R403 IonicContact OD1-NH1 3.3Å; D401-R403 PolarHBondContact OD1-NH1 3.48Å; D401-R403 IonicContact OD2-NH1 3.86Å; D401-R403 PolarHBondContact OD2-NH1 3.13Å; R403-R405 VanDerWaalsContact C-N 3.32Å; R403-R409 PolarHBondContact O-NH2 3.05Å
404	L	98.1	Very high	96.6	Very high	50 Å²	50	34.7 Å²	34.7	26%	0.262	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-86.1	-7.3	177.8	-53.6	177.2	0	0	0	112.2	L389 E394 L397 P398 D401 C402 P406 Y480	L389-L404 HydrophobicContact CD1-CD2 4.21Å; L389-L404 HydrophobicContact CD2-CD2 4.13Å; E394-L404 HydrophobicContact CG-CD2 4.01Å; L397-L404 HydrophobicContact CB-CD1 4.5Å; L397-L404 HydrophobicContact CD1-CD2 4.42Å; L397-L404 HydrophobicContact CD1-CG 4.5Å; P398-L404 WeakPolarHBondContact O-CD1 2.9Å; D401-L404 WeakPolarHBondContact O-CB 3.5Å; D401-L404 PolarHBondContact O-N 3.48Å; C402-L404 PolarHBondContact O-N 3.22Å; L404-P406 WeakPolarHBondContact O-CD 3.44Å; L404-Y480 HydrophobicContact CB-CD2 4.14Å; L404-Y480 HydrophobicContact CB-CE2 3.92Å
405	R	98.3	Very high	96.8	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.008	18%	0.175	C	C	.	.			trans	-70.4	117.8	-175.5	-165.5	179.1	155	161.8	1.3	111.2	N153 E158 C402 R403 D407 I408 R409 L426 Y480	N153-R405 PolarHBondContact O-NH1 3.03Å; E158-R405 IonicContact OE1-NH1 2.75Å; E158-R405 VanDerWaalsContact OE2-CD 3.31Å; E158-R405 WeakPolarHBondContact OE2-CD 3.19Å; E158-R405 IonicContact OE2-CZ 2.89Å; E158-R405 IonicContact OE2-NE 2.77Å; E158-R405 IonicContact OE2-NH1 3.56Å; E158-R405 PolarHBondContact OE2-NH1 2.64Å; C402-R405 VanDerWaalsContact O-CB 3.28Å; C402-R405 WeakPolarHBondContact O-CB 3.18Å; C402-R405 PolarHBondContact O-N 3.4Å; R403-R405 VanDerWaalsContact C-N 3.32Å; R405-D407 WeakPolarHBondContact CD-OD1 3.39Å; R405-D407 WeakPolarHBondContact CG-OD1 3.4Å; R405-D407 IonicContact CZ-OD1 3.82Å; R405-D407 IonicContact CZ-OD2 2.74Å; R405-D407 IonicContact NE-OD1 3.89Å; R405-D407 PolarHBondContact NE-OD1 2.9Å; R405-D407 IonicContact NE-OD2 2.73Å; R405-D407 PolarHBondContact NE-OD2 2.79Å; R405-D407 IonicContact NH2-OD1 2.86Å; R405-D407 IonicContact NH2-OD2 3.36Å; R405-D407 PolarHBondContact NH2-OD2 2.99Å; R405-D407 PolarHBondContact O-N 3.24Å; R405-I408 HydrophobicContact CB-CD1 4.22Å; R405-I408 HydrophobicContact CB-CG1 4.36Å; R405-I408 HydrophobicContact CG-CD1 4.36Å; R405-I408 HydrophobicContact CG-CG1 4.32Å; R405-I408 PolarHBondContact O-N 3.21Å; R405-R409 PolarHBondContact O-N 3.17Å; R405-R409 VanDerWaalsContact O-N 3.14Å; R405-L426 HydrophobicContact CG-CD1 3.99Å; R405-Y480 HydrophobicContact CB-CD1 4.28Å; R405-Y480 HydrophobicContact CB-CE1 3.69Å; R405-Y480 HydrophobicContact CB-CE2 4.22Å; R405-Y480 HydrophobicContact CG-CD1 3.85Å; R405-Y480 HydrophobicContact CG-CE1 3.43Å; R405-Y480 VanDerWaalsContact CG-CE1 3.43Å
406	P	97.9	Very high	96.8	Very high	32 Å²	32	24.9 Å²	24.9	21%	0.208	14%	0.144	C	C	.	.	H	α-helix	trans	-73.7	-31.4	-164.1	25.7	-34.7	0	0	0	114.7	L404 R409 G410 E422 L426	L404-P406 WeakPolarHBondContact O-CD 3.44Å; P406-R409 PolarHBondContact O-N 2.62Å; P406-G410 PolarHBondContact O-N 2.78Å; P406-E422 HydrophobicContact CB-CB 4.29Å; P406-E422 HydrophobicContact CB-CG 4.07Å; P406-E422 VanDerWaalsContact CB-OE2 3.29Å; P406-E422 WeakPolarHBondContact CB-OE2 3.47Å; P406-E422 HydrophobicContact CG-CB 4.3Å; P406-E422 HydrophobicContact CG-CG 4.39Å; P406-E422 WeakPolarHBondContact CG-OE2 3.34Å; P406-L426 HydrophobicContact CG-CD1 4.1Å
407	D	97.5	Very high	96.7	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-43.9	176.3	60.5	-11.7	0	0	0	112.1	F152 R405 G410 M411 A419 E422 K423 L426	F152-D407 WeakPolarHBondContact CD1-OD2 3.13Å; F152-D407 HydrophobicContact CE1-CB 4.08Å; F152-D407 WeakPolarHBondContact CE1-OD2 3.35Å; R405-D407 WeakPolarHBondContact CD-OD1 3.39Å; R405-D407 WeakPolarHBondContact CG-OD1 3.4Å; R405-D407 IonicContact CZ-OD1 3.82Å; R405-D407 IonicContact CZ-OD2 2.74Å; R405-D407 IonicContact NE-OD1 3.89Å; R405-D407 PolarHBondContact NE-OD1 2.9Å; R405-D407 IonicContact NE-OD2 2.73Å; R405-D407 PolarHBondContact NE-OD2 2.79Å; R405-D407 IonicContact NH2-OD1 2.86Å; R405-D407 IonicContact NH2-OD2 3.36Å; R405-D407 PolarHBondContact NH2-OD2 2.99Å; R405-D407 PolarHBondContact O-N 3.24Å; D407-G410 PolarHBondContact O-N 3.37Å; D407-M411 PolarHBondContact O-N 3.41Å; D407-A419 WeakPolarHBondContact CB-O 3.43Å; D407-A419 WeakPolarHBondContact O-CB 3.28Å; D407-E422 HydrophobicContact CB-CB 3.97Å; D407-K423 HydrophobicContact CB-CB 3.87Å; D407-L426 HydrophobicContact CB-CD1 4.2Å
408	I	97.8	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-46.1	173.9	-58.2	-175.5	0	0	0	110	P100 F152 R405 M411 E412	P100-I408 HydrophobicContact CB-CG2 4.47Å; P100-I408 WeakPolarHBondContact O-CG2 3.17Å; F152-I408 HydrophobicContact CB-CD1 3.99Å; F152-I408 HydrophobicContact CB-CG1 4.1Å; F152-I408 HydrophobicContact CD1-CG1 4.02Å; F152-I408 HydrophobicContact CD2-CD1 4.37Å; F152-I408 HydrophobicContact CD2-CG1 3.8Å; F152-I408 HydrophobicContact CE1-CG1 4.38Å; F152-I408 HydrophobicContact CE2-CG1 4.18Å; F152-I408 HydrophobicContact CG-CD1 4.16Å; F152-I408 HydrophobicContact CG-CG1 3.71Å; F152-I408 HydrophobicContact CZ-CG1 4.45Å; R405-I408 HydrophobicContact CB-CD1 4.22Å; R405-I408 HydrophobicContact CB-CG1 4.36Å; R405-I408 HydrophobicContact CG-CD1 4.36Å; R405-I408 HydrophobicContact CG-CG1 4.32Å; R405-I408 PolarHBondContact O-N 3.21Å; I408-M411 PolarHBondContact O-N 2.89Å; I408-E412 WeakPolarHBondContact O-CB 3.4Å; I408-E412 PolarHBondContact O-N 3.26Å
409	R	97.4	Very high	96.4	Very high	46 Å²	46	29.9 Å²	29.9	17%	0.174	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-41.8	-179.9	-172	60.1	60.1	-169.7	0.8	112.2	N387 R403 R405 P406 M411 E412 N413	N387-R409 PolarHBondContact O-NH1 2.81Å; N387-R409 PolarHBondContact O-NH2 2.7Å; R403-R409 PolarHBondContact O-NH2 3.05Å; R405-R409 PolarHBondContact O-N 3.17Å; R405-R409 VanDerWaalsContact O-N 3.14Å; P406-R409 PolarHBondContact O-N 2.62Å; R409-M411 VanDerWaalsContact C-N 3.32Å; R409-M411 PolarHBondContact O-N 3.24Å; R409-E412 IonicContact CZ-OE2 3.86Å; R409-E412 IonicContact NH1-OE2 2.7Å; R409-E412 PolarHBondContact NH1-OE2 2.94Å; R409-E412 PolarHBondContact O-N 3.3Å; R409-N413 WeakPolarHBondContact O-CB 3.29Å; R409-N413 PolarHBondContact O-N 3.23Å; R409-N413 PolarHBondContact O-ND2 3.16Å
410	G	96.8	Very high	96.2	Very high	2 Å²	2	29 Å²	29	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-56.7	-47.4	174.2	0	0	0	0	0	111.3	P406 D407 N413 G414 N415	P406-G410 PolarHBondContact O-N 2.78Å; D407-G410 PolarHBondContact O-N 3.37Å; G410-N413 PolarHBondContact O-N 3.26Å; G410-G414 PolarHBondContact O-N 3.33Å; G410-N415 CarbonylContact C-O 3.45Å; G410-N415 CarbonylContact O-C 3.56Å; G410-N415 WeakPolarHBondContact O-CA 3.43Å; G410-N415 PolarHBondContact O-N 2.79Å
411	M	96.1	Very high	96	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-45.3	179.2	-175.1	174.8	-172.1	0	0	112	I95 N98 P100 F152 Y377 D407 I408 R409 N413 G414 M416 A419	I95-M411 HydrophobicContact CG1-SD 3.94Å; I95-M411 VanDerWaalsContact O-CE 3.27Å; I95-M411 WeakPolarHBondContact O-CE 3.15Å; N98-M411 VanDerWaalsContact C-CE 3.47Å; N98-M411 HydrophobicContact CB-CE 4.01Å; N98-M411 HydrophobicContact CB-SD 3.8Å; N98-M411 WeakPolarHBondContact O-CE 3.4Å; P100-M411 HydrophobicContact CB-CB 4.44Å; P100-M411 HydrophobicContact CB-CG 4.29Å; F152-M411 HydrophobicContact CE2-SD 3.57Å; F152-M411 VanDerWaalsContact CE2-SD 3.57Å; F152-M411 HydrophobicContact CZ-CB 4.36Å; F152-M411 HydrophobicContact CZ-SD 3.76Å; Y377-M411 HydrophobicContact CE1-CE 3.86Å; Y377-M411 WeakPolarHBondContact OH-CE 3.49Å; D407-M411 PolarHBondContact O-N 3.41Å; I408-M411 PolarHBondContact O-N 2.89Å; R409-M411 VanDerWaalsContact C-N 3.32Å; R409-M411 PolarHBondContact O-N 3.24Å; M411-N413 PolarHBondContact O-N 3.12Å; M411-G414 PolarHBondContact O-N 2.93Å; M411-G414 VanDerWaalsContact O-N 3.14Å; M411-M416 HydrophobicContact CG-SD 4.13Å; M411-A419 HydrophobicContact CB-CB 3.97Å
412	E	97	Very high	95.9	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-61.2	-34.2	179.5	-159.2	-171.9	-116.9	0	0	112.8	R61 L64 P100 N387 I408 R409 G414	R61-E412 IonicContact CZ-OE1 3.45Å; R61-E412 IonicContact CZ-OE2 3.81Å; R61-E412 IonicContact NH1-OE1 3.9Å; R61-E412 PolarHBondContact NH1-OE1 3.18Å; R61-E412 VanDerWaalsContact NH1-OE1 3.14Å; R61-E412 IonicContact NH1-OE2 2.99Å; R61-E412 PolarHBondContact NH1-OE2 2.79Å; R61-E412 IonicContact NH2-OE1 3.17Å; R61-E412 PolarHBondContact NH2-OE1 3.17Å; R61-E412 IonicContact NH2-OE2 3.37Å; L64-E412 HydrophobicContact CD2-CG 4.17Å; P100-E412 HydrophobicContact CB-CB 3.72Å; P100-E412 HydrophobicContact CB-CG 4.01Å; P100-E412 HydrophobicContact CG-CB 4.38Å; P100-E412 HydrophobicContact CG-CG 4.2Å; N387-E412 WeakPolarHBondContact CB-OE1 3.3Å; N387-E412 PolarHBondContact ND2-OE1 3.4Å; I408-E412 WeakPolarHBondContact O-CB 3.4Å; I408-E412 PolarHBondContact O-N 3.26Å; R409-E412 IonicContact CZ-OE2 3.86Å; R409-E412 IonicContact NH1-OE2 2.7Å; R409-E412 PolarHBondContact NH1-OE2 2.94Å; R409-E412 PolarHBondContact O-N 3.3Å; E412-G414 VanDerWaalsContact C-N 3.3Å; E412-G414 PolarHBondContact O-N 3.45Å
413	N	96.6	Very high	95.7	Very high	81 Å²	81	37.5 Å²	37.5	43%	0.433	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	3	179.5	-73.5	-25.5	0	0	0	114	P65 R409 G410 M411	P65-N413 WeakPolarHBondContact CB-OD1 3.49Å; P65-N413 WeakPolarHBondContact CG-OD1 3.34Å; R409-N413 WeakPolarHBondContact O-CB 3.29Å; R409-N413 PolarHBondContact O-N 3.23Å; R409-N413 PolarHBondContact O-ND2 3.16Å; G410-N413 PolarHBondContact O-N 3.26Å; M411-N413 PolarHBondContact O-N 3.12Å
414	G	94.5	Very high	95.3	Very high	30 Å²	30	42.8 Å²	42.8	31%	0.309	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	7	179.1	0	0	0	0	0	114.6	F69 G410 M411 E412	F69-G414 WeakPolarHBondContact CE1-O 3.42Å; F69-G414 VanDerWaalsContact CZ-C 3.41Å; F69-G414 VanDerWaalsContact CZ-O 3.32Å; F69-G414 WeakPolarHBondContact CZ-O 3.37Å; G410-G414 PolarHBondContact O-N 3.33Å; M411-G414 PolarHBondContact O-N 2.93Å; M411-G414 VanDerWaalsContact O-N 3.14Å; E412-G414 VanDerWaalsContact C-N 3.3Å; E412-G414 PolarHBondContact O-N 3.45Å
415	N	95.3	Very high	95.3	Very high	74 Å²	74	45.1 Å²	45.1	40%	0.396	23%	0.232	S	C	.	.			trans	-102.2	85.7	-178.2	-170.2	-15.5	0	0	0	111.6	G410 L418 A419	G410-N415 CarbonylContact C-O 3.45Å; G410-N415 CarbonylContact O-C 3.56Å; G410-N415 WeakPolarHBondContact O-CA 3.43Å; G410-N415 PolarHBondContact O-N 2.79Å; N415-L418 HydrophobicContact CB-CB 4.17Å; N415-L418 WeakPolarHBondContact ND2-CB 3.39Å; N415-L418 WeakPolarHBondContact OD1-CB 3.3Å; N415-L418 PolarHBondContact OD1-N 3.35Å; N415-L418 VanDerWaalsContact OD1-N 3.09Å; N415-A419 VanDerWaalsContact O-CB 3.26Å; N415-A419 WeakPolarHBondContact O-CB 3.27Å; N415-A419 PolarHBondContact O-N 2.96Å
416	M	91	Very high	95.2	Very high	35 Å²	35	45 Å²	45	17%	0.172	23%	0.232	C	C	.	.	H	α-helix	trans	-69	-31.6	-176.6	-67.1	-60.3	-88.2	0	0	114.3	F69 I95 A96 M411 A419 S420	F69-M416 HydrophobicContact CD1-CG 3.82Å; F69-M416 HydrophobicContact CD1-SD 4.49Å; F69-M416 HydrophobicContact CD2-CE 4Å; F69-M416 HydrophobicContact CD2-CG 3.93Å; F69-M416 HydrophobicContact CD2-SD 3.49Å; F69-M416 WeakPolarHBondContact CD2-SD 3.44Å; F69-M416 HydrophobicContact CE1-CG 3.36Å; F69-M416 HydrophobicContact CE1-SD 4.15Å; F69-M416 HydrophobicContact CE2-CE 4.21Å; F69-M416 HydrophobicContact CE2-CG 3.53Å; F69-M416 HydrophobicContact CE2-SD 3.1Å; F69-M416 WeakPolarHBondContact CE2-SD 3.49Å; F69-M416 HydrophobicContact CG-CE 4.43Å; F69-M416 HydrophobicContact CG-CG 4.06Å; F69-M416 HydrophobicContact CG-SD 4.17Å; F69-M416 HydrophobicContact CZ-CB 4.47Å; F69-M416 HydrophobicContact CZ-CG 3.16Å; F69-M416 HydrophobicContact CZ-SD 3.43Å; F69-M416 WeakPolarHBondContact CZ-SD 3.33Å; I95-M416 HydrophobicContact CB-CE 4.48Å; I95-M416 HydrophobicContact CG1-CE 4.49Å; I95-M416 HydrophobicContact CG2-CE 3.61Å; A96-M416 HydrophobicContact CB-CE 4.37Å; M411-M416 HydrophobicContact CG-SD 4.13Å; M416-A419 PolarHBondContact O-N 3.44Å; M416-S420 WeakPolarHBondContact O-CB 3.39Å; M416-S420 PolarHBondContact O-N 2.89Å; M416-S420 PolarHBondContact O-OG 2.91Å
417	D	91.1	Very high	94.9	Very high	119 Å²	119	45.5 Å²	45.5	64%	0.636	23%	0.231	S	C	*	.	H	α-helix	trans	-68.3	-49.1	180	-65.5	-23.2	0	0	0	109.8	A419 S420 Q421	D417-A419 VanDerWaalsContact C-N 3.32Å; D417-A419 PolarHBondContact O-N 3.44Å; D417-S420 PolarHBondContact O-N 2.89Å; D417-Q421 VanDerWaalsContact O-CG 3.29Å; D417-Q421 WeakPolarHBondContact O-CG 3.23Å; D417-Q421 PolarHBondContact O-N 3.03Å
418	L	94.5	Very high	94.7	Very high	71 Å²	71	47.9 Å²	47.9	37%	0.372	24%	0.243	S	C	.	.	H	α-helix	trans	-58.3	-46.8	173.3	178.3	65.9	0	0	0	110.9	N415 S420 Q421 E422	N415-L418 HydrophobicContact CB-CB 4.17Å; N415-L418 WeakPolarHBondContact ND2-CB 3.39Å; N415-L418 WeakPolarHBondContact OD1-CB 3.3Å; N415-L418 PolarHBondContact OD1-N 3.35Å; N415-L418 VanDerWaalsContact OD1-N 3.09Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.05Å; L418-Q421 PolarHBondContact O-N 3.23Å; L418-E422 HydrophobicContact CD1-CG 3.82Å; L418-E422 HydrophobicContact CG-CG 4.25Å; L418-E422 WeakPolarHBondContact O-CB 3.2Å; L418-E422 WeakPolarHBondContact O-CG 3.23Å; L418-E422 PolarHBondContact O-N 2.68Å
419	A	94.5	Very high	94.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-39	-178.2	0	0	0	0	0	112.3	I95 D407 M411 N415 M416 D417 K423	I95-A419 HydrophobicContact CD1-CB 3.34Å; I95-A419 WeakPolarHBondContact CD1-O 3.48Å; I95-A419 HydrophobicContact CG1-CB 4.49Å; D407-A419 WeakPolarHBondContact CB-O 3.43Å; D407-A419 WeakPolarHBondContact O-CB 3.28Å; M411-A419 HydrophobicContact CB-CB 3.97Å; N415-A419 VanDerWaalsContact O-CB 3.26Å; N415-A419 WeakPolarHBondContact O-CB 3.27Å; N415-A419 PolarHBondContact O-N 2.96Å; M416-A419 PolarHBondContact O-N 3.44Å; D417-A419 VanDerWaalsContact C-N 3.32Å; D417-A419 PolarHBondContact O-N 3.44Å; A419-K423 WeakPolarHBondContact O-CB 3.06Å; A419-K423 PolarHBondContact O-N 2.68Å
420	S	91.4	Very high	94.5	Very high	49 Å²	49	49.6 Å²	49.6	34%	0.343	25%	0.252	S	S	.	.	H	α-helix	trans	-69.3	-45.9	177.1	-57.5	0	0	0	0	111.9	I95 M416 D417 L418 K423 E424	I95-S420 WeakPolarHBondContact CG2-OG 3.36Å; M416-S420 WeakPolarHBondContact O-CB 3.39Å; M416-S420 PolarHBondContact O-N 2.89Å; M416-S420 PolarHBondContact O-OG 2.91Å; D417-S420 PolarHBondContact O-N 2.89Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.05Å; S420-K423 PolarHBondContact O-N 2.77Å; S420-E424 PolarHBondContact O-N 3.31Å; S420-E424 VanDerWaalsContact O-N 3.1Å
421	Q	94.5	Very high	94.3	Very high	125 Å²	125	52.7 Å²	52.7	58%	0.584	26%	0.263	S	S	*	.	H	α-helix	trans	-61.8	-47.1	178.8	-71.5	170.5	30.4	0	0	111.5	D417 L418 K423 E424 R425	D417-Q421 VanDerWaalsContact O-CG 3.29Å; D417-Q421 WeakPolarHBondContact O-CG 3.23Å; D417-Q421 PolarHBondContact O-N 3.03Å; L418-Q421 PolarHBondContact O-N 3.23Å; Q421-K423 VanDerWaalsContact C-N 3.33Å; Q421-K423 PolarHBondContact O-N 3.11Å; Q421-E424 PolarHBondContact O-N 3.49Å; Q421-R425 WeakPolarHBondContact O-CB 3.32Å; Q421-R425 PolarHBondContact O-N 2.86Å
422	E	97.2	Very high	94.2	Very high	38 Å²	38	57 Å²	57	18%	0.178	28%	0.283	C	S	.	.	H	α-helix	trans	-66.7	-36.8	179.2	-71.8	-66.2	102.6	0	0	111.5	P406 D407 L418 E424 R425 L426	P406-E422 HydrophobicContact CB-CB 4.29Å; P406-E422 HydrophobicContact CB-CG 4.07Å; P406-E422 VanDerWaalsContact CB-OE2 3.29Å; P406-E422 WeakPolarHBondContact CB-OE2 3.47Å; P406-E422 HydrophobicContact CG-CB 4.3Å; P406-E422 HydrophobicContact CG-CG 4.39Å; P406-E422 WeakPolarHBondContact CG-OE2 3.34Å; D407-E422 HydrophobicContact CB-CB 3.97Å; L418-E422 HydrophobicContact CD1-CG 3.82Å; L418-E422 HydrophobicContact CG-CG 4.25Å; L418-E422 WeakPolarHBondContact O-CB 3.2Å; L418-E422 WeakPolarHBondContact O-CG 3.23Å; L418-E422 PolarHBondContact O-N 2.68Å; E422-E424 PolarHBondContact O-N 2.85Å; E422-R425 PolarHBondContact O-N 2.94Å; E422-R425 IonicContact OE1-CZ 2.77Å; E422-R425 IonicContact OE1-NE 2.76Å; E422-R425 PolarHBondContact OE1-NE 3.02Å; E422-R425 IonicContact OE1-NH2 3.87Å; E422-R425 IonicContact OE2-CZ 3.67Å; E422-R425 IonicContact OE2-NE 3.55Å; E422-R425 PolarHBondContact OE2-NE 3.06Å; E422-R425 IonicContact OE2-NH2 3.52Å; E422-R425 PolarHBondContact OE2-NH2 3.02Å; E422-L426 WeakPolarHBondContact O-CB 3.46Å; E422-L426 WeakPolarHBondContact O-CG 3.08Å; E422-L426 PolarHBondContact O-N 2.99Å
423	K	93.2	Very high	94.1	Very high	18 Å²	18	58.2 Å²	58.2	8%	0.078	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-46.8	175.8	-178.9	178.1	179.3	177.8	0	111.4	M93 I95 N98 F152 D407 A419 S420 Q421 L426 E427	M93-K423 PolarHBondContact O-NZ 3.23Å; I95-K423 HydrophobicContact CD1-CD 4.38Å; N98-K423 PolarHBondContact OD1-NZ 2.75Å; F152-K423 HydrophobicContact CE1-CD 4.25Å; D407-K423 HydrophobicContact CB-CB 3.87Å; A419-K423 WeakPolarHBondContact O-CB 3.06Å; A419-K423 PolarHBondContact O-N 2.68Å; S420-K423 PolarHBondContact O-N 2.77Å; Q421-K423 VanDerWaalsContact C-N 3.33Å; Q421-K423 PolarHBondContact O-N 3.11Å; K423-L426 PolarHBondContact O-N 2.83Å; K423-E427 WeakPolarHBondContact CE-OE1 3.07Å; K423-E427 WeakPolarHBondContact O-CB 3.41Å; K423-E427 WeakPolarHBondContact O-CG 2.93Å; K423-E427 PolarHBondContact O-N 2.98Å
424	E	91.2	Very high	93.9	Very high	121 Å²	121	59.1 Å²	59.1	57%	0.565	29%	0.291	S	S	*	.	H	α-helix	trans	-61.8	-45.8	177.1	-176.4	173.3	-167.5	0	0	111.4	S420 Q421 E422 L426 E427 E428	S420-E424 PolarHBondContact O-N 3.31Å; S420-E424 VanDerWaalsContact O-N 3.1Å; Q421-E424 PolarHBondContact O-N 3.49Å; E422-E424 PolarHBondContact O-N 2.85Å; E424-L426 PolarHBondContact O-N 3.38Å; E424-E427 PolarHBondContact O-N 3.11Å; E424-E428 WeakPolarHBondContact O-CB 3.37Å; E424-E428 PolarHBondContact O-N 3.4Å
425	R	96.8	Very high	93.9	Very high	99 Å²	99	64.6 Å²	64.6	37%	0.374	30%	0.302	S	S	.	.	H	α-helix	trans	-58.5	-45.9	177.4	-171.4	-176.6	65.8	71.4	-0.1	112.2	Q421 E422 K429 Y480	Q421-R425 WeakPolarHBondContact O-CB 3.32Å; Q421-R425 PolarHBondContact O-N 2.86Å; E422-R425 PolarHBondContact O-N 2.94Å; E422-R425 IonicContact OE1-CZ 2.77Å; E422-R425 IonicContact OE1-NE 2.76Å; E422-R425 PolarHBondContact OE1-NE 3.02Å; E422-R425 IonicContact OE1-NH2 3.87Å; E422-R425 IonicContact OE2-CZ 3.67Å; E422-R425 IonicContact OE2-NE 3.55Å; E422-R425 PolarHBondContact OE2-NE 3.06Å; E422-R425 IonicContact OE2-NH2 3.52Å; E422-R425 PolarHBondContact OE2-NH2 3.02Å; R425-K429 WeakPolarHBondContact O-CB 3.39Å; R425-K429 PolarHBondContact O-N 3.05Å; R425-Y480 PolarHBondContact NH1-OXT 3.49Å; R425-Y480 PolarHBondContact NH2-OXT 3.46Å
426	L	96.5	Very high	93.9	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-44.1	178.8	-70	174.6	0	0	0	112.1	L155 R405 P406 D407 E422 K423 E424 K429 Q430 Y480	L155-L426 HydrophobicContact CD1-CB 4.17Å; L155-L426 HydrophobicContact CD1-CD1 4.49Å; L155-L426 HydrophobicContact CD1-CD2 4.1Å; L155-L426 HydrophobicContact CD1-CG 4.49Å; L155-L426 HydrophobicContact CD2-CB 4.5Å; R405-L426 HydrophobicContact CG-CD1 3.99Å; P406-L426 HydrophobicContact CG-CD1 4.1Å; D407-L426 HydrophobicContact CB-CD1 4.2Å; E422-L426 WeakPolarHBondContact O-CB 3.46Å; E422-L426 WeakPolarHBondContact O-CG 3.08Å; E422-L426 PolarHBondContact O-N 2.99Å; K423-L426 PolarHBondContact O-N 2.83Å; E424-L426 PolarHBondContact O-N 3.38Å; L426-K429 PolarHBondContact O-N 2.86Å; L426-Q430 WeakPolarHBondContact O-CB 3.32Å; L426-Q430 PolarHBondContact O-N 3.3Å; L426-Y480 VanDerWaalsContact CD2-CA 3.46Å; L426-Y480 HydrophobicContact CD2-CD1 4.07Å; L426-Y480 WeakPolarHBondContact CD2-OXT 3.4Å
427	E	91.8	Very high	94	Very high	43 Å²	43	67.1 Å²	67.1	20%	0.201	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-37.2	178	-74	-178.3	-171.2	0	0	111.6	T92 K423 E424 R431	T92-E427 WeakPolarHBondContact CG2-OE2 3.22Å; T92-E427 PolarHBondContact OG1-OE2 2.9Å; K423-E427 WeakPolarHBondContact CE-OE1 3.07Å; K423-E427 WeakPolarHBondContact O-CB 3.41Å; K423-E427 WeakPolarHBondContact O-CG 2.93Å; K423-E427 PolarHBondContact O-N 2.98Å; E424-E427 PolarHBondContact O-N 3.11Å; E427-R431 VanDerWaalsContact O-CG 3.28Å; E427-R431 WeakPolarHBondContact O-CG 3.4Å; E427-R431 PolarHBondContact O-N 2.97Å; E427-R431 VanDerWaalsContact O-N 3.15Å; E427-R431 PolarHBondContact O-NE 3.22Å
428	E	93.4	Very high	94.1	Very high	50 Å²	50	65 Å²	65	23%	0.234	31%	0.307	C	S	.	.	H	α-helix	trans	-68	-48.5	172.8	-171.2	67.8	-115.8	0	0	112	E424 Q430 R431 E432 R435	E424-E428 WeakPolarHBondContact O-CB 3.37Å; E424-E428 PolarHBondContact O-N 3.4Å; E428-Q430 PolarHBondContact O-N 3.32Å; E428-R431 VanDerWaalsContact CD-CZ 3.47Å; E428-R431 VanDerWaalsContact CD-NH2 3.34Å; E428-R431 CarbonylContact O-C 3.51Å; E428-R431 WeakPolarHBondContact O-CA 3.41Å; E428-R431 WeakPolarHBondContact O-CB 3.21Å; E428-R431 PolarHBondContact O-N 3.14Å; E428-R431 IonicContact OE1-CZ 2.7Å; E428-R431 IonicContact OE1-NH1 3.47Å; E428-R431 PolarHBondContact OE1-NH1 3.15Å; E428-R431 VanDerWaalsContact OE1-NH1 3.11Å; E428-R431 IonicContact OE1-NH2 3.14Å; E428-R431 IonicContact OE2-CZ 3.24Å; E428-R431 IonicContact OE2-NH1 2.94Å; E428-R431 PolarHBondContact OE2-NH1 3.01Å; E428-R431 IonicContact OE2-NH2 2.95Å; E428-R431 PolarHBondContact OE2-NH2 3.09Å; E428-E432 HydrophobicContact CG-CG 4.42Å; E428-E432 PolarHBondContact O-N 3.43Å; E428-R435 IonicContact OE1-NH2 2.83Å; E428-R435 PolarHBondContact OE1-NH2 3.14Å
429	K	96.5	Very high	94.1	Very high	55 Å²	55	71.8 Å²	71.8	24%	0.239	33%	0.328	C	S	.	.	H	α-helix	trans	-53.5	-44.2	176.9	-179.9	175.5	178.2	171.8	0	111.3	R425 L426 E432 A433 D478 Y480	R425-K429 WeakPolarHBondContact O-CB 3.39Å; R425-K429 PolarHBondContact O-N 3.05Å; L426-K429 PolarHBondContact O-N 2.86Å; K429-E432 PolarHBondContact O-N 3.15Å; K429-A433 WeakPolarHBondContact O-CB 3.47Å; K429-A433 PolarHBondContact O-N 2.93Å; K429-D478 VanDerWaalsContact CE-O 3.27Å; K429-D478 WeakPolarHBondContact CE-O 3.46Å; K429-D478 PolarHBondContact NZ-O 3.32Å; K429-D478 IonicContact NZ-OD1 2.66Å; K429-D478 PolarHBondContact NZ-OD1 2.71Å; K429-D478 IonicContact NZ-OD2 3.75Å; K429-D478 PolarHBondContact NZ-OD2 3.3Å; K429-Y480 PolarHBondContact NZ-O 2.81Å
430	Q	94.8	Very high	94.1	Very high	27 Å²	27	78.8 Å²	78.8	13%	0.126	36%	0.361	C	S	.	.	H	α-helix	trans	-64.7	-40.1	176.5	-175.9	-178.5	-117.6	0	0	112.6	L155 H178 L426 E428 R434	L155-Q430 VanDerWaalsContact CA-OE1 3.25Å; L155-Q430 HydrophobicContact CD2-CB 4.41Å; H178-Q430 PolarHBondContact CE1-NE2 3.1Å; H178-Q430 VanDerWaalsContact CE1-NE2 3.35Å; H178-Q430 PolarHBondContact NE2-NE2 2.93Å; H178-Q430 VanDerWaalsContact NE2-NE2 3.15Å; L426-Q430 WeakPolarHBondContact O-CB 3.32Å; L426-Q430 PolarHBondContact O-N 3.3Å; E428-Q430 PolarHBondContact O-N 3.32Å; Q430-R434 WeakPolarHBondContact O-CB 3.26Å; Q430-R434 PolarHBondContact O-N 2.86Å
431	R	91.8	Very high	94.2	Very high	66 Å²	66	85.2 Å²	85.2	25%	0.249	39%	0.385	C	S	.	.	H	α-helix	trans	-66.3	-40.7	177.5	-78.1	-179	-73.1	125.7	-7	111.8	E427 E428 R434 R435	E427-R431 VanDerWaalsContact O-CG 3.28Å; E427-R431 WeakPolarHBondContact O-CG 3.4Å; E427-R431 PolarHBondContact O-N 2.97Å; E427-R431 VanDerWaalsContact O-N 3.15Å; E427-R431 PolarHBondContact O-NE 3.22Å; E428-R431 VanDerWaalsContact CD-CZ 3.47Å; E428-R431 VanDerWaalsContact CD-NH2 3.34Å; E428-R431 CarbonylContact O-C 3.51Å; E428-R431 WeakPolarHBondContact O-CA 3.41Å; E428-R431 WeakPolarHBondContact O-CB 3.21Å; E428-R431 PolarHBondContact O-N 3.14Å; E428-R431 IonicContact OE1-CZ 2.7Å; E428-R431 IonicContact OE1-NH1 3.47Å; E428-R431 PolarHBondContact OE1-NH1 3.15Å; E428-R431 VanDerWaalsContact OE1-NH1 3.11Å; E428-R431 IonicContact OE1-NH2 3.14Å; E428-R431 IonicContact OE2-CZ 3.24Å; E428-R431 IonicContact OE2-NH1 2.94Å; E428-R431 PolarHBondContact OE2-NH1 3.01Å; E428-R431 IonicContact OE2-NH2 2.95Å; E428-R431 PolarHBondContact OE2-NH2 3.09Å; R431-R434 PolarHBondContact O-N 2.93Å; R431-R435 WeakPolarHBondContact O-CG 3.09Å; R431-R435 PolarHBondContact O-N 3.05Å; R431-R435 PolarHBondContact O-NE 3.16Å
432	E	94.9	Very high	94.1	Very high	94 Å²	94	81.4 Å²	81.4	44%	0.439	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-52.8	173.3	-72.4	178.2	167.4	0	0	111.1	E428 K429 R434 R435 E436	E428-E432 HydrophobicContact CG-CG 4.42Å; E428-E432 PolarHBondContact O-N 3.43Å; K429-E432 PolarHBondContact O-N 3.15Å; E432-R434 PolarHBondContact O-N 2.66Å; E432-R435 VanDerWaalsContact CG-NH2 3.26Å; E432-R435 WeakPolarHBondContact O-CA 3.29Å; E432-R435 WeakPolarHBondContact O-CB 3.4Å; E432-R435 PolarHBondContact O-N 2.7Å; E432-E436 PolarHBondContact O-N 2.7Å
433	A	94.6	Very high	93.7	Very high	28 Å²	28	88 Å²	88	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-59.3	-33.7	179	0	0	0	0	0	112.7	K429 R437	K429-A433 WeakPolarHBondContact O-CB 3.47Å; K429-A433 PolarHBondContact O-N 2.93Å; A433-R437 WeakPolarHBondContact O-CG 3.35Å; A433-R437 PolarHBondContact O-N 3.49Å; A433-R437 PolarHBondContact O-NH1 3.16Å
434	R	93.2	Very high	93.6	Very high	100 Å²	100	90.8 Å²	90.8	38%	0.377	42%	0.416	S	S	.	.	H	α-helix	trans	-67.4	-43.8	172.7	-179.4	-178.5	174.2	-157.8	-3.5	112	D9 H179 Q430 R431 E432 E436 R437 A438	D9-R434 IonicContact OD2-NH1 2.92Å; D9-R434 PolarHBondContact OD2-NH1 2.86Å; H179-R434 PolarHBondContact CD2-NH1 3.49Å; H179-R434 PolarHBondContact NE2-NH1 2.92Å; Q430-R434 WeakPolarHBondContact O-CB 3.26Å; Q430-R434 PolarHBondContact O-N 2.86Å; R431-R434 PolarHBondContact O-N 2.93Å; E432-R434 PolarHBondContact O-N 2.66Å; R434-E436 VanDerWaalsContact C-N 3.31Å; R434-R437 PolarHBondContact O-N 2.84Å; R434-A438 WeakPolarHBondContact O-CB 3.35Å; R434-A438 PolarHBondContact O-N 3.4Å
435	R	93.8	Very high	93.6	Very high	144 Å²	144	93 Å²	93	54%	0.543	43%	0.427	S	S	.	.	H	α-helix	trans	-62.9	-38.8	177.3	-76.5	-178.2	-77.6	172.7	-7.4	111.5	E428 R431 E432 R439	E428-R435 IonicContact OE1-NH2 2.83Å; E428-R435 PolarHBondContact OE1-NH2 3.14Å; R431-R435 WeakPolarHBondContact O-CG 3.09Å; R431-R435 PolarHBondContact O-N 3.05Å; R431-R435 PolarHBondContact O-NE 3.16Å; E432-R435 VanDerWaalsContact CG-NH2 3.26Å; E432-R435 WeakPolarHBondContact O-CA 3.29Å; E432-R435 WeakPolarHBondContact O-CB 3.4Å; E432-R435 PolarHBondContact O-N 2.7Å; R435-R439 WeakPolarHBondContact O-CB 3.44Å; R435-R439 PolarHBondContact O-N 3.43Å
436	E	94.6	Very high	93.5	Very high	110 Å²	110	89.7 Å²	89.7	51%	0.514	42%	0.418	S	S	.	.	H	α-helix	trans	-64.6	-51.9	175.3	-70.4	179.3	160	0	0	111.5	E432 R434 A438 R439 E440	E432-E436 PolarHBondContact O-N 2.7Å; R434-E436 VanDerWaalsContact C-N 3.31Å; E436-A438 VanDerWaalsContact C-N 3.26Å; E436-A438 PolarHBondContact O-N 3.37Å; E436-R439 WeakPolarHBondContact O-CB 3.29Å; E436-R439 PolarHBondContact O-N 2.99Å; E436-E440 WeakPolarHBondContact O-CG 3.35Å; E436-E440 PolarHBondContact O-N 3.14Å
437	R	94.3	Very high	93.3	Very high	53 Å²	53	92.7 Å²	92.7	20%	0.2	43%	0.429	C	S	.	.	H	α-helix	trans	-55.5	-41.2	175.2	-76	-170.8	-62.5	-83.7	2.4	112.8	A433 R434 E440 E441 A442	A433-R437 WeakPolarHBondContact O-CG 3.35Å; A433-R437 PolarHBondContact O-N 3.49Å; A433-R437 PolarHBondContact O-NH1 3.16Å; R434-R437 PolarHBondContact O-N 2.84Å; R437-E440 CarbonylContact O-C 3.57Å; R437-E440 PolarHBondContact O-N 3.31Å; R437-E441 PolarHBondContact O-N 3.49Å; R437-E441 VanDerWaalsContact O-N 3.1Å; R437-A442 PolarHBondContact O-N 3.39Å
438	A	92.9	Very high	93.6	Very high	73 Å²	73	91.3 Å²	91.3	60%	0.603	42%	0.422	S	S	*	.	H	α-helix	trans	-65.3	-38.5	176.8	0	0	0	0	0	112.5	R434 E436 E440 E441	R434-A438 WeakPolarHBondContact O-CB 3.35Å; R434-A438 PolarHBondContact O-N 3.4Å; E436-A438 VanDerWaalsContact C-N 3.26Å; E436-A438 PolarHBondContact O-N 3.37Å; A438-E440 VanDerWaalsContact C-N 3.3Å; A438-E441 PolarHBondContact O-N 3.05Å
439	R	94.8	Very high	93.8	Very high	214 Å²	214	89.1 Å²	89.1	81%	0.808	41%	0.411	S	S	*	.	H	α-helix	trans	-66.5	-33.8	175.5	-177.4	-175.2	-71.1	161.4	-1.8	112.1	R435 E436 E441	R435-R439 WeakPolarHBondContact O-CB 3.44Å; R435-R439 PolarHBondContact O-N 3.43Å; E436-R439 WeakPolarHBondContact O-CB 3.29Å; E436-R439 PolarHBondContact O-N 2.99Å; R439-E441 VanDerWaalsContact C-N 3.31Å
440	E	95.3	Very high	93.9	Very high	147 Å²	147	92 Å²	92	69%	0.687	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-1	179.1	-66.6	179.3	174.5	0	0	113.4	E436 R437 A438 A442	E436-E440 WeakPolarHBondContact O-CG 3.35Å; E436-E440 PolarHBondContact O-N 3.14Å; R437-E440 CarbonylContact O-C 3.57Å; R437-E440 PolarHBondContact O-N 3.31Å; A438-E440 VanDerWaalsContact C-N 3.3Å; E440-A442 HydrophobicContact CB-CB 4.2Å; E440-A442 PolarHBondContact O-N 2.92Å; E440-A442 VanDerWaalsContact O-N 3.15Å
441	E	92.9	Very high	94	Very high	184 Å²	184	95.1 Å²	95.1	86%	0.86	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	29.8	-171.9	-59.1	179.8	179.3	0	0	112.5	R437 A438 R439	R437-E441 PolarHBondContact O-N 3.49Å; R437-E441 VanDerWaalsContact O-N 3.1Å; A438-E441 PolarHBondContact O-N 3.05Å; R439-E441 VanDerWaalsContact C-N 3.31Å
442	A	91.5	Very high	94.3	Very high	46 Å²	46	92.8 Å²	92.8	38%	0.38	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-90	130.4	-178.3	0	0	0	0	0	111.1	R437 E440	R437-A442 PolarHBondContact O-N 3.39Å; E440-A442 HydrophobicContact CB-CB 4.2Å; E440-A442 PolarHBondContact O-N 2.92Å; E440-A442 VanDerWaalsContact O-N 3.15Å
443	E	89.1	Confident	94.4	Very high	176 Å²	176	93.3 Å²	93.3	82%	0.822	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-84.4	142.9	172.6	-66.9	-170.8	164.6	0	0	111.4	Q445	E443-Q445 PolarHBondContact O-N 3.48Å
444	W	92.2	Very high	94.5	Very high	76 Å²	76	92 Å²	92	29%	0.288	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-70.4	128.3	171.3	175.9	-97.1	0	0	0	110.2	L156 P477	L156-W444 HydrophobicContact CD1-CD2 4.46Å; L156-W444 HydrophobicContact CD1-CG 4.31Å; L156-W444 HydrophobicContact CD2-CB 4.17Å; L156-W444 HydrophobicContact CD2-CD2 3.62Å; L156-W444 HydrophobicContact CD2-CE3 3.97Å; L156-W444 HydrophobicContact CD2-CG 3.68Å; L156-W444 HydrophobicContact CG-CD2 3.83Å; L156-W444 HydrophobicContact CG-CE3 4.38Å; L156-W444 HydrophobicContact CG-CG 4.09Å; L156-W444 HydrophobicContact CG-CZ2 4.11Å; W444-P477 HydrophobicContact CH2-CB 3.79Å; W444-P477 HydrophobicContact CH2-CG 3.84Å; W444-P477 HydrophobicContact CZ2-CG 4.44Å; W444-P477 HydrophobicContact CZ3-CB 4.43Å
445	Q	90.9	Very high	94.7	Very high	169 Å²	169	91.5 Å²	91.5	79%	0.79	45%	0.446	S	S	*	.			trans	-106	119.7	172	-65	-175.4	4.8	0	0	109.4	E443	E443-Q445 PolarHBondContact O-N 3.48Å
446	T	93.9	Very high	94.9	Very high	29 Å²	29	88.3 Å²	88.3	18%	0.178	43%	0.434	C	S	.	.			trans	-69.8	148.1	171.5	49.4	0	0	0	0	110	V176 F449 W462	V176-T446 HydrophobicContact CB-CG2 3.72Å; V176-T446 HydrophobicContact CG1-CG2 3.97Å; V176-T446 VanDerWaalsContact O-CG2 3.31Å; V176-T446 WeakPolarHBondContact O-CG2 3.25Å; T446-F449 WeakPolarHBondContact CB-O 3.38Å; T446-F449 PolarHBondContact OG1-O 3.31Å; T446-W462 HydrophobicContact CG2-CH2 3.97Å; T446-W462 HydrophobicContact CG2-CZ3 3.69Å; T446-W462 WeakPolarHBondContact OG1-CZ3 3.25Å
447	R	93.1	Very high	95.1	Very high	62 Å²	62	85.6 Å²	85.6	23%	0.234	43%	0.425	C	S	.	.	S	Bend	trans	-96.3	-42.4	-170.2	-167.5	170.4	-175.9	-178.3	9.4	113.1	E174 N472 D475 C476	E174-R447 PolarHBondContact OE1-N 3.33Å; R447-N472 PolarHBondContact NH2-O 3.35Å; R447-N472 VanDerWaalsContact NH2-O 3.15Å; R447-D475 PolarHBondContact NH1-O 2.99Å; R447-C476 PolarHBondContact NH1-SG 3.47Å
448	W	97.6	Very high	95.2	Very high	15 Å²	15	85.2 Å²	85.2	6%	0.057	44%	0.438	C	S	.	.	S	Bend	trans	-109.3	-9	-169.3	-47.8	114.8	0	0	0	112.7	E174 Y464 A465 Y468 F473	E174-W448 WeakPolarHBondContact OE2-CA 3.49Å; E174-W448 WeakPolarHBondContact OE2-CB 3.21Å; E174-W448 PolarHBondContact OE2-N 3.1Å; W448-Y464 HydrophobicContact CB-CE2 4.48Å; W448-Y464 WeakPolarHBondContact O-CD2 3.44Å; W448-A465 WeakPolarHBondContact O-CB 3.49Å; W448-A465 PolarHBondContact O-N 3.38Å; W448-Y468 AromaticContact CD1-CD2 3.85Å; W448-Y468 AromaticContact CD2-CD2 3.57Å; W448-Y468 HydrophobicContact CD2-CD2 3.57Å; W448-Y468 HydrophobicContact CD2-CG 4.31Å; W448-Y468 AromaticContact CE2-CD2 3.48Å; W448-Y468 VanDerWaalsContact CE2-CD2 3.48Å; W448-Y468 HydrophobicContact CE3-CD2 4.12Å; W448-Y468 HydrophobicContact CE3-CG 4.49Å; W448-Y468 AromaticContact CG-CD2 3.78Å; W448-Y468 HydrophobicContact CG-CD2 3.78Å; W448-Y468 HydrophobicContact CH2-CD2 4.43Å; W448-Y468 AromaticContact CZ2-CD2 3.94Å; W448-Y468 HydrophobicContact CZ2-CD2 3.94Å; W448-Y468 HydrophobicContact CZ2-CE2 4.45Å; W448-Y468 AromaticContact NE1-CD2 3.66Å; W448-Y468 AromaticContact NE1-CE2 3.93Å; W448-F473 HydrophobicContact CH2-CD1 4.02Å; W448-F473 HydrophobicContact CH2-CE1 4.12Å; W448-F473 AromaticContact CZ2-CD1 3.8Å; W448-F473 HydrophobicContact CZ2-CD1 3.8Å; W448-F473 AromaticContact CZ2-CE1 3.97Å; W448-F473 HydrophobicContact CZ2-CE1 3.97Å
449	F	98.3	Very high	95.4	Very high	3 Å²	3	84.4 Å²	84.4	1%	0.013	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	154.9	177	-64.7	-97.3	0	0	0	110.3	I172 E174 V176 A184 H186 T446 W462 L463 Y464	I172-F449 HydrophobicContact CG2-CZ 4.4Å; E174-F449 HydrophobicContact CB-CD2 3.64Å; E174-F449 HydrophobicContact CB-CE2 3.8Å; E174-F449 PolarHBondContact OE2-N 2.89Å; V176-F449 HydrophobicContact CG1-CB 3.78Å; V176-F449 HydrophobicContact CG1-CD2 4.3Å; V176-F449 HydrophobicContact CG1-CG 4.22Å; A184-F449 HydrophobicContact CB-CB 4.24Å; A184-F449 HydrophobicContact CB-CD1 3.54Å; A184-F449 HydrophobicContact CB-CD2 4.09Å; A184-F449 HydrophobicContact CB-CE1 3.85Å; A184-F449 HydrophobicContact CB-CE2 4.37Å; A184-F449 HydrophobicContact CB-CG 3.69Å; A184-F449 HydrophobicContact CB-CZ 4.26Å; H186-F449 HydrophobicContact CB-CE1 3.93Å; H186-F449 HydrophobicContact CB-CZ 4.01Å; T446-F449 WeakPolarHBondContact CB-O 3.38Å; T446-F449 PolarHBondContact OG1-O 3.31Å; F449-W462 HydrophobicContact CB-CB 4.42Å; F449-W462 HydrophobicContact CB-CE3 4.13Å; F449-L463 CarbonylContact C-O 3.6Å; F449-L463 WeakPolarHBondContact CA-O 2.99Å; F449-Y464 HydrophobicContact CE1-CD2 4.36Å; F449-Y464 HydrophobicContact CE2-CD2 4.49Å; F449-Y464 HydrophobicContact CZ-CD2 4.2Å
450	Y	97.6	Very high	95.5	Very high	115 Å²	115	79.6 Å²	79.6	45%	0.451	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.2	173.6	64.2	-86.2	0	0	0	110.6	G452 W462 L463 A465	Y450-G452 PolarHBondContact O-N 3.36Å; Y450-W462 WeakPolarHBondContact O-CA 3.36Å; Y450-L463 HydrophobicContact CD1-CB 4.35Å; Y450-L463 VanDerWaalsContact CD1-O 3.27Å; Y450-L463 WeakPolarHBondContact CD1-O 3.26Å; Y450-L463 HydrophobicContact CD2-CB 4.5Å; Y450-L463 HydrophobicContact CE1-CB 3.78Å; Y450-L463 HydrophobicContact CE2-CB 3.96Å; Y450-L463 HydrophobicContact CE2-CD1 3.91Å; Y450-L463 HydrophobicContact CE2-CG 4.4Å; Y450-L463 PolarHBondContact N-O 3.37Å; Y450-L463 PolarHBondContact O-N 3.47Å; Y450-A465 HydrophobicContact CD1-CB 4.06Å
451	P	97.1	Very high	95.6	Very high	93 Å²	93	72.8 Å²	72.8	60%	0.604	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	130.8	175.7	29	-33.5	0	0	0	109.7	W462	P451-W462 HydrophobicContact CB-CH2 4.37Å; P451-W462 HydrophobicContact CB-CZ3 4.35Å; P451-W462 HydrophobicContact CG-CH2 4.49Å; P451-W462 HydrophobicContact CG-CZ3 4.39Å
452	G	96.9	Very high	95.8	Very high	18 Å²	18	66.1 Å²	66.1	19%	0.186	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	-167.7	179.2	0	0	0	0	0	111.4	Y450 P460 D461	Y450-G452 PolarHBondContact O-N 3.36Å; G452-P460 WeakPolarHBondContact O-CA 3.34Å; G452-D461 PolarHBondContact N-O 3.05Å; G452-D461 PolarHBondContact O-N 3.02Å; G452-D461 VanDerWaalsContact O-O 3.08Å
453	N	97.6	Very high	96.1	Very high	105 Å²	105	65.5 Å²	65.5	56%	0.561	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	137.5	172.6	-69.8	15.3	0	0	0	109.1	G458 T459	N453-G458 PolarHBondContact ND2-O 3.38Å; N453-T459 CarbonylContact C-O 3.43Å; N453-T459 WeakPolarHBondContact CA-O 3.43Å
454	N	97.9	Very high	96.6	Very high	1 Å²	1	59 Å²	59	1%	0.005	32%	0.316	C	S	.	.			trans	-58.5	126.2	171.2	-174.8	-73.8	0	0	0	109.6	T220 Y456 T457 G458 T459 D461	T220-N454 PolarHBondContact OG1-ND2 2.99Å; N454-Y456 PolarHBondContact O-N 2.87Å; N454-Y456 VanDerWaalsContact O-N 3.12Å; N454-Y456 PolarHBondContact OD1-N 3.46Å; N454-T457 VanDerWaalsContact CB-OG1 3.28Å; N454-T457 WeakPolarHBondContact CB-OG1 3.27Å; N454-T457 PolarHBondContact OD1-N 2.87Å; N454-T457 PolarHBondContact OD1-OG1 3.2Å; N454-G458 WeakPolarHBondContact O-CA 3.47Å; N454-G458 PolarHBondContact O-N 2.84Å; N454-T459 PolarHBondContact N-O 3.31Å; N454-D461 HydrophobicContact CB-CB 4.17Å; N454-D461 PolarHBondContact ND2-OD2 2.86Å; N454-D461 VanDerWaalsContact ND2-OD2 3.14Å
455	P	97.2	Very high	96.8	Very high	89 Å²	89	58 Å²	58	58%	0.578	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.4	-171	25.8	-33.9	0	0	0	113.9
456	Y	98.2	Very high	97.1	Very high	76 Å²	76	50.7 Å²	50.7	30%	0.298	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-33.1	-176.6	-52.4	-69.9	0	0	0	113.4	T220 E222 A229 T231 H260 N454	T220-Y456 HydrophobicContact CG2-CD2 3.78Å; T220-Y456 HydrophobicContact CG2-CE2 3.75Å; E222-Y456 HydrophobicContact CG-CE2 3.96Å; E222-Y456 WeakPolarHBondContact CG-OH 3.16Å; E222-Y456 PolarHBondContact OE2-OH 3.19Å; E222-Y456 VanDerWaalsContact OE2-OH 3.06Å; A229-Y456 HydrophobicContact CB-CD1 3.61Å; A229-Y456 HydrophobicContact CB-CD2 3.64Å; A229-Y456 HydrophobicContact CB-CE1 3.29Å; A229-Y456 HydrophobicContact CB-CE2 3.32Å; A229-Y456 HydrophobicContact CB-CG 3.78Å; T231-Y456 HydrophobicContact CG2-CD2 4.46Å; H260-Y456 HydrophobicContact CB-CD1 4.24Å; H260-Y456 PolarHBondContact CE1-O 3.22Å; N454-Y456 PolarHBondContact O-N 2.87Å; N454-Y456 VanDerWaalsContact O-N 3.12Å; N454-Y456 PolarHBondContact OD1-N 3.46Å
457	T	97.4	Very high	97.1	Very high	54 Å²	54	54.1 Å²	54.1	33%	0.331	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-19.3	-179.4	60.7	0	0	0	0	113.3	T218 T231 N454 T459	T218-T457 HydrophobicContact CG2-CG2 4.24Å; T231-T457 HydrophobicContact CG2-CG2 4.04Å; N454-T457 VanDerWaalsContact CB-OG1 3.28Å; N454-T457 WeakPolarHBondContact CB-OG1 3.27Å; N454-T457 PolarHBondContact OD1-N 2.87Å; N454-T457 PolarHBondContact OD1-OG1 3.2Å; T457-T459 PolarHBondContact O-N 3.06Å; T457-T459 PolarHBondContact OG1-N 3.26Å; T457-T459 PolarHBondContact OG1-OG1 3.35Å
458	G	97.2	Very high	97.3	Very high	45 Å²	45	51.1 Å²	51.1	46%	0.464	30%	0.3	S	S	.	.			trans	70.6	4.5	-173.8	0	0	0	0	0	114.4	N453 N454	N453-G458 PolarHBondContact ND2-O 3.38Å; N454-G458 WeakPolarHBondContact O-CA 3.47Å; N454-G458 PolarHBondContact O-N 2.84Å
459	T	96.1	Very high	97.2	Very high	56 Å²	56	52 Å²	52	34%	0.344	30%	0.304	S	S	.	.			trans	-78.1	151.2	178.5	54.5	0	0	0	0	111.1	T218 N453 N454 T457 D461	T218-T459 PolarHBondContact OG1-OG1 3.16Å; N453-T459 CarbonylContact C-O 3.43Å; N453-T459 WeakPolarHBondContact CA-O 3.43Å; N454-T459 PolarHBondContact N-O 3.31Å; T457-T459 PolarHBondContact O-N 3.06Å; T457-T459 PolarHBondContact OG1-N 3.26Å; T457-T459 PolarHBondContact OG1-OG1 3.35Å; T459-D461 PolarHBondContact O-N 3.3Å
460	P	96.9	Very high	97	Very high	112 Å²	112	58.8 Å²	58.8	73%	0.727	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55	138.7	172.5	-24.6	34.2	0	0	0	111.8	G452	G452-P460 WeakPolarHBondContact O-CA 3.34Å
461	D	97.6	Very high	96.9	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.027	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	175.5	-178.2	-149.2	-11.9	0	0	0	110.8	S199 G452 N454 T459	S199-D461 PolarHBondContact OG-OD1 3.3Å; G452-D461 PolarHBondContact N-O 3.05Å; G452-D461 PolarHBondContact O-N 3.02Å; G452-D461 VanDerWaalsContact O-O 3.08Å; N454-D461 HydrophobicContact CB-CB 4.17Å; N454-D461 PolarHBondContact ND2-OD2 2.86Å; N454-D461 VanDerWaalsContact ND2-OD2 3.14Å; T459-D461 PolarHBondContact O-N 3.3Å
462	W	98.2	Very high	96.8	Very high	44 Å²	44	57.6 Å²	57.6	17%	0.167	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.6	171.8	-72.7	86.9	0	0	0	109.7	V176 A184 T446 F449 Y450 P451	V176-W462 HydrophobicContact CB-CD2 3.81Å; V176-W462 HydrophobicContact CB-CE3 3.77Å; V176-W462 HydrophobicContact CB-CG 4.45Å; V176-W462 HydrophobicContact CB-CH2 4.04Å; V176-W462 HydrophobicContact CB-CZ2 4.07Å; V176-W462 HydrophobicContact CB-CZ3 3.9Å; V176-W462 HydrophobicContact CG1-CD2 4.13Å; V176-W462 HydrophobicContact CG1-CE3 3.86Å; V176-W462 HydrophobicContact CG1-CZ3 4.26Å; V176-W462 HydrophobicContact CG2-CD2 3.58Å; V176-W462 HydrophobicContact CG2-CE3 4.09Å; V176-W462 HydrophobicContact CG2-CG 3.81Å; V176-W462 HydrophobicContact CG2-CH2 4.48Å; V176-W462 HydrophobicContact CG2-CZ2 4.02Å; A184-W462 HydrophobicContact CB-CB 3.61Å; A184-W462 HydrophobicContact CB-CG 4.26Å; T446-W462 HydrophobicContact CG2-CH2 3.97Å; T446-W462 HydrophobicContact CG2-CZ3 3.69Å; T446-W462 WeakPolarHBondContact OG1-CZ3 3.25Å; F449-W462 HydrophobicContact CB-CB 4.42Å; F449-W462 HydrophobicContact CB-CE3 4.13Å; Y450-W462 WeakPolarHBondContact O-CA 3.36Å; P451-W462 HydrophobicContact CB-CH2 4.37Å; P451-W462 HydrophobicContact CB-CZ3 4.35Å; P451-W462 HydrophobicContact CG-CH2 4.49Å; P451-W462 HydrophobicContact CG-CZ3 4.39Å
463	L	98.3	Very high	96.7	Very high	33 Å²	33	58.1 Å²	58.1	17%	0.173	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138.7	-174.4	-57.6	-179.6	0	0	0	110	F449 Y450 A465	F449-L463 CarbonylContact C-O 3.6Å; F449-L463 WeakPolarHBondContact CA-O 2.99Å; Y450-L463 HydrophobicContact CD1-CB 4.35Å; Y450-L463 VanDerWaalsContact CD1-O 3.27Å; Y450-L463 WeakPolarHBondContact CD1-O 3.26Å; Y450-L463 HydrophobicContact CD2-CB 4.5Å; Y450-L463 HydrophobicContact CE1-CB 3.78Å; Y450-L463 HydrophobicContact CE2-CB 3.96Å; Y450-L463 HydrophobicContact CE2-CD1 3.91Å; Y450-L463 HydrophobicContact CE2-CG 4.4Å; Y450-L463 PolarHBondContact N-O 3.37Å; Y450-L463 PolarHBondContact O-N 3.47Å; L463-A465 PolarHBondContact O-N 3.47Å
464	Y	98.4	Very high	96.3	Very high	39 Å²	39	57.3 Å²	57.3	15%	0.153	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	129.8	176.5	178.4	-123.9	0	0	0	110.6	I172 H186 W448 F449 G466 Y468	I172-Y464 HydrophobicContact CG2-CD2 4.13Å; I172-Y464 HydrophobicContact CG2-CE2 3.84Å; H186-Y464 HydrophobicContact CB-CD1 4.45Å; H186-Y464 HydrophobicContact CB-CD2 4.35Å; H186-Y464 HydrophobicContact CB-CG 3.95Å; H186-Y464 AromaticContact CD2-CD1 3.34Å; H186-Y464 WeakPolarHBondContact CD2-CD1 3.21Å; H186-Y464 AromaticContact CD2-CE1 3.8Å; H186-Y464 AromaticContact CD2-CG 3.73Å; H186-Y464 AromaticContact CE1-CD1 3.94Å; H186-Y464 AromaticContact CG-CD1 3.77Å; H186-Y464 AromaticContact CG-CG 3.72Å; H186-Y464 AromaticContact NE2-CD1 3.44Å; H186-Y464 WeakPolarHBondContact NE2-CD1 3.42Å; H186-Y464 AromaticContact NE2-CE1 3.98Å; W448-Y464 HydrophobicContact CB-CE2 4.48Å; W448-Y464 WeakPolarHBondContact O-CD2 3.44Å; F449-Y464 HydrophobicContact CE1-CD2 4.36Å; F449-Y464 HydrophobicContact CE2-CD2 4.49Å; F449-Y464 HydrophobicContact CZ-CD2 4.2Å; Y464-G466 VanDerWaalsContact CE1-CA 3.47Å; Y464-G466 VanDerWaalsContact CZ-CA 3.48Å; Y464-G466 VanDerWaalsContact OH-C 3.32Å; Y464-G466 PolarHBondContact OH-O 3.04Å; Y464-Y468 WeakPolarHBondContact OH-CB 3.42Å; Y464-Y468 PolarHBondContact OH-N 3.14Å
465	A	97.3	Very high	95.9	Very high	54 Å²	54	63.5 Å²	63.5	45%	0.446	36%	0.358	S	S	.	.			trans	-80.1	-20.6	-177.2	0	0	0	0	0	113	W448 Y450 L463	W448-A465 WeakPolarHBondContact O-CB 3.49Å; W448-A465 PolarHBondContact O-N 3.38Å; Y450-A465 HydrophobicContact CD1-CB 4.06Å; L463-A465 PolarHBondContact O-N 3.47Å
466	G	95.8	Very high	95.7	Very high	17 Å²	17	60.2 Å²	60.2	18%	0.175	34%	0.338	C	S	.	.	S	Bend	trans	99	-167.7	-168.1	0	0	0	0	0	112.3	Y464 Y468	Y464-G466 VanDerWaalsContact CE1-CA 3.47Å; Y464-G466 VanDerWaalsContact CZ-CA 3.48Å; Y464-G466 VanDerWaalsContact OH-C 3.32Å; Y464-G466 PolarHBondContact OH-O 3.04Å; G466-Y468 PolarHBondContact O-N 3.32Å
467	D	94.4	Very high	95.5	Very high	100 Å²	100	58.3 Å²	58.3	54%	0.535	33%	0.334	S	S	.	.			trans	63.1	-15.8	164.4	-49.8	-16.5	0	0	0	118.6	F469 E470	D467-F469 VanDerWaalsContact C-N 3.26Å; D467-F469 PolarHBondContact O-N 3.49Å; D467-E470 VanDerWaalsContact O-CB 3.29Å; D467-E470 WeakPolarHBondContact O-CB 3.37Å; D467-E470 PolarHBondContact O-N 3.42Å
468	Y	97.2	Very high	95.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-54.2	-44.7	179	179.8	-90	0	0	0	112	E161 I172 P398 W448 Y464 G466 E470 R471 F473	E161-Y468 HydrophobicContact CB-CE1 3.78Å; E161-Y468 WeakPolarHBondContact CB-OH 3.34Å; E161-Y468 HydrophobicContact CG-CE1 4.3Å; E161-Y468 WeakPolarHBondContact OE2-CE1 3.33Å; I172-Y468 HydrophobicContact CB-CD1 4.23Å; I172-Y468 HydrophobicContact CB-CE1 4.5Å; I172-Y468 HydrophobicContact CB-CG 4.49Å; I172-Y468 HydrophobicContact CD1-CD1 3.89Å; I172-Y468 HydrophobicContact CD1-CD2 3.66Å; I172-Y468 HydrophobicContact CD1-CE1 3.57Å; I172-Y468 HydrophobicContact CD1-CE2 3.32Å; I172-Y468 HydrophobicContact CD1-CG 3.94Å; I172-Y468 HydrophobicContact CG1-CD1 3.91Å; I172-Y468 HydrophobicContact CG1-CD2 3.85Å; I172-Y468 HydrophobicContact CG1-CE1 4.12Å; I172-Y468 HydrophobicContact CG1-CE2 4.07Å; I172-Y468 HydrophobicContact CG1-CG 3.79Å; P398-Y468 VanDerWaalsContact CD-OH 3.29Å; P398-Y468 WeakPolarHBondContact CD-OH 3.29Å; P398-Y468 HydrophobicContact CG-CE2 4.01Å; P398-Y468 VanDerWaalsContact CG-OH 3.28Å; P398-Y468 WeakPolarHBondContact CG-OH 3.46Å; W448-Y468 AromaticContact CD1-CD2 3.85Å; W448-Y468 AromaticContact CD2-CD2 3.57Å; W448-Y468 HydrophobicContact CD2-CD2 3.57Å; W448-Y468 HydrophobicContact CD2-CG 4.31Å; W448-Y468 AromaticContact CE2-CD2 3.48Å; W448-Y468 VanDerWaalsContact CE2-CD2 3.48Å; W448-Y468 HydrophobicContact CE3-CD2 4.12Å; W448-Y468 HydrophobicContact CE3-CG 4.49Å; W448-Y468 AromaticContact CG-CD2 3.78Å; W448-Y468 HydrophobicContact CG-CD2 3.78Å; W448-Y468 HydrophobicContact CH2-CD2 4.43Å; W448-Y468 AromaticContact CZ2-CD2 3.94Å; W448-Y468 HydrophobicContact CZ2-CD2 3.94Å; W448-Y468 HydrophobicContact CZ2-CE2 4.45Å; W448-Y468 AromaticContact NE1-CD2 3.66Å; W448-Y468 AromaticContact NE1-CE2 3.93Å; Y464-Y468 WeakPolarHBondContact OH-CB 3.42Å; Y464-Y468 PolarHBondContact OH-N 3.14Å; G466-Y468 PolarHBondContact O-N 3.32Å; Y468-E470 PolarHBondContact O-N 3.09Å; Y468-R471 PolarHBondContact O-N 3.32Å; Y468-F473 HydrophobicContact CD2-CE1 4.15Å; Y468-F473 AromaticContact CE2-CE1 4Å; Y468-F473 HydrophobicContact CE2-CE1 4Å; Y468-F473 HydrophobicContact CE2-CZ 4.39Å
469	F	95.7	Very high	95.3	Very high	34 Å²	34	60.5 Å²	60.5	15%	0.149	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-76.7	-2.1	-178.8	-64.1	-67.1	0	0	0	114.1	I163 R170 I172 D467	I163-F469 HydrophobicContact CD1-CE1 4.37Å; I163-F469 HydrophobicContact CG1-CE1 4.45Å; R170-F469 HydrophobicContact CB-CE1 4.29Å; R170-F469 HydrophobicContact CB-CZ 3.99Å; R170-F469 HydrophobicContact CG-CE1 4.5Å; R170-F469 HydrophobicContact CG-CE2 4Å; R170-F469 HydrophobicContact CG-CZ 3.91Å; I172-F469 HydrophobicContact CB-CE2 4.49Å; I172-F469 HydrophobicContact CB-CZ 4.18Å; I172-F469 HydrophobicContact CG2-CE2 4.2Å; I172-F469 HydrophobicContact CG2-CZ 4.35Å; D467-F469 VanDerWaalsContact C-N 3.26Å; D467-F469 PolarHBondContact O-N 3.49Å
470	E	94.8	Very high	95.3	Very high	145 Å²	145	59.4 Å²	59.4	68%	0.678	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-79	-7.7	169.8	-57.8	-170.3	160.9	0	0	112.7	D467 Y468 N472	D467-E470 VanDerWaalsContact O-CB 3.29Å; D467-E470 WeakPolarHBondContact O-CB 3.37Å; D467-E470 PolarHBondContact O-N 3.42Å; Y468-E470 PolarHBondContact O-N 3.09Å; E470-N472 VanDerWaalsContact C-N 3.32Å; E470-N472 PolarHBondContact O-N 3.46Å
471	R	95.1	Very high	95.2	Very high	85 Å²	85	56.8 Å²	56.8	32%	0.321	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	23	171.2	-51.7	-61.4	-179.5	171.2	-11.3	115.6	E161 T396 Y468 F473	E161-R471 IonicContact OE1-CZ 3.89Å; E161-R471 IonicContact OE1-NH1 3.84Å; E161-R471 PolarHBondContact OE1-NH1 3.36Å; E161-R471 IonicContact OE1-NH2 3.7Å; E161-R471 PolarHBondContact OE1-NH2 2.9Å; E161-R471 IonicContact OE2-CZ 3.12Å; E161-R471 VanDerWaalsContact OE2-CZ 3.24Å; E161-R471 IonicContact OE2-NH1 3.23Å; E161-R471 PolarHBondContact OE2-NH1 2.86Å; E161-R471 IonicContact OE2-NH2 3.97Å; E161-R471 PolarHBondContact OE2-NH2 3.44Å; T396-R471 PolarHBondContact O-NH1 3.31Å; T396-R471 VanDerWaalsContact O-NH1 3.16Å; Y468-R471 PolarHBondContact O-N 3.32Å; R471-F473 HydrophobicContact CB-CE2 4.2Å; R471-F473 HydrophobicContact CB-CZ 4.46Å; R471-F473 PolarHBondContact O-N 3Å
472	N	93.7	Very high	95.1	Very high	97 Å²	97	59.5 Å²	59.5	52%	0.519	32%	0.317	S	S	.	.			trans	-87.9	96.1	169.9	-174.1	3.4	0	0	0	111.3	R447 E470 S474	R447-N472 PolarHBondContact NH2-O 3.35Å; R447-N472 VanDerWaalsContact NH2-O 3.15Å; E470-N472 VanDerWaalsContact C-N 3.32Å; E470-N472 PolarHBondContact O-N 3.46Å; N472-S474 PolarHBondContact OD1-N 3.03Å; N472-S474 PolarHBondContact OD1-OG 2.76Å
473	F	95.5	Very high	94.9	Very high	30 Å²	30	60.3 Å²	60.3	13%	0.132	33%	0.326	C	S	.	.			trans	-107.6	12.4	-176.9	-53.9	-47.3	0	0	0	114.5	T396 P398 W448 Y468 R471 D475 C476	T396-F473 WeakPolarHBondContact O-CE2 3.43Å; P398-F473 HydrophobicContact CB-CB 4.23Å; P398-F473 HydrophobicContact CB-CD1 3.77Å; P398-F473 HydrophobicContact CB-CD2 3.97Å; P398-F473 HydrophobicContact CB-CE1 4.04Å; P398-F473 HydrophobicContact CB-CE2 4.23Å; P398-F473 HydrophobicContact CB-CG 3.72Å; P398-F473 HydrophobicContact CB-CZ 4.25Å; P398-F473 HydrophobicContact CG-CE1 4.4Å; P398-F473 HydrophobicContact CG-CZ 4.37Å; W448-F473 HydrophobicContact CH2-CD1 4.02Å; W448-F473 HydrophobicContact CH2-CE1 4.12Å; W448-F473 AromaticContact CZ2-CD1 3.8Å; W448-F473 HydrophobicContact CZ2-CD1 3.8Å; W448-F473 AromaticContact CZ2-CE1 3.97Å; W448-F473 HydrophobicContact CZ2-CE1 3.97Å; Y468-F473 HydrophobicContact CD2-CE1 4.15Å; Y468-F473 AromaticContact CE2-CE1 4Å; Y468-F473 HydrophobicContact CE2-CE1 4Å; Y468-F473 HydrophobicContact CE2-CZ 4.39Å; R471-F473 HydrophobicContact CB-CE2 4.2Å; R471-F473 HydrophobicContact CB-CZ 4.46Å; R471-F473 PolarHBondContact O-N 3Å; F473-D475 VanDerWaalsContact C-N 3.31Å; F473-D475 PolarHBondContact O-N 2.92Å; F473-C476 WeakPolarHBondContact O-CB 3.32Å; F473-C476 PolarHBondContact O-N 3.09Å; F473-C476 VanDerWaalsContact O-N 3.11Å
474	S	90.4	Very high	94.7	Very high	87 Å²	87	61.9 Å²	61.9	61%	0.608	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-43.6	-176.3	47.7	0	0	0	0	113.8	N472 C476	N472-S474 PolarHBondContact OD1-N 3.03Å; N472-S474 PolarHBondContact OD1-OG 2.76Å; S474-C476 PolarHBondContact O-N 2.77Å
475	D	88.8	Confident	94.5	Very high	131 Å²	131	63.4 Å²	63.4	70%	0.701	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	28.8	-179.1	-49.2	-48.7	0	0	0	114	R447 F473	R447-D475 PolarHBondContact NH1-O 2.99Å; F473-D475 VanDerWaalsContact C-N 3.31Å; F473-D475 PolarHBondContact O-N 2.92Å
476	C	93.4	Very high	94.3	Very high	21 Å²	21	64 Å²	64	14%	0.142	34%	0.339	C	S	.	.			trans	-74.6	142.8	-179.6	-99	0	0	0	0	109.9	P399 T400 R447 F473 S474	P399-C476 HydrophobicContact CG-CB 3.49Å; P399-C476 VanDerWaalsContact CG-CB 3.49Å; T400-C476 HydrophobicContact CG2-CB 4.26Å; R447-C476 PolarHBondContact NH1-SG 3.47Å; F473-C476 WeakPolarHBondContact O-CB 3.32Å; F473-C476 PolarHBondContact O-N 3.09Å; F473-C476 VanDerWaalsContact O-N 3.11Å; S474-C476 PolarHBondContact O-N 2.77Å
477	P	92.8	Very high	94.2	Very high	36 Å²	36	67.4 Å²	67.4	23%	0.234	35%	0.351	C	S	.	.			trans	-66.8	144.1	176.3	30.1	-35.8	0	0	0	110.8	T400 W444 I479	T400-P477 HydrophobicContact CG2-CG 3.72Å; T400-P477 WeakPolarHBondContact CG2-O 3.1Å; W444-P477 HydrophobicContact CH2-CB 3.79Å; W444-P477 HydrophobicContact CH2-CG 3.84Å; W444-P477 HydrophobicContact CZ2-CG 4.44Å; W444-P477 HydrophobicContact CZ3-CB 4.43Å; P477-I479 HydrophobicContact CB-CG2 3.94Å; P477-I479 HydrophobicContact CG-CG2 4.09Å; P477-I479 PolarHBondContact O-N 3.34Å
478	D	95.1	Very high	94.2	Very high	124 Å²	124	64.8 Å²	64.8	66%	0.663	34%	0.337	S	S	*	.			trans	-87.1	99.8	171.6	175.8	25.9	0	0	0	110	K429	K429-D478 VanDerWaalsContact CE-O 3.27Å; K429-D478 WeakPolarHBondContact CE-O 3.46Å; K429-D478 PolarHBondContact NZ-O 3.32Å; K429-D478 IonicContact NZ-OD1 2.66Å; K429-D478 PolarHBondContact NZ-OD1 2.71Å; K429-D478 IonicContact NZ-OD2 3.75Å; K429-D478 PolarHBondContact NZ-OD2 3.3Å
479	I	96.3	Very high	93.9	Very high	20 Å²	20	70.3 Å²	70.3	10%	0.103	37%	0.365	C	S	.	.			trans	-112.6	-10	-172.9	63	173.5	0	0	0	113.9	L155 E158 T400 P477	L155-I479 HydrophobicContact CB-CD1 4.5Å; L155-I479 HydrophobicContact CD1-CB 4.42Å; L155-I479 VanDerWaalsContact CD1-O 3.22Å; L155-I479 WeakPolarHBondContact CD1-O 3.19Å; E158-I479 VanDerWaalsContact CA-CD1 3.44Å; E158-I479 HydrophobicContact CB-CD1 3.91Å; E158-I479 HydrophobicContact CG-CD1 4.47Å; T400-I479 HydrophobicContact CG2-CD1 3.86Å; T400-I479 HydrophobicContact CG2-CG1 4.13Å; P477-I479 HydrophobicContact CB-CG2 3.94Å; P477-I479 HydrophobicContact CG-CG2 4.09Å; P477-I479 PolarHBondContact O-N 3.34Å
480	Y	95.7	Very high	93.8	Very high	33 Å²	33	73.5 Å²	73.5	13%	0.129	38%	0.384	C	S	.	.			trans	-101.6	0	-178.8	-61.2	-32.1	0	0	0	114.4	L155 E158 P399 T400 D401 C402 L404 R405 R425 L426 K429	L155-Y480 HydrophobicContact CD1-CD1 3.98Å; L155-Y480 HydrophobicContact CD1-CE1 4.01Å; E158-Y480 WeakPolarHBondContact CG-OH 3.39Å; P399-Y480 VanDerWaalsContact O-CD2 3.27Å; P399-Y480 WeakPolarHBondContact O-CD2 3.42Å; P399-Y480 WeakPolarHBondContact O-CE2 3.36Å; T400-Y480 PolarHBondContact O-OH 3.14Å; T400-Y480 VanDerWaalsContact O-OH 3.09Å; D401-Y480 WeakPolarHBondContact O-CE2 3.32Å; D401-Y480 PolarHBondContact O-OH 3.28Å; C402-Y480 VanDerWaalsContact CA-OH 3.27Å; C402-Y480 WeakPolarHBondContact CA-OH 3.49Å; C402-Y480 PolarHBondContact N-OH 3.39Å; L404-Y480 HydrophobicContact CB-CD2 4.14Å; L404-Y480 HydrophobicContact CB-CE2 3.92Å; R405-Y480 HydrophobicContact CB-CD1 4.28Å; R405-Y480 HydrophobicContact CB-CE1 3.69Å; R405-Y480 HydrophobicContact CB-CE2 4.22Å; R405-Y480 HydrophobicContact CG-CD1 3.85Å; R405-Y480 HydrophobicContact CG-CE1 3.43Å; R405-Y480 VanDerWaalsContact CG-CE1 3.43Å; R425-Y480 PolarHBondContact NH1-OXT 3.49Å; R425-Y480 PolarHBondContact NH2-OXT 3.46Å; L426-Y480 VanDerWaalsContact CD2-CA 3.46Å; L426-Y480 HydrophobicContact CD2-CD1 4.07Å; L426-Y480 WeakPolarHBondContact CD2-OXT 3.4Å; K429-Y480 PolarHBondContact NZ-O 2.81Å

Retrieved 480 of 480 residues in 139 ms (Link to these results)

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