A0A087YFA4_POEFO Loading...

Neuronal pentraxin 1

AlphaFold DB , UniProt , Accession A0A087YFA4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 422 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	35.1	Very low	230 Å²	230	178.1 Å²	178.1	100%	1.133	89%	0.889	S	S	*	*				0	89.3	0	-71.4	169.8	178.9	0	0	105.6
2	E	34.1	Very low	34.6	Very low	197 Å²	197	173.4 Å²	173.4	92%	0.921	89%	0.886	S	S	*	*				93.1	132.3	99	-79.2	-172.1	-174.3	0	0	108.9
3	G	33.1	Very low	34.3	Very low	75 Å²	75	169.5 Å²	169.5	77%	0.773	88%	0.881	S	S	*	*			cis	153.1	133	10.2	0	0	0	0	0	107.7
4	F	38.7	Very low	33.9	Very low	198 Å²	198	168.2 Å²	168.2	87%	0.868	88%	0.875	S	S	*	*			trans	-50.8	151	172.7	-105.5	-107.6	0	0	0	113.6
5	S	34.1	Very low	33.5	Very low	107 Å²	107	170.8 Å²	170.8	75%	0.748	88%	0.877	S	S	*	*			trans	-155	100.9	150.3	-165.3	0	0	0	0	113.7	K7	S5-K7 PolarHBondContact O-N 3.42Å
6	W	36.8	Very low	33.3	Very low	244 Å²	244	166.6 Å²	166.6	92%	0.924	88%	0.876	S	S	*	*			trans	-74.1	93.4	156.9	-98.8	-23.8	0	0	0	109
7	K	35.5	Very low	33	Very low	185 Å²	185	162.8 Å²	162.8	80%	0.804	87%	0.874	S	S	*	*			trans	-157.6	80	163.4	-74.8	-161.3	-180	179.7	0	110.6	S5	S5-K7 PolarHBondContact O-N 3.42Å
8	L	37.3	Very low	32.8	Very low	174 Å²	174	165.1 Å²	165.1	91%	0.911	88%	0.879	S	S	*	*			trans	-158.5	25.1	167.2	-113.2	147.2	0	0	0	115.1
9	F	34.6	Very low	32.5	Very low	208 Å²	208	160.5 Å²	160.5	91%	0.912	88%	0.875	S	S	*	*	S	Bend	trans	-127.7	25.9	177.8	-115.9	-81.3	0	0	0	114.9
10	L	35.7	Very low	32.3	Very low	162 Å²	162	158.8 Å²	158.8	85%	0.848	88%	0.875	S	S	*	*	S	Bend	trans	-140.1	92.8	169	-76.3	170.1	0	0	0	108.5
11	L	33.3	Very low	32.3	Very low	179 Å²	179	156.1 Å²	156.1	94%	0.937	87%	0.874	S	S	*	*			trans	157.6	86.8	144.7	-101	103.5	0	0	0	110
12	S	29.5	Very low	32.2	Very low	122 Å²	122	154.6 Å²	154.6	85%	0.853	86%	0.864	S	S	*	*			trans	-162.2	66.3	150	64.3	0	0	0	0	109.5
13	C	29.7	Very low	32.3	Very low	122 Å²	122	152.4 Å²	152.4	82%	0.824	86%	0.859	S	S	*	*			trans	-82.8	150.7	150.9	-84.9	0	0	0	0	108.2
14	L	28.9	Very low	32.2	Very low	152 Å²	152	158.8 Å²	158.8	80%	0.796	87%	0.865	S	S	*	*			trans	103.5	92.2	171	-56.8	160.5	0	0	0	113.4
15	F	28.6	Very low	32	Very low	207 Å²	207	152.7 Å²	152.7	91%	0.908	86%	0.858	S	S	*	*	S	Bend		176.1	138.7	106	-95.9	-76.2	0	0	0	110.9
16	A	29.3	Very low	32.3	Very low	103 Å²	103	156.4 Å²	156.4	85%	0.851	86%	0.864	S	S	*	*			trans	74	89.7	163.2	0	0	0	0	0	118.8
17	A	29.2	Very low	32.6	Very low	103 Å²	103	150.5 Å²	150.5	85%	0.851	86%	0.855	S	S	*	*			trans	-108.5	118.9	151.5	0	0	0	0	0	108.9
18	E	28.7	Very low	33	Very low	204 Å²	204	149.5 Å²	149.5	95%	0.953	85%	0.853	S	S	*	*			trans	-152.1	131.1	160.7	-88.4	-179.9	159.8	0	0	103.4
19	G	27.3	Very low	33.2	Very low	78 Å²	78	149.9 Å²	149.9	80%	0.804	85%	0.848	S	S	*	*			cis	158.5	114.8	3.9	0	0	0	0	0	105.6
20	S	28.4	Very low	33.7	Very low	125 Å²	125	146.5 Å²	146.5	87%	0.874	84%	0.838	S	S	*	*			trans	-154.7	108.9	155.2	58.9	0	0	0	0	109.2
21	A	31.6	Very low	33.8	Very low	103 Å²	103	144.9 Å²	144.9	85%	0.851	84%	0.838	S	S	*	*			trans	-83.5	136	178	0	0	0	0	0	110.2
22	Q	31.9	Very low	34.8	Very low	199 Å²	199	141.9 Å²	141.9	93%	0.93	83%	0.828	S	S	*	*			trans	-139.2	138.7	150.8	-105.5	176.8	-7.2	0	0	108.9
23	D	35.3	Very low	35.4	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	83%	0.826	S	S	*	*			trans	-81.8	129.7	-151.9	-166.6	13.8	0	0	0	112.7
24	F	32.7	Very low	36.2	Very low	208 Å²	208	142 Å²	142	91%	0.912	82%	0.824	S	S	*	*			trans	-136.1	112.2	160.9	-98.3	-85.3	0	0	0	107.4	Q26	F24-Q26 PolarHBondContact O-N 3.08Å
25	G	33.3	Very low	36.9	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	82%	0.82	S	S	*	*			trans	-54.9	127	-172.5	0	0	0	0	0	113.7	T27	G25-T27 PolarHBondContact O-N 3.5Å
26	Q	40.3	Very low	37.9	Very low	186 Å²	186	139.5 Å²	139.5	87%	0.869	82%	0.817	S	S	*	*			trans	-59.5	118.8	166.1	-95.4	175.8	-19	0	0	110.4	F24 Q28	F24-Q26 PolarHBondContact O-N 3.08Å; Q26-Q28 PolarHBondContact O-N 3.04Å
27	T	43.8	Very low	38.8	Very low	120 Å²	120	142.1 Å²	142.1	74%	0.736	82%	0.817	S	S	*	*			trans	-71.2	97	159	49.4	0	0	0	0	108.4	G25 F29	G25-T27 PolarHBondContact O-N 3.5Å; T27-F29 PolarHBondContact O-N 3.47Å
28	Q	44.1	Very low	39.4	Very low	164 Å²	164	143.4 Å²	143.4	77%	0.766	81%	0.814	S	S	*	*			trans	-78.3	111.1	174.3	-162.1	174.5	11.3	0	0	108.8	Q26 I30	Q26-Q28 PolarHBondContact O-N 3.04Å; Q28-I30 PolarHBondContact O-N 3Å
29	F	41.1	Very low	40	Very low	182 Å²	182	141 Å²	141	80%	0.798	81%	0.808	S	S	*	*			trans	-73.9	105.3	171	-69.9	-81.5	0	0	0	109.2	T27 C31	T27-F29 PolarHBondContact O-N 3.47Å; F29-C31 PolarHBondContact O-N 3.36Å
30	I	44.4	Very low	40.6	Very low	137 Å²	137	145.4 Å²	145.4	70%	0.703	81%	0.812	S	S	*	*			trans	-80.9	108.6	170.4	-63.6	173.3	0	0	0	107.7	Q28 T32	Q28-I30 PolarHBondContact O-N 3Å; I30-T32 HydrophobicContact CG2-CG2 4.08Å
31	C	38.5	Very low	41.3	Very low	127 Å²	127	144.9 Å²	144.9	86%	0.858	81%	0.807	S	S	*	*			trans	-86.9	108.5	164.7	-75.5	0	0	0	0	108.9	F29	F29-C31 PolarHBondContact O-N 3.36Å
32	T	53.5	Low	42	Very low	117 Å²	117	147 Å²	147	72%	0.718	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-94.1	129.2	164.4	38.8	0	0	0	0	109.4	I30	I30-T32 HydrophobicContact CG2-CG2 4.08Å
33	S	43.7	Very low	42.2	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71	128.6	173.8	43.1	0	0	0	0	110.4
34	V	44.8	Very low	42.3	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-88.5	128.4	172.5	179.1	0	0	0	0	108.6
35	P	44.1	Very low	42.5	Very low	107 Å²	107	135.6 Å²	135.6	70%	0.695	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.6	137.5	171.8	-17.3	30.2	0	0	0	110.6
36	K	49	Very low	42.8	Very low	198 Å²	198	141.4 Å²	141.4	86%	0.861	80%	0.799	S	S	*	*	S	Bend	trans	-67.2	134.8	166.6	-76.2	-179.8	173.4	179.8	0	108.5
37	D	48.2	Very low	42.6	Very low	158 Å²	158	140 Å²	140	85%	0.845	80%	0.797	S	S	*	*			trans	100.1	51.7	171.7	-51.8	-21.6	0	0	0	117.9
38	V	43.1	Very low	42.6	Very low	131 Å²	131	139.8 Å²	139.8	79%	0.794	80%	0.801	S	S	*	*			trans	-142.5	126	155.5	-163.2	0	0	0	0	111.7	L40	V38-L40 PolarHBondContact O-N 3.41Å
39	D	40.3	Very low	42.7	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	80%	0.798	S	S	*	*			trans	-59.6	121.5	174.1	-103.5	-31.9	0	0	0	111.9	C41	D39-C41 VanDerWaalsContact C-N 3.3Å; D39-C41 PolarHBondContact O-N 3.33Å; D39-C41 VanDerWaalsContact O-N 3.08Å
40	L	41.5	Very low	43.1	Very low	172 Å²	172	131.7 Å²	131.7	90%	0.901	79%	0.793	S	S	*	*	S	Bend	trans	-87.3	59.2	-175.6	-165.4	74.7	0	0	0	111.9	V38	V38-L40 PolarHBondContact O-N 3.41Å
41	C	41.2	Very low	43.5	Very low	114 Å²	114	126.9 Å²	126.9	77%	0.77	77%	0.773	S	S	*	*	S	Bend	trans	-140.9	32.4	-178.5	-88.7	0	0	0	0	114.9	D39	D39-C41 VanDerWaalsContact C-N 3.3Å; D39-C41 PolarHBondContact O-N 3.33Å; D39-C41 VanDerWaalsContact O-N 3.08Å
42	T	46.3	Very low	44.3	Very low	147 Å²	147	126.3 Å²	126.3	90%	0.902	76%	0.758	S	S	*	*	S	Bend	trans	-155.6	14.4	175.7	29.3	0	0	0	0	118.1
43	A	37.2	Very low	44.4	Very low	105 Å²	105	126.2 Å²	126.2	87%	0.868	75%	0.753	S	S	*	*			trans	-131.5	74.4	-175.9	0	0	0	0	0	114.1
44	A	37.3	Very low	45	Very low	96 Å²	96	126.1 Å²	126.1	79%	0.793	74%	0.743	S	S	*	*			trans	-169.3	83.8	147.2	0	0	0	0	0	109.7
45	M	37.3	Very low	46.2	Very low	117 Å²	117	123.9 Å²	123.9	58%	0.576	72%	0.723	S	S	*	*			trans	-148.9	89.5	158.5	-76.9	-135.5	94.8	0	0	110.3	A51 K55	M45-A51 HydrophobicContact CE-CB 3.69Å; M45-K55 PolarHBondContact SD-NZ 3.4Å
46	Q	39.9	Very low	47.4	Very low	193 Å²	193	122.3 Å²	122.3	90%	0.902	71%	0.711	S	S	*	*			trans	-138.7	86.7	151.9	-75.6	-171	-15	0	0	108
47	N	36.3	Very low	48.3	Very low	156 Å²	156	116 Å²	116	83%	0.834	69%	0.689	S	S	*	*	S	Bend	trans	-172.9	148.1	139.7	-100	-13.7	0	0	0	111.2
48	S	43.5	Very low	49.6	Very low	116 Å²	116	113.1 Å²	113.1	81%	0.811	67%	0.673	S	S	*	*			trans	-62.4	122.7	-164.2	47	0	0	0	0	118
49	G	45.8	Very low	51.1	Low	69 Å²	69	112.1 Å²	112.1	71%	0.711	66%	0.662	S	S	*	*	S	Bend	trans	62.2	153	158.5	0	0	0	0	0	118.3
50	P	48.8	Very low	52.5	Low	107 Å²	107	110.9 Å²	110.9	70%	0.695	65%	0.651	S	S	*	*	S	Bend	cis	-104.2	55.2	-11.1	39.6	-26.6	0	0	0	110.8
51	A	53.3	Low	54	Low	35 Å²	35	107.7 Å²	107.7	29%	0.289	64%	0.635	S	S	.	*	H	α-helix	trans	-77.4	-21.7	-173.1	0	0	0	0	0	114.2	M45 K55	M45-A51 HydrophobicContact CE-CB 3.69Å; A51-K55 VanDerWaalsContact O-CG 3.29Å; A51-K55 WeakPolarHBondContact O-CG 3.25Å; A51-K55 PolarHBondContact O-N 3.5Å; A51-K55 VanDerWaalsContact O-N 3.15Å
52	E	55.6	Low	55.9	Low	116 Å²	116	111.1 Å²	111.1	54%	0.542	63%	0.631	S	S	.	*	H	α-helix	trans	-73.4	-36.7	-179.9	-72.5	-56.5	132	0	0	112.2	L54 K55 T56	E52-L54 VanDerWaalsContact C-N 3.32Å; E52-L54 PolarHBondContact O-N 2.88Å; E52-K55 PolarHBondContact O-N 3.14Å; E52-K55 IonicContact OE1-NZ 3.78Å; E52-K55 PolarHBondContact OE1-NZ 3.19Å; E52-T56 WeakPolarHBondContact O-CG2 3.34Å; E52-T56 PolarHBondContact O-N 3.13Å; E52-T56 PolarHBondContact O-OG1 2.94Å
53	D	55.3	Low	57.5	Low	114 Å²	114	110.3 Å²	110.3	61%	0.61	62%	0.617	S	S	*	*	H	α-helix	trans	-67.3	-32.8	175.2	-69.6	-25.4	0	0	0	112.4	T56 T57	D53-T56 WeakPolarHBondContact CA-OG1 3.43Å; D53-T56 PolarHBondContact O-OG1 3.23Å; D53-T57 VanDerWaalsContact O-CB 3.29Å; D53-T57 WeakPolarHBondContact O-CB 3.25Å; D53-T57 PolarHBondContact O-N 3.32Å; D53-T57 PolarHBondContact O-OG1 3.49Å
54	L	57.4	Low	59.2	Low	114 Å²	114	108.4 Å²	108.4	60%	0.597	60%	0.595	S	S	*	*	H	α-helix	trans	-72	-39.7	176.1	-160.7	73.6	0	0	0	111.2	E52 T57 I58	E52-L54 VanDerWaalsContact C-N 3.32Å; E52-L54 PolarHBondContact O-N 2.88Å; L54-T57 PolarHBondContact O-N 2.83Å; L54-I58 HydrophobicContact CG-CD1 4.14Å; L54-I58 WeakPolarHBondContact O-CB 3.47Å; L54-I58 WeakPolarHBondContact O-CD1 3.46Å; L54-I58 WeakPolarHBondContact O-CG1 3.41Å; L54-I58 PolarHBondContact O-N 2.9Å
55	K	68.3	Low	61.2	Low	85 Å²	85	108 Å²	108	37%	0.37	58%	0.582	S	S	.	*	H	α-helix	trans	-65.3	-44	176.2	-73.3	173.9	-168.9	171.1	0	111.8	M45 A51 E52 I58 I59	M45-K55 PolarHBondContact SD-NZ 3.4Å; A51-K55 VanDerWaalsContact O-CG 3.29Å; A51-K55 WeakPolarHBondContact O-CG 3.25Å; A51-K55 PolarHBondContact O-N 3.5Å; A51-K55 VanDerWaalsContact O-N 3.15Å; E52-K55 PolarHBondContact O-N 3.14Å; E52-K55 IonicContact OE1-NZ 3.78Å; E52-K55 PolarHBondContact OE1-NZ 3.19Å; K55-I58 PolarHBondContact O-N 3.5Å; K55-I59 VanDerWaalsContact O-CG1 3.27Å; K55-I59 WeakPolarHBondContact O-CG1 3.31Å; K55-I59 PolarHBondContact O-N 3.49Å
56	T	69.7	Low	63.1	Low	73 Å²	73	107.2 Å²	107.2	45%	0.448	58%	0.58	S	S	.	*	H	α-helix	trans	-63.9	-42.5	176.4	55	0	0	0	0	110.9	E52 D53 I58 I59 Q60	E52-T56 WeakPolarHBondContact O-CG2 3.34Å; E52-T56 PolarHBondContact O-N 3.13Å; E52-T56 PolarHBondContact O-OG1 2.94Å; D53-T56 WeakPolarHBondContact CA-OG1 3.43Å; D53-T56 PolarHBondContact O-OG1 3.23Å; T56-I58 PolarHBondContact O-N 2.82Å; T56-I59 PolarHBondContact O-N 2.94Å; T56-Q60 WeakPolarHBondContact O-CB 3.48Å; T56-Q60 PolarHBondContact O-N 2.97Å
57	T	68.6	Low	65.1	Low	65 Å²	65	104.1 Å²	104.1	40%	0.399	57%	0.565	S	S	.	*	H	α-helix	trans	-61.9	-41.6	175.4	-55.8	0	0	0	0	112.1	D53 L54 Q60 L61	D53-T57 VanDerWaalsContact O-CB 3.29Å; D53-T57 WeakPolarHBondContact O-CB 3.25Å; D53-T57 PolarHBondContact O-N 3.32Å; D53-T57 PolarHBondContact O-OG1 3.49Å; L54-T57 PolarHBondContact O-N 2.83Å; T57-Q60 PolarHBondContact O-N 3.41Å; T57-L61 HydrophobicContact CG2-CD1 3.95Å; T57-L61 WeakPolarHBondContact O-CB 3.27Å; T57-L61 WeakPolarHBondContact O-CD1 3.45Å; T57-L61 WeakPolarHBondContact O-CG 3.36Å; T57-L61 PolarHBondContact O-N 3.36Å
58	I	74.3	Confident	66.9	Low	98 Å²	98	102.3 Å²	102.3	50%	0.503	55%	0.552	S	S	.	*	H	α-helix	trans	-64.6	-41.7	176.4	-72.1	164.3	0	0	0	111.3	L54 K55 T56 R62	L54-I58 HydrophobicContact CG-CD1 4.14Å; L54-I58 WeakPolarHBondContact O-CB 3.47Å; L54-I58 WeakPolarHBondContact O-CD1 3.46Å; L54-I58 WeakPolarHBondContact O-CG1 3.41Å; L54-I58 PolarHBondContact O-N 2.9Å; K55-I58 PolarHBondContact O-N 3.5Å; T56-I58 PolarHBondContact O-N 2.82Å; I58-R62 WeakPolarHBondContact O-CB 3.38Å; I58-R62 PolarHBondContact O-N 2.96Å
59	I	74.5	Confident	68.8	Low	110 Å²	110	103.4 Å²	103.4	56%	0.564	54%	0.542	S	S	*	.	H	α-helix	trans	-64.8	-43.6	176.8	-68.9	165.4	0	0	0	110.3	K55 T56 R62 E63	K55-I59 VanDerWaalsContact O-CG1 3.27Å; K55-I59 WeakPolarHBondContact O-CG1 3.31Å; K55-I59 PolarHBondContact O-N 3.49Å; T56-I59 PolarHBondContact O-N 2.94Å; I59-R62 WeakPolarHBondContact O-CB 3.32Å; I59-R62 PolarHBondContact O-N 2.9Å; I59-E63 PolarHBondContact O-N 3.45Å
60	Q	71.4	Confident	70.4	Confident	127 Å²	127	106.1 Å²	106.1	59%	0.593	54%	0.536	S	S	*	.	H	α-helix	trans	-66.7	-39	179.9	-153.6	174.1	12.8	0	0	112.1	T56 T57 E63 T64	T56-Q60 WeakPolarHBondContact O-CB 3.48Å; T56-Q60 PolarHBondContact O-N 2.97Å; T57-Q60 PolarHBondContact O-N 3.41Å; Q60-E63 PolarHBondContact O-N 2.97Å; Q60-T64 WeakPolarHBondContact O-CB 3.41Å; Q60-T64 PolarHBondContact O-N 3.34Å; Q60-T64 PolarHBondContact O-OG1 2.92Å
61	L	71.3	Confident	71.5	Confident	105 Å²	105	104.3 Å²	104.3	55%	0.55	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-42.3	171.8	-80.3	162.4	0	0	0	111.5	T57 E63 T64 V65	T57-L61 HydrophobicContact CG2-CD1 3.95Å; T57-L61 WeakPolarHBondContact O-CB 3.27Å; T57-L61 WeakPolarHBondContact O-CD1 3.45Å; T57-L61 WeakPolarHBondContact O-CG 3.36Å; T57-L61 PolarHBondContact O-N 3.36Å; L61-E63 VanDerWaalsContact C-N 3.33Å; L61-E63 PolarHBondContact O-N 2.95Å; L61-T64 PolarHBondContact O-N 3.19Å; L61-V65 WeakPolarHBondContact O-CB 3.33Å; L61-V65 VanDerWaalsContact O-CG2 3.28Å; L61-V65 WeakPolarHBondContact O-CG2 3.35Å; L61-V65 PolarHBondContact O-N 3.27Å
62	R	81.4	Confident	72.8	Confident	186 Å²	186	107.6 Å²	107.6	70%	0.702	54%	0.535	S	S	*	.	H	α-helix	trans	-61.8	-42.1	177	-171.2	179.9	-172.9	-169.7	2.3	111.6	I58 I59 V65 L66	I58-R62 WeakPolarHBondContact O-CB 3.38Å; I58-R62 PolarHBondContact O-N 2.96Å; I59-R62 WeakPolarHBondContact O-CB 3.32Å; I59-R62 PolarHBondContact O-N 2.9Å; R62-V65 PolarHBondContact O-N 2.82Å; R62-L66 HydrophobicContact CG-CD1 4.49Å; R62-L66 VanDerWaalsContact O-CG 3.31Å; R62-L66 WeakPolarHBondContact O-CG 3.46Å; R62-L66 PolarHBondContact O-N 2.81Å
63	E	80.4	Confident	73.8	Confident	130 Å²	130	105.8 Å²	105.8	61%	0.607	53%	0.532	S	S	*	.	H	α-helix	trans	-66	-42.5	176.9	-165.7	166.7	-163.5	0	0	111.5	I59 Q60 L61 V65 L66 Q67	I59-E63 PolarHBondContact O-N 3.45Å; Q60-E63 PolarHBondContact O-N 2.97Å; L61-E63 VanDerWaalsContact C-N 3.33Å; L61-E63 PolarHBondContact O-N 2.95Å; E63-V65 PolarHBondContact O-N 3.49Å; E63-L66 PolarHBondContact O-N 3.18Å; E63-Q67 WeakPolarHBondContact O-CB 3.4Å; E63-Q67 PolarHBondContact O-N 3.05Å
64	T	73.4	Confident	75	Confident	64 Å²	64	104.5 Å²	104.5	39%	0.393	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-41.5	176.2	-52.2	0	0	0	0	111.8	Q60 L61 Q67 Q68	Q60-T64 WeakPolarHBondContact O-CB 3.41Å; Q60-T64 PolarHBondContact O-N 3.34Å; Q60-T64 PolarHBondContact O-OG1 2.92Å; L61-T64 PolarHBondContact O-N 3.19Å; T64-Q67 PolarHBondContact O-N 2.99Å; T64-Q68 WeakPolarHBondContact O-CB 3.32Å; T64-Q68 WeakPolarHBondContact O-CG 3.35Å; T64-Q68 PolarHBondContact O-N 3.38Å
65	V	79.4	Confident	75.8	Confident	88 Å²	88	104.4 Å²	104.4	53%	0.533	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-39.3	176.7	169	0	0	0	0	111.3	L61 R62 E63 K69	L61-V65 WeakPolarHBondContact O-CB 3.33Å; L61-V65 VanDerWaalsContact O-CG2 3.28Å; L61-V65 WeakPolarHBondContact O-CG2 3.35Å; L61-V65 PolarHBondContact O-N 3.27Å; R62-V65 PolarHBondContact O-N 2.82Å; E63-V65 PolarHBondContact O-N 3.49Å; V65-K69 WeakPolarHBondContact O-CB 3.39Å; V65-K69 PolarHBondContact O-N 2.88Å
66	L	76.3	Confident	76.4	Confident	100 Å²	100	106.9 Å²	106.9	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-65.5	-42.1	175.6	-73.3	172	0	0	0	111.6	R62 E63 K69 E70	R62-L66 HydrophobicContact CG-CD1 4.49Å; R62-L66 VanDerWaalsContact O-CG 3.31Å; R62-L66 WeakPolarHBondContact O-CG 3.46Å; R62-L66 PolarHBondContact O-N 2.81Å; E63-L66 PolarHBondContact O-N 3.18Å; L66-K69 WeakPolarHBondContact O-CB 3.42Å; L66-K69 PolarHBondContact O-N 2.82Å; L66-E70 PolarHBondContact O-N 3.26Å
67	Q	81.5	Confident	76.8	Confident	128 Å²	128	109.5 Å²	109.5	60%	0.598	54%	0.54	S	S	*	.	H	α-helix	trans	-67.1	-39.1	177.6	-162.2	174.5	13.8	0	0	112.3	E63 T64 E70 T71	E63-Q67 WeakPolarHBondContact O-CB 3.4Å; E63-Q67 PolarHBondContact O-N 3.05Å; T64-Q67 PolarHBondContact O-N 2.99Å; Q67-E70 PolarHBondContact O-N 3.26Å; Q67-T71 WeakPolarHBondContact O-CB 3.3Å; Q67-T71 PolarHBondContact O-N 2.96Å; Q67-T71 PolarHBondContact O-OG1 3.46Å
68	Q	74.5	Confident	77.3	Confident	119 Å²	119	109.9 Å²	109.9	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-64.1	-41.7	172.2	-78.7	-171.8	-18.4	0	0	111.8	T64 E70 T71 I72	T64-Q68 WeakPolarHBondContact O-CB 3.32Å; T64-Q68 WeakPolarHBondContact O-CG 3.35Å; T64-Q68 PolarHBondContact O-N 3.38Å; Q68-E70 PolarHBondContact O-N 3.11Å; Q68-T71 PolarHBondContact O-N 2.87Å; Q68-I72 VanDerWaalsContact O-CG1 3.25Å; Q68-I72 WeakPolarHBondContact O-CG1 3.46Å; Q68-I72 PolarHBondContact O-N 2.98Å
69	K	83.4	Confident	77.7	Confident	138 Å²	138	110.1 Å²	110.1	60%	0.6	54%	0.543	S	S	*	.	H	α-helix	trans	-60.7	-44.9	176.3	-178.3	-177.7	176.6	-176.4	0	111.7	V65 L66 I72 V73	V65-K69 WeakPolarHBondContact O-CB 3.39Å; V65-K69 PolarHBondContact O-N 2.88Å; L66-K69 WeakPolarHBondContact O-CB 3.42Å; L66-K69 PolarHBondContact O-N 2.82Å; K69-I72 PolarHBondContact O-N 2.98Å; K69-V73 VanDerWaalsContact O-CG2 3.31Å; K69-V73 WeakPolarHBondContact O-CG2 3.39Å; K69-V73 PolarHBondContact O-N 2.85Å
70	E	79.9	Confident	78	Confident	126 Å²	126	111.8 Å²	111.8	59%	0.589	55%	0.546	S	S	*	.	H	α-helix	trans	-63.6	-41.9	177.3	-171.4	174.2	-175.7	0	0	111.7	L66 Q67 Q68 I72 V73 N74	L66-E70 PolarHBondContact O-N 3.26Å; Q67-E70 PolarHBondContact O-N 3.26Å; Q68-E70 PolarHBondContact O-N 3.11Å; E70-I72 VanDerWaalsContact C-N 3.35Å; E70-I72 PolarHBondContact O-N 2.76Å; E70-V73 PolarHBondContact O-N 3.43Å; E70-N74 PolarHBondContact O-N 2.89Å
71	T	72.6	Confident	78.6	Confident	70 Å²	70	110.7 Å²	110.7	43%	0.429	54%	0.541	S	S	.	.	H	α-helix	trans	-60.8	-43.5	175.5	-54.9	0	0	0	0	111.5	Q67 Q68 N74 Q75	Q67-T71 WeakPolarHBondContact O-CB 3.3Å; Q67-T71 PolarHBondContact O-N 2.96Å; Q67-T71 PolarHBondContact O-OG1 3.46Å; Q68-T71 PolarHBondContact O-N 2.87Å; T71-N74 PolarHBondContact O-N 3.37Å; T71-Q75 WeakPolarHBondContact O-CB 3.41Å; T71-Q75 VanDerWaalsContact O-CG 3.3Å; T71-Q75 WeakPolarHBondContact O-CG 3.14Å; T71-Q75 PolarHBondContact O-N 2.94Å
72	I	79.5	Confident	78.9	Confident	103 Å²	103	110.7 Å²	110.7	53%	0.528	54%	0.541	S	S	.	.	H	α-helix	trans	-66.2	-38.6	178	-69.8	165.2	0	0	0	111.3	Q68 K69 E70 Q75 K76	Q68-I72 VanDerWaalsContact O-CG1 3.25Å; Q68-I72 WeakPolarHBondContact O-CG1 3.46Å; Q68-I72 PolarHBondContact O-N 2.98Å; K69-I72 PolarHBondContact O-N 2.98Å; E70-I72 VanDerWaalsContact C-N 3.35Å; E70-I72 PolarHBondContact O-N 2.76Å; I72-Q75 PolarHBondContact O-N 3.47Å; I72-K76 WeakPolarHBondContact O-CB 3.49Å; I72-K76 PolarHBondContact O-N 2.88Å
73	V	77.4	Confident	78.8	Confident	79 Å²	79	106 Å²	106	48%	0.479	53%	0.533	S	S	.	.	H	α-helix	trans	-63.9	-46.3	176.2	169.8	0	0	0	0	110.6	K69 E70 Q75 K76 E77	K69-V73 VanDerWaalsContact O-CG2 3.31Å; K69-V73 WeakPolarHBondContact O-CG2 3.39Å; K69-V73 PolarHBondContact O-N 2.85Å; E70-V73 PolarHBondContact O-N 3.43Å; V73-Q75 PolarHBondContact O-N 2.75Å; V73-K76 WeakPolarHBondContact O-CB 3.39Å; V73-K76 PolarHBondContact O-N 3.18Å; V73-E77 PolarHBondContact O-N 3.01Å
74	N	79	Confident	78.7	Confident	87 Å²	87	103 Å²	103	47%	0.465	53%	0.527	S	S	.	.	H	α-helix	trans	-61.2	-43.8	175.2	-77.8	-19.5	0	0	0	111.8	E70 T71 K76 E77 T78	E70-N74 PolarHBondContact O-N 2.89Å; T71-N74 PolarHBondContact O-N 3.37Å; N74-K76 VanDerWaalsContact C-N 3.32Å; N74-K76 PolarHBondContact O-N 3.42Å; N74-E77 PolarHBondContact O-N 3.22Å; N74-T78 PolarHBondContact O-N 2.95Å; N74-T78 PolarHBondContact O-OG1 3.4Å
75	Q	75.4	Confident	79	Confident	112 Å²	112	105.3 Å²	105.3	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-61.2	-40.5	175.8	-75.7	177.8	-17.3	0	0	112	T71 I72 V73 E77 T78 I79	T71-Q75 WeakPolarHBondContact O-CB 3.41Å; T71-Q75 VanDerWaalsContact O-CG 3.3Å; T71-Q75 WeakPolarHBondContact O-CG 3.14Å; T71-Q75 PolarHBondContact O-N 2.94Å; I72-Q75 PolarHBondContact O-N 3.47Å; V73-Q75 PolarHBondContact O-N 2.75Å; Q75-E77 VanDerWaalsContact C-N 3.34Å; Q75-E77 PolarHBondContact O-N 3.5Å; Q75-T78 PolarHBondContact O-N 3.45Å; Q75-I79 WeakPolarHBondContact O-CB 3.4Å; Q75-I79 WeakPolarHBondContact O-CD1 3.33Å; Q75-I79 VanDerWaalsContact O-CG1 3.24Å; Q75-I79 WeakPolarHBondContact O-CG1 3.41Å; Q75-I79 PolarHBondContact O-N 3.07Å
76	K	80.8	Confident	78.7	Confident	136 Å²	136	106.5 Å²	106.5	59%	0.591	53%	0.534	S	S	*	.	H	α-helix	trans	-65	-37.8	176.9	-174.8	178.4	-179.8	176.6	0	112.3	I72 V73 N74 K80	I72-K76 WeakPolarHBondContact O-CB 3.49Å; I72-K76 PolarHBondContact O-N 2.88Å; V73-K76 WeakPolarHBondContact O-CB 3.39Å; V73-K76 PolarHBondContact O-N 3.18Å; N74-K76 VanDerWaalsContact C-N 3.32Å; N74-K76 PolarHBondContact O-N 3.42Å; K76-K80 PolarHBondContact O-N 2.89Å
77	E	78.3	Confident	78.4	Confident	129 Å²	129	105.1 Å²	105.1	60%	0.603	53%	0.532	S	S	*	.	H	α-helix	trans	-69.5	-41.3	175.9	-165.6	151	-145.8	0	0	111.3	V73 N74 Q75 I79 K80 E81	V73-E77 PolarHBondContact O-N 3.01Å; N74-E77 PolarHBondContact O-N 3.22Å; Q75-E77 VanDerWaalsContact C-N 3.34Å; Q75-E77 PolarHBondContact O-N 3.5Å; E77-I79 VanDerWaalsContact C-N 3.34Å; E77-I79 PolarHBondContact O-N 3.24Å; E77-K80 WeakPolarHBondContact O-CB 3.48Å; E77-K80 PolarHBondContact O-N 3.32Å; E77-E81 PolarHBondContact O-N 3.3Å
78	T	79.7	Confident	77.9	Confident	72 Å²	72	107.8 Å²	107.8	44%	0.442	54%	0.537	S	S	.	.	H	α-helix	trans	-61	-42.7	173.5	-37.7	0	0	0	0	111.3	N74 Q75 E81 L82	N74-T78 PolarHBondContact O-N 2.95Å; N74-T78 PolarHBondContact O-OG1 3.4Å; Q75-T78 PolarHBondContact O-N 3.45Å; T78-E81 PolarHBondContact O-N 3.47Å; T78-L82 HydrophobicContact CG2-CD1 4.27Å; T78-L82 WeakPolarHBondContact O-CB 3.48Å; T78-L82 VanDerWaalsContact O-CG 3.26Å; T78-L82 WeakPolarHBondContact O-CG 3.32Å; T78-L82 PolarHBondContact O-N 3.21Å
79	I	82.2	Confident	77.3	Confident	103 Å²	103	106.2 Å²	106.2	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-44.7	175.2	-71.2	162.4	0	0	0	110.5	Q75 E77 E81 L82 T83	Q75-I79 WeakPolarHBondContact O-CB 3.4Å; Q75-I79 WeakPolarHBondContact O-CD1 3.33Å; Q75-I79 VanDerWaalsContact O-CG1 3.24Å; Q75-I79 WeakPolarHBondContact O-CG1 3.41Å; Q75-I79 PolarHBondContact O-N 3.07Å; E77-I79 VanDerWaalsContact C-N 3.34Å; E77-I79 PolarHBondContact O-N 3.24Å; I79-E81 VanDerWaalsContact C-N 3.31Å; I79-E81 PolarHBondContact O-N 2.83Å; I79-L82 PolarHBondContact O-N 2.92Å; I79-T83 WeakPolarHBondContact O-CB 3.46Å; I79-T83 PolarHBondContact O-N 2.87Å; I79-T83 PolarHBondContact O-OG1 3.01Å
80	K	80.2	Confident	76.4	Confident	145 Å²	145	105.8 Å²	105.8	63%	0.63	54%	0.538	S	S	*	.	H	α-helix	trans	-59.2	-42.4	175.5	-86.7	-175.7	172.6	-175.5	0	112.4	K76 E77 T83 S84	K76-K80 PolarHBondContact O-N 2.89Å; E77-K80 WeakPolarHBondContact O-CB 3.48Å; E77-K80 PolarHBondContact O-N 3.32Å; K80-T83 PolarHBondContact O-N 3.14Å; K80-S84 WeakPolarHBondContact O-CB 3.26Å; K80-S84 PolarHBondContact O-N 3.41Å
81	E	83.2	Confident	75.4	Confident	104 Å²	104	104.1 Å²	104.1	49%	0.486	54%	0.541	S	S	.	.	H	α-helix	trans	-65.7	-44.1	178.4	-167.3	-173.2	164	0	0	111.3	E77 T78 I79 S84 K85	E77-E81 PolarHBondContact O-N 3.3Å; T78-E81 PolarHBondContact O-N 3.47Å; I79-E81 VanDerWaalsContact C-N 3.31Å; I79-E81 PolarHBondContact O-N 2.83Å; E81-S84 PolarHBondContact O-N 3.38Å; E81-K85 HydrophobicContact CG-CD 4.47Å; E81-K85 WeakPolarHBondContact O-CG 3.4Å; E81-K85 PolarHBondContact O-N 3.29Å; E81-K85 WeakPolarHBondContact OE1-CE 3.26Å; E81-K85 IonicContact OE1-NZ 3.87Å; E81-K85 PolarHBondContact OE1-NZ 3.12Å
82	L	77.9	Confident	74.7	Confident	105 Å²	105	109 Å²	109	55%	0.55	56%	0.559	S	S	.	*	H	α-helix	trans	-63.1	-42.9	176.2	-72.4	168.4	0	0	0	111.7	T78 I79 S84 K85 L86	T78-L82 HydrophobicContact CG2-CD1 4.27Å; T78-L82 WeakPolarHBondContact O-CB 3.48Å; T78-L82 VanDerWaalsContact O-CG 3.26Å; T78-L82 WeakPolarHBondContact O-CG 3.32Å; T78-L82 PolarHBondContact O-N 3.21Å; I79-L82 PolarHBondContact O-N 2.92Å; L82-S84 VanDerWaalsContact C-N 3.35Å; L82-S84 PolarHBondContact O-N 2.92Å; L82-K85 PolarHBondContact O-N 3.36Å; L82-L86 WeakPolarHBondContact O-CB 3.44Å; L82-L86 PolarHBondContact O-N 2.84Å
83	T	79.9	Confident	73	Confident	87 Å²	87	108.2 Å²	108.2	53%	0.534	56%	0.562	S	S	.	*	H	α-helix	trans	-63.7	-39	176.2	-57.8	0	0	0	0	111.9	I79 K80 L86 S87	I79-T83 WeakPolarHBondContact O-CB 3.46Å; I79-T83 PolarHBondContact O-N 2.87Å; I79-T83 PolarHBondContact O-OG1 3.01Å; K80-T83 PolarHBondContact O-N 3.14Å; T83-L86 PolarHBondContact O-N 2.82Å; T83-S87 WeakPolarHBondContact O-CB 3.47Å; T83-S87 PolarHBondContact O-N 3.41Å
84	S	78.7	Confident	71.2	Confident	68 Å²	68	111.5 Å²	111.5	48%	0.476	58%	0.577	S	S	.	*	H	α-helix	trans	-64.6	-42.5	174.2	177.8	0	0	0	0	112.1	K80 E81 L82 S87 R88	K80-S84 WeakPolarHBondContact O-CB 3.26Å; K80-S84 PolarHBondContact O-N 3.41Å; E81-S84 PolarHBondContact O-N 3.38Å; L82-S84 VanDerWaalsContact C-N 3.35Å; L82-S84 PolarHBondContact O-N 2.92Å; S84-S87 PolarHBondContact O-N 2.88Å; S84-R88 PolarHBondContact O-N 3.49Å; S84-R88 VanDerWaalsContact O-N 3.11Å
85	K	79.3	Confident	69.4	Low	113 Å²	113	113.4 Å²	113.4	49%	0.491	59%	0.593	S	S	.	*	H	α-helix	trans	-66.1	-38.2	175.3	-72.5	177.5	-176.5	171.3	0	111.8	E81 L82 R88 C89	E81-K85 HydrophobicContact CG-CD 4.47Å; E81-K85 WeakPolarHBondContact O-CG 3.4Å; E81-K85 PolarHBondContact O-N 3.29Å; E81-K85 WeakPolarHBondContact OE1-CE 3.26Å; E81-K85 IonicContact OE1-NZ 3.87Å; E81-K85 PolarHBondContact OE1-NZ 3.12Å; L82-K85 PolarHBondContact O-N 3.36Å; K85-R88 PolarHBondContact O-N 3.37Å; K85-C89 PolarHBondContact O-N 2.92Å; K85-C89 VanDerWaalsContact O-N 3.09Å
86	L	72.4	Confident	67.5	Low	112 Å²	112	113 Å²	113	59%	0.586	61%	0.61	S	S	*	*	H	α-helix	trans	-64.4	-44.3	176.3	-152.2	94.3	0	0	0	111.4	L82 T83 R88 C89 E90	L82-L86 WeakPolarHBondContact O-CB 3.44Å; L82-L86 PolarHBondContact O-N 2.84Å; T83-L86 PolarHBondContact O-N 2.82Å; L86-R88 VanDerWaalsContact C-N 3.29Å; L86-R88 PolarHBondContact O-N 3.25Å; L86-C89 WeakPolarHBondContact O-CB 3.49Å; L86-C89 PolarHBondContact O-N 3.49Å; L86-E90 PolarHBondContact O-N 3.45Å
87	S	70.3	Confident	65.4	Low	71 Å²	71	111.5 Å²	111.5	50%	0.497	62%	0.622	S	S	.	*	H	α-helix	trans	-62.4	-34.3	176.2	177.1	0	0	0	0	112.8	T83 S84 S91	T83-S87 WeakPolarHBondContact O-CB 3.47Å; T83-S87 PolarHBondContact O-N 3.41Å; S84-S87 PolarHBondContact O-N 2.88Å; S87-S91 PolarHBondContact O-N 2.96Å; S87-S91 VanDerWaalsContact O-N 3.1Å; S87-S91 PolarHBondContact O-OG 3.41Å
88	R	71.9	Confident	63.3	Low	184 Å²	184	110.6 Å²	110.6	69%	0.694	64%	0.637	S	S	*	*	H	α-helix	trans	-69.9	-31.5	172.3	-78.3	-177	176.5	-166.8	-0.4	113.1	S84 K85 L86 S91	S84-R88 PolarHBondContact O-N 3.49Å; S84-R88 VanDerWaalsContact O-N 3.11Å; K85-R88 PolarHBondContact O-N 3.37Å; L86-R88 VanDerWaalsContact C-N 3.29Å; L86-R88 PolarHBondContact O-N 3.25Å; R88-S91 WeakPolarHBondContact CA-OG 3.32Å; R88-S91 PolarHBondContact O-OG 2.91Å; R88-S91 VanDerWaalsContact O-OG 3.12Å
89	C	62	Low	61.1	Low	87 Å²	87	110.6 Å²	110.6	59%	0.588	65%	0.651	S	S	*	*	H	α-helix	trans	-73.4	-39.7	173.2	-77.9	0	0	0	0	111.9	K85 L86 S91 Q92 S93	K85-C89 PolarHBondContact O-N 2.92Å; K85-C89 VanDerWaalsContact O-N 3.09Å; L86-C89 WeakPolarHBondContact O-CB 3.49Å; L86-C89 PolarHBondContact O-N 3.49Å; C89-S91 VanDerWaalsContact C-N 3.34Å; C89-S91 PolarHBondContact O-N 3.31Å; C89-Q92 PolarHBondContact O-N 3.03Å; C89-S93 PolarHBondContact O-OG 3.31Å
90	E	64.4	Low	59.4	Low	128 Å²	128	112.3 Å²	112.3	60%	0.598	67%	0.669	S	S	*	*	H	α-helix	trans	-67.3	-31.7	177.2	-86.5	-177.9	151.6	0	0	113.4	L86 Q92 S93	L86-E90 PolarHBondContact O-N 3.45Å; E90-Q92 PolarHBondContact O-N 3.42Å; E90-S93 WeakPolarHBondContact CA-OG 3.5Å; E90-S93 PolarHBondContact O-N 3.46Å; E90-S93 PolarHBondContact O-OG 3.46Å
91	S	59.2	Low	57.1	Low	91 Å²	91	109.5 Å²	109.5	64%	0.636	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-11.4	175.7	48.6	0	0	0	0	114.1	S87 R88 C89	S87-S91 PolarHBondContact O-N 2.96Å; S87-S91 VanDerWaalsContact O-N 3.1Å; S87-S91 PolarHBondContact O-OG 3.41Å; R88-S91 WeakPolarHBondContact CA-OG 3.32Å; R88-S91 PolarHBondContact O-OG 2.91Å; R88-S91 VanDerWaalsContact O-OG 3.12Å; C89-S91 VanDerWaalsContact C-N 3.34Å; C89-S91 PolarHBondContact O-N 3.31Å
92	Q	56.4	Low	54.7	Low	173 Å²	173	108.5 Å²	108.5	81%	0.808	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-5.3	174.8	-75.8	-178.1	-1.7	0	0	113.9	C89 E90	C89-Q92 PolarHBondContact O-N 3.03Å; E90-Q92 PolarHBondContact O-N 3.42Å
93	S	43.9	Very low	52.5	Low	86 Å²	86	115.3 Å²	115.3	60%	0.601	72%	0.718	S	S	*	*	S	Bend	trans	-111	21.2	-171.6	54.9	0	0	0	0	115.3	C89 E90	C89-S93 PolarHBondContact O-OG 3.31Å; E90-S93 WeakPolarHBondContact CA-OG 3.5Å; E90-S93 PolarHBondContact O-N 3.46Å; E90-S93 PolarHBondContact O-OG 3.46Å
94	L	40	Very low	50.3	Low	149 Å²	149	122.5 Å²	122.5	78%	0.78	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-103.9	135.5	171.6	-74	166.8	0	0	0	112.2
95	P	41.2	Very low	48.9	Very low	126 Å²	126	125 Å²	125	82%	0.818	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-81.6	123.4	179.3	14.7	-1.3	0	0	0	111.2
96	A	36.6	Very low	46.5	Very low	105 Å²	105	123.7 Å²	123.7	87%	0.868	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-75	126.8	173.8	0	0	0	0	0	111.3
97	A	35.2	Very low	44.5	Very low	103 Å²	103	122.2 Å²	122.2	85%	0.851	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-70.9	154.7	175.1	0	0	0	0	0	112.9
98	A	35.6	Very low	42.8	Very low	111 Å²	111	127.7 Å²	127.7	92%	0.917	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.7	151.4	-168.4	0	0	0	0	0	116.5
99	G	31.7	Very low	41	Very low	72 Å²	72	125.5 Å²	125.5	74%	0.742	80%	0.797	S	S	*	*			trans	-164.7	132.6	161.2	0	0	0	0	0	111.1
100	P	48.2	Very low	39.7	Very low	138 Å²	138	128 Å²	128	90%	0.896	81%	0.81	S	S	*	*			trans	-104.5	151.2	-166.3	37.6	-31.1	0	0	0	114.7
101	G	32	Very low	38.3	Very low	86 Å²	86	130.8 Å²	130.8	89%	0.887	83%	0.825	S	S	*	*			trans	133.8	122.1	149.7	0	0	0	0	0	117.1
102	G	32	Very low	37.3	Very low	84 Å²	84	129.7 Å²	129.7	87%	0.866	83%	0.828	S	S	*	*			trans	147.9	113.1	159.1	0	0	0	0	0	116.1
103	R	31.3	Very low	36.5	Very low	248 Å²	248	129 Å²	129	94%	0.936	83%	0.83	S	S	*	*			trans	-88.2	134.2	-178.7	-82	172.6	163.2	172.2	-4.9	113.5
104	R	33	Very low	36.5	Very low	238 Å²	238	131.4 Å²	131.4	90%	0.898	84%	0.841	S	S	*	*			trans	43.1	165.3	135.8	-83.9	-172	176.2	-177.2	-0.3	122.1
105	P	49.9	Very low	36.5	Very low	119 Å²	119	129.7 Å²	129.7	77%	0.773	84%	0.841	S	S	*	*			cis	-141.3	165.7	-26.5	36.1	-16.7	0	0	0	116.5
106	G	29.7	Very low	36.7	Very low	86 Å²	86	133.5 Å²	133.5	89%	0.887	84%	0.839	S	S	*	*			trans	105.5	125	137.3	0	0	0	0	0	119.8
107	G	30.8	Very low	36.8	Very low	81 Å²	81	130.8 Å²	130.8	84%	0.835	82%	0.822	S	S	*	*			trans	157.7	75.7	162	0	0	0	0	0	118.6
108	K	34.3	Very low	37.3	Very low	187 Å²	187	131.5 Å²	131.5	81%	0.813	82%	0.816	S	S	*	*			trans	19.6	120.3	153.9	-84.9	172.5	168.3	170.4	0	122.8
109	N	34.3	Very low	37.7	Very low	138 Å²	138	129.3 Å²	129.3	74%	0.738	80%	0.797	S	S	*	*				53.7	117.9	125.3	-47.9	-2.6	0	0	0	121.1
110	T	34	Very low	38.6	Very low	139 Å²	139	130.7 Å²	130.7	85%	0.853	79%	0.788	S	S	*	*				-169.1	133.5	121.2	32.2	0	0	0	0	112.6
111	M	35.4	Very low	38.9	Very low	186 Å²	186	127.9 Å²	127.9	92%	0.916	77%	0.768	S	S	*	*			trans	67.5	107.5	157.6	-69.7	-85.1	-88.4	0	0	120.5
112	G	38.1	Very low	39.8	Very low	69 Å²	69	130 Å²	130	71%	0.711	76%	0.759	S	S	*	*				86.2	89.1	120.9	0	0	0	0	0	118.6
113	D	38.6	Very low	40.8	Very low	159 Å²	159	128.6 Å²	128.6	85%	0.85	74%	0.738	S	S	*	*			trans	49.1	90	136.7	-155.7	16.1	0	0	0	118.8
114	V	44.8	Very low	41.8	Very low	136 Å²	136	122.8 Å²	122.8	82%	0.824	72%	0.722	S	S	*	*			trans	-141.8	96.1	156.1	-176.1	0	0	0	0	108.8
115	S	39	Very low	42.8	Very low	112 Å²	112	116.8 Å²	116.8	78%	0.783	71%	0.707	S	S	*	*			trans	-152.1	67.2	156.4	-158.9	0	0	0	0	110.9
116	R	45.8	Very low	43.4	Very low	207 Å²	207	112.6 Å²	112.6	78%	0.781	69%	0.686	S	S	*	*			trans	-153.5	20.2	165.8	-119.2	175.7	173.5	152.1	-1.3	115.3
117	G	40.1	Very low	44.9	Very low	48 Å²	48	114.5 Å²	114.5	50%	0.495	67%	0.672	S	S	.	*	H	α-helix	trans	-83.5	-12.7	-169.1	0	0	0	0	0	117.8	T121	G117-T121 VanDerWaalsContact O-CG2 3.27Å; G117-T121 WeakPolarHBondContact O-CG2 3.46Å; G117-T121 PolarHBondContact O-OG1 3.2Å
118	T	44.2	Very low	46.5	Very low	118 Å²	118	114.3 Å²	114.3	72%	0.724	65%	0.654	S	S	*	*	H	α-helix	trans	-98.1	-21.8	-175.8	43.2	0	0	0	0	114.2	T121	T118-T121 PolarHBondContact O-OG1 2.84Å
119	A	44.7	Very low	47.6	Very low	65 Å²	65	110.8 Å²	110.8	54%	0.537	64%	0.644	S	S	.	*	H	α-helix	trans	-83.9	-38.8	177.4	0	0	0	0	0	112.1	A123	A119-A123 WeakPolarHBondContact O-CB 3.22Å; A119-A123 PolarHBondContact O-N 3.06Å; A119-A123 VanDerWaalsContact O-N 3.08Å
120	D	50	Low	48.8	Very low	100 Å²	100	110.5 Å²	110.5	54%	0.535	64%	0.638	S	S	.	*	H	α-helix	trans	-73.3	-30.9	-179.1	-70.8	-19.7	0	0	0	112.5	A123 Q124	D120-A123 PolarHBondContact O-N 3.15Å; D120-Q124 WeakPolarHBondContact O-CB 3.33Å; D120-Q124 WeakPolarHBondContact O-CG 3.37Å; D120-Q124 PolarHBondContact O-N 3Å
121	T	55.1	Low	50.3	Low	80 Å²	80	107.6 Å²	107.6	49%	0.491	62%	0.62	S	S	.	*	H	α-helix	trans	-71.6	-37.9	175.8	45.4	0	0	0	0	112.3	G117 T118 Q124 L125	G117-T121 VanDerWaalsContact O-CG2 3.27Å; G117-T121 WeakPolarHBondContact O-CG2 3.46Å; G117-T121 PolarHBondContact O-OG1 3.2Å; T118-T121 PolarHBondContact O-OG1 2.84Å; T121-Q124 PolarHBondContact O-N 3.32Å; T121-L125 WeakPolarHBondContact O-CB 3.39Å; T121-L125 PolarHBondContact O-N 2.93Å
122	L	50.6	Low	51.5	Low	131 Å²	131	104.1 Å²	104.1	69%	0.686	60%	0.604	S	S	*	*	H	α-helix	trans	-68.6	-37.2	173.5	-112.5	153.8	0	0	0	112	L125 G126	L122-L125 PolarHBondContact O-N 3.34Å; L122-G126 PolarHBondContact O-N 2.9Å
123	A	52.8	Low	52.7	Low	53 Å²	53	106.9 Å²	106.9	44%	0.438	60%	0.597	S	S	.	*	H	α-helix	trans	-68.1	-41.3	174.2	0	0	0	0	0	112.2	A119 D120 G126 Q127	A119-A123 WeakPolarHBondContact O-CB 3.22Å; A119-A123 PolarHBondContact O-N 3.06Å; A119-A123 VanDerWaalsContact O-N 3.08Å; D120-A123 PolarHBondContact O-N 3.15Å; A123-G126 PolarHBondContact O-N 2.99Å; A123-Q127 WeakPolarHBondContact O-CG 3.44Å; A123-Q127 PolarHBondContact O-N 3.25Å
124	Q	53.6	Low	53.6	Low	127 Å²	127	105.2 Å²	105.2	59%	0.593	58%	0.584	S	S	*	*	H	α-helix	trans	-66.4	-38.2	173.8	-83.5	-177.7	-22	0	0	112.4	D120 T121 G126 Q127 T128	D120-Q124 WeakPolarHBondContact O-CB 3.33Å; D120-Q124 WeakPolarHBondContact O-CG 3.37Å; D120-Q124 PolarHBondContact O-N 3Å; T121-Q124 PolarHBondContact O-N 3.32Å; Q124-G126 VanDerWaalsContact C-N 3.35Å; Q124-Q127 PolarHBondContact O-N 3.48Å; Q124-T128 WeakPolarHBondContact O-CG2 3.43Å; Q124-T128 PolarHBondContact O-N 3.16Å; Q124-T128 PolarHBondContact O-OG1 2.9Å
125	L	53.4	Low	54.5	Low	111 Å²	111	106.9 Å²	106.9	58%	0.581	58%	0.576	S	S	*	*	H	α-helix	trans	-66.5	-38.9	175	-148.1	84.7	0	0	0	111.2	T121 L122 T128 L129	T121-L125 WeakPolarHBondContact O-CB 3.39Å; T121-L125 PolarHBondContact O-N 2.93Å; L122-L125 PolarHBondContact O-N 3.34Å; L125-T128 WeakPolarHBondContact CA-OG1 3.24Å; L125-T128 PolarHBondContact O-N 3.35Å; L125-T128 PolarHBondContact O-OG1 3.37Å; L125-L129 WeakPolarHBondContact O-CB 3.24Å; L125-L129 PolarHBondContact O-N 3.17Å
126	G	63.2	Low	55.2	Low	32 Å²	32	107.3 Å²	107.3	33%	0.33	57%	0.569	S	S	.	*	H	α-helix	trans	-62.4	-43.7	173.7	0	0	0	0	0	113	L122 A123 Q124 L129 Q130	L122-G126 PolarHBondContact O-N 2.9Å; A123-G126 PolarHBondContact O-N 2.99Å; Q124-G126 VanDerWaalsContact C-N 3.35Å; G126-L129 PolarHBondContact O-N 3.39Å; G126-Q130 PolarHBondContact O-N 3.34Å
127	Q	60.7	Low	55.7	Low	126 Å²	126	101.7 Å²	101.7	59%	0.589	55%	0.551	S	S	*	*	H	α-helix	trans	-67.4	-38.2	178	-76.5	179.1	-4.2	0	0	112.8	A123 Q124 Q130 T131	A123-Q127 WeakPolarHBondContact O-CG 3.44Å; A123-Q127 PolarHBondContact O-N 3.25Å; Q124-Q127 PolarHBondContact O-N 3.48Å; Q127-Q130 PolarHBondContact O-N 3.33Å; Q127-T131 WeakPolarHBondContact O-CB 3.33Å; Q127-T131 PolarHBondContact O-N 2.63Å; Q127-T131 PolarHBondContact O-OG1 3.1Å
128	T	63.2	Low	56.3	Low	76 Å²	76	104 Å²	104	47%	0.466	55%	0.552	S	S	.	*	H	α-helix	trans	-70.6	-37.8	176.8	47.8	0	0	0	0	112	Q124 L125 T131 L132	Q124-T128 WeakPolarHBondContact O-CG2 3.43Å; Q124-T128 PolarHBondContact O-N 3.16Å; Q124-T128 PolarHBondContact O-OG1 2.9Å; L125-T128 WeakPolarHBondContact CA-OG1 3.24Å; L125-T128 PolarHBondContact O-N 3.35Å; L125-T128 PolarHBondContact O-OG1 3.37Å; T128-T131 PolarHBondContact O-N 3.01Å; T128-L132 WeakPolarHBondContact O-CB 3.39Å; T128-L132 WeakPolarHBondContact O-CG 3.28Å; T128-L132 PolarHBondContact O-N 2.85Å
129	L	59	Low	56.5	Low	113 Å²	113	104.1 Å²	104.1	59%	0.592	55%	0.547	S	S	*	.	H	α-helix	trans	-63.5	-41.8	171.3	-105.9	154	0	0	0	112.7	L125 G126 L132 K133	L125-L129 WeakPolarHBondContact O-CB 3.24Å; L125-L129 PolarHBondContact O-N 3.17Å; G126-L129 PolarHBondContact O-N 3.39Å; L129-L132 PolarHBondContact O-N 3.05Å; L129-K133 VanDerWaalsContact O-CB 3.3Å; L129-K133 WeakPolarHBondContact O-CB 3.4Å; L129-K133 PolarHBondContact O-N 3.09Å
130	Q	59.1	Low	56.7	Low	133 Å²	133	105.8 Å²	105.8	62%	0.621	54%	0.544	S	S	*	.	H	α-helix	trans	-66	-39	174.7	-98.7	162.9	-27.4	0	0	112.4	G126 Q127 K133 Q134	G126-Q130 PolarHBondContact O-N 3.34Å; Q127-Q130 PolarHBondContact O-N 3.33Å; Q130-K133 PolarHBondContact O-N 3.31Å; Q130-Q134 WeakPolarHBondContact O-CB 3.38Å; Q130-Q134 PolarHBondContact O-N 3.37Å
131	T	64.1	Low	56.5	Low	78 Å²	78	107.1 Å²	107.1	48%	0.479	55%	0.547	S	S	.	.	H	α-helix	trans	-66.6	-39.9	176.3	-55.3	0	0	0	0	111.6	Q127 T128 Q134 R135	Q127-T131 WeakPolarHBondContact O-CB 3.33Å; Q127-T131 PolarHBondContact O-N 2.63Å; Q127-T131 PolarHBondContact O-OG1 3.1Å; T128-T131 PolarHBondContact O-N 3.01Å; T131-Q134 PolarHBondContact O-N 2.81Å; T131-R135 WeakPolarHBondContact O-CG 3.3Å; T131-R135 PolarHBondContact O-N 2.93Å
132	L	60.4	Low	55.8	Low	112 Å²	112	113.2 Å²	113.2	59%	0.586	56%	0.563	S	S	*	*	H	α-helix	trans	-68.2	-41.3	175	-81.8	162.9	0	0	0	111.9	T128 L129 Q134 R135 L136	T128-L132 WeakPolarHBondContact O-CB 3.39Å; T128-L132 WeakPolarHBondContact O-CG 3.28Å; T128-L132 PolarHBondContact O-N 2.85Å; L129-L132 PolarHBondContact O-N 3.05Å; L132-Q134 VanDerWaalsContact C-N 3.33Å; L132-Q134 PolarHBondContact O-N 2.84Å; L132-R135 PolarHBondContact O-N 3.26Å; L132-L136 WeakPolarHBondContact O-CB 3.28Å; L132-L136 PolarHBondContact O-N 2.94Å
133	K	63.5	Low	55.3	Low	128 Å²	128	111.9 Å²	111.9	56%	0.557	56%	0.564	S	S	*	*	H	α-helix	trans	-57.7	-46.4	173.7	-174.7	-175.8	177	-168.4	0	111.1	L129 Q130 R135 L136 E137	L129-K133 VanDerWaalsContact O-CB 3.3Å; L129-K133 WeakPolarHBondContact O-CB 3.4Å; L129-K133 PolarHBondContact O-N 3.09Å; Q130-K133 PolarHBondContact O-N 3.31Å; K133-R135 VanDerWaalsContact C-N 3.32Å; K133-R135 PolarHBondContact O-N 3.44Å; K133-L136 WeakPolarHBondContact O-CB 3.5Å; K133-L136 PolarHBondContact O-N 3.46Å; K133-E137 WeakPolarHBondContact CE-OE1 3.17Å; K133-E137 IonicContact NZ-OE1 3.37Å; K133-E137 WeakPolarHBondContact O-CG 3.44Å; K133-E137 PolarHBondContact O-N 2.85Å
134	Q	59.2	Low	54.9	Low	124 Å²	124	117.1 Å²	117.1	58%	0.579	57%	0.573	S	S	*	*	H	α-helix	trans	-69.8	-28.9	179.8	-163.9	135	15	0	0	113	Q130 T131 L132 N138	Q130-Q134 WeakPolarHBondContact O-CB 3.38Å; Q130-Q134 PolarHBondContact O-N 3.37Å; T131-Q134 PolarHBondContact O-N 2.81Å; L132-Q134 VanDerWaalsContact C-N 3.33Å; L132-Q134 PolarHBondContact O-N 2.84Å; Q134-N138 WeakPolarHBondContact O-CB 3.38Å; Q134-N138 PolarHBondContact O-N 3.4Å; Q134-N138 PolarHBondContact O-ND2 2.65Å
135	R	62.3	Low	54.4	Low	171 Å²	171	113.6 Å²	113.6	65%	0.645	57%	0.57	S	S	*	*	H	α-helix	trans	-73.8	-35.1	170.5	-76.9	-176.3	177.5	-166.5	-0.1	112.4	T131 L132 K133 N138 L139	T131-R135 WeakPolarHBondContact O-CG 3.3Å; T131-R135 PolarHBondContact O-N 2.93Å; L132-R135 PolarHBondContact O-N 3.26Å; K133-R135 VanDerWaalsContact C-N 3.32Å; K133-R135 PolarHBondContact O-N 3.44Å; R135-N138 PolarHBondContact O-N 2.63Å; R135-L139 WeakPolarHBondContact O-CB 3.25Å; R135-L139 WeakPolarHBondContact O-CG 3.36Å; R135-L139 PolarHBondContact O-N 2.98Å
136	L	55.2	Low	54.3	Low	121 Å²	121	115.2 Å²	115.2	63%	0.634	58%	0.58	S	S	*	*	H	α-helix	trans	-67.4	-44.3	175	-142.8	101.1	0	0	0	110.8	L132 K133 N138 L139 E140	L132-L136 WeakPolarHBondContact O-CB 3.28Å; L132-L136 PolarHBondContact O-N 2.94Å; K133-L136 WeakPolarHBondContact O-CB 3.5Å; K133-L136 PolarHBondContact O-N 3.46Å; L136-N138 PolarHBondContact O-N 2.87Å; L136-L139 PolarHBondContact O-N 2.84Å; L136-E140 VanDerWaalsContact O-CB 3.32Å; L136-E140 WeakPolarHBondContact O-CB 3.38Å; L136-E140 PolarHBondContact O-N 3.08Å
137	E	54.8	Low	53.8	Low	88 Å²	88	121.2 Å²	121.2	41%	0.411	60%	0.604	S	S	.	*	H	α-helix	trans	-62.4	-40.7	174.7	-73.5	171.2	170.9	0	0	111.4	K133 E140 Q141	K133-E137 WeakPolarHBondContact CE-OE1 3.17Å; K133-E137 IonicContact NZ-OE1 3.37Å; K133-E137 WeakPolarHBondContact O-CG 3.44Å; K133-E137 PolarHBondContact O-N 2.85Å; E137-E140 PolarHBondContact O-N 3.12Å; E137-Q141 WeakPolarHBondContact O-CB 3.48Å; E137-Q141 PolarHBondContact O-N 2.98Å
138	N	53.3	Low	53.4	Low	96 Å²	96	117.5 Å²	117.5	51%	0.513	59%	0.592	S	S	.	*	H	α-helix	trans	-67.6	-37.4	173.8	-90.7	-40.1	0	0	0	113.4	Q134 R135 L136 Q141 Y142	Q134-N138 WeakPolarHBondContact O-CB 3.38Å; Q134-N138 PolarHBondContact O-N 3.4Å; Q134-N138 PolarHBondContact O-ND2 2.65Å; R135-N138 PolarHBondContact O-N 2.63Å; L136-N138 PolarHBondContact O-N 2.87Å; N138-Q141 PolarHBondContact O-N 3.38Å; N138-Y142 PolarHBondContact O-N 2.98Å
139	L	48	Very low	52.8	Low	121 Å²	121	117.5 Å²	117.5	63%	0.634	60%	0.6	S	S	*	*	H	α-helix	trans	-69.1	-36	174.4	-88.9	156.5	0	0	0	111.7	R135 L136 Q141 Y142 S143	R135-L139 WeakPolarHBondContact O-CB 3.25Å; R135-L139 WeakPolarHBondContact O-CG 3.36Å; R135-L139 PolarHBondContact O-N 2.98Å; L136-L139 PolarHBondContact O-N 2.84Å; L139-Q141 VanDerWaalsContact C-N 3.35Å; L139-Y142 PolarHBondContact O-N 3.32Å; L139-S143 PolarHBondContact O-N 3.48Å
140	E	49.4	Very low	52.3	Low	100 Å²	100	120.2 Å²	120.2	47%	0.467	61%	0.609	S	S	.	*	H	α-helix	trans	-69	-34.3	174	-156.4	178.7	-177.5	0	0	111.2	L136 E137 S143 R144	L136-E140 VanDerWaalsContact O-CB 3.32Å; L136-E140 WeakPolarHBondContact O-CB 3.38Å; L136-E140 PolarHBondContact O-N 3.08Å; E137-E140 PolarHBondContact O-N 3.12Å; E140-S143 PolarHBondContact O-N 3.11Å; E140-R144 WeakPolarHBondContact O-CB 3.4Å; E140-R144 WeakPolarHBondContact O-CG 3.47Å; E140-R144 PolarHBondContact O-N 3.46Å; E140-R144 IonicContact OE1-NH2 3.93Å
141	Q	46.2	Very low	51.8	Low	128 Å²	128	116.5 Å²	116.5	60%	0.598	60%	0.601	S	S	*	*	H	α-helix	trans	-67.4	-38.1	169.7	-109.2	164.2	-24.6	0	0	113.1	E137 N138 L139 S143 R144 G145	E137-Q141 WeakPolarHBondContact O-CB 3.48Å; E137-Q141 PolarHBondContact O-N 2.98Å; N138-Q141 PolarHBondContact O-N 3.38Å; L139-Q141 VanDerWaalsContact C-N 3.35Å; Q141-S143 VanDerWaalsContact C-N 3.32Å; Q141-R144 PolarHBondContact O-N 2.83Å; Q141-G145 PolarHBondContact O-N 3.47Å
142	Y	39.7	Very low	51.2	Low	209 Å²	209	117 Å²	117	82%	0.82	60%	0.601	S	S	*	*	H	α-helix	trans	-68.1	-32.8	175.3	-147.9	-93.9	0	0	0	111.9	N138 L139	N138-Y142 PolarHBondContact O-N 2.98Å; L139-Y142 PolarHBondContact O-N 3.32Å
143	S	40	Very low	51	Low	102 Å²	102	115.3 Å²	115.3	71%	0.713	60%	0.599	S	S	*	*	H	α-helix	trans	-75.2	-35.7	173.6	179.7	0	0	0	0	113.2	L139 E140 Q141 G145	L139-S143 PolarHBondContact O-N 3.48Å; E140-S143 PolarHBondContact O-N 3.11Å; Q141-S143 VanDerWaalsContact C-N 3.32Å; S143-G145 VanDerWaalsContact C-N 3.26Å; S143-G145 PolarHBondContact O-N 2.85Å
144	R	45.5	Very low	50.5	Low	164 Å²	164	114.2 Å²	114.2	62%	0.619	60%	0.598	S	S	*	*	H	α-helix	trans	-75.4	-13.3	173.8	-75.7	-177.6	171.2	173.3	3.6	114.1	E140 Q141 N146 S148	E140-R144 WeakPolarHBondContact O-CB 3.4Å; E140-R144 WeakPolarHBondContact O-CG 3.47Å; E140-R144 PolarHBondContact O-N 3.46Å; E140-R144 IonicContact OE1-NH2 3.93Å; Q141-R144 PolarHBondContact O-N 2.83Å; R144-N146 VanDerWaalsContact C-N 3.31Å; R144-N146 PolarHBondContact O-N 3.27Å; R144-S148 PolarHBondContact O-OG 2.94Å
145	G	42.8	Very low	50.5	Low	52 Å²	52	114.7 Å²	114.7	54%	0.536	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.8	-10.1	-173.2	0	0	0	0	0	116.5	Q141 S143	Q141-G145 PolarHBondContact O-N 3.47Å; S143-G145 VanDerWaalsContact C-N 3.26Å; S143-G145 PolarHBondContact O-N 2.85Å
146	N	51.1	Low	50.6	Low	146 Å²	146	111.3 Å²	111.3	78%	0.781	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	21.5	-172.2	-129.5	36.2	0	0	0	116.9	R144	R144-N146 VanDerWaalsContact C-N 3.31Å; R144-N146 PolarHBondContact O-N 3.27Å
147	N	51.9	Low	51.1	Low	157 Å²	157	111 Å²	111	84%	0.84	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.3	1.8	164.6	-97.1	-34.7	0	0	0	116.4
148	S	53.4	Low	51.4	Low	49 Å²	49	111.4 Å²	111.4	34%	0.343	60%	0.596	S	S	.	*	S	Bend	trans	-111.1	-23.4	-170.3	68.7	0	0	0	0	116.1	R144 Q150 A151 N152	R144-S148 PolarHBondContact O-OG 2.94Å; S148-Q150 PolarHBondContact O-N 3.31Å; S148-A151 PolarHBondContact O-N 2.9Å; S148-N152 PolarHBondContact O-N 2.66Å; S148-N152 PolarHBondContact O-ND2 2.84Å
149	A	49.2	Very low	52.1	Low	76 Å²	76	111.2 Å²	111.2	63%	0.628	59%	0.592	S	S	*	*	H	α-helix	trans	-70.1	-33.5	-173.7	0	0	0	0	0	113.6	S153	A149-S153 WeakPolarHBondContact O-CB 3.41Å; A149-S153 PolarHBondContact O-N 3.41Å
150	Q	49.3	Very low	53.3	Low	170 Å²	170	110.7 Å²	110.7	79%	0.794	59%	0.59	S	S	*	*	H	α-helix	trans	-73.4	-33.2	174.6	-80.5	160.1	-27.1	0	0	112.4	S148 L154	S148-Q150 PolarHBondContact O-N 3.31Å; Q150-L154 WeakPolarHBondContact O-CB 3.42Å; Q150-L154 PolarHBondContact O-N 2.89Å
151	A	47.9	Very low	54.4	Low	55 Å²	55	112.3 Å²	112.3	46%	0.455	60%	0.595	S	S	.	*	H	α-helix	trans	-74	-38.5	179.7	0	0	0	0	0	112.4	S148 K155	S148-A151 PolarHBondContact O-N 2.9Å; A151-K155 VanDerWaalsContact O-CB 3.22Å; A151-K155 WeakPolarHBondContact O-CB 3.26Å; A151-K155 PolarHBondContact O-N 3.41Å
152	N	53	Low	55.7	Low	88 Å²	88	109.6 Å²	109.6	47%	0.471	58%	0.584	S	S	.	*	H	α-helix	trans	-72.2	-39.1	178.4	-69.6	-23.6	0	0	0	112.1	S148 L154 K155 D156	S148-N152 PolarHBondContact O-N 2.66Å; S148-N152 PolarHBondContact O-ND2 2.84Å; N152-L154 PolarHBondContact O-N 3.24Å; N152-K155 PolarHBondContact O-N 2.87Å; N152-D156 WeakPolarHBondContact O-CB 3.41Å; N152-D156 PolarHBondContact O-N 3.32Å
153	S	55.3	Low	57.2	Low	77 Å²	77	102.8 Å²	102.8	54%	0.538	56%	0.562	S	S	.	*	H	α-helix	trans	-61.8	-42.3	173.8	178.1	0	0	0	0	112.1	A149 L157	A149-S153 WeakPolarHBondContact O-CB 3.41Å; A149-S153 PolarHBondContact O-N 3.41Å; S153-L157 VanDerWaalsContact O-CB 3.26Å; S153-L157 WeakPolarHBondContact O-CB 3.22Å; S153-L157 PolarHBondContact O-N 2.89Å
154	L	53.5	Low	58.8	Low	105 Å²	105	102.5 Å²	102.5	55%	0.55	55%	0.553	S	S	.	*	H	α-helix	trans	-69.1	-38.6	176.7	-173.3	64	0	0	0	112.1	Q150 N152 L157 L158	Q150-L154 WeakPolarHBondContact O-CB 3.42Å; Q150-L154 PolarHBondContact O-N 2.89Å; N152-L154 PolarHBondContact O-N 3.24Å; L154-L157 PolarHBondContact O-N 3.41Å; L154-L158 HydrophobicContact CD1-CD1 4.47Å; L154-L158 HydrophobicContact CG-CD1 4Å; L154-L158 WeakPolarHBondContact O-CB 3.49Å; L154-L158 VanDerWaalsContact O-CG 3.24Å; L154-L158 WeakPolarHBondContact O-CG 3.46Å; L154-L158 PolarHBondContact O-N 3.32Å
155	K	59.7	Low	59.8	Low	134 Å²	134	99.6 Å²	99.6	58%	0.583	55%	0.547	S	S	*	.	H	α-helix	trans	-64.7	-44	177	-174.4	-178.7	177.4	-173.3	0	111.8	A151 N152 L157 L158 Q159	A151-K155 VanDerWaalsContact O-CB 3.22Å; A151-K155 WeakPolarHBondContact O-CB 3.26Å; A151-K155 PolarHBondContact O-N 3.41Å; N152-K155 PolarHBondContact O-N 2.87Å; K155-L157 VanDerWaalsContact C-N 3.34Å; K155-L158 PolarHBondContact O-N 2.9Å; K155-Q159 WeakPolarHBondContact O-CB 3.49Å; K155-Q159 PolarHBondContact O-N 3.43Å
156	D	62.6	Low	61.1	Low	100 Å²	100	102.5 Å²	102.5	54%	0.535	55%	0.547	S	S	.	.	H	α-helix	trans	-68.9	-34.6	177.2	-72.2	-21.4	0	0	0	111.6	N152 N160	N152-D156 WeakPolarHBondContact O-CB 3.41Å; N152-D156 PolarHBondContact O-N 3.32Å; D156-N160 WeakPolarHBondContact O-CB 3.48Å; D156-N160 VanDerWaalsContact O-CG 3.28Å; D156-N160 PolarHBondContact O-N 3.34Å; D156-N160 PolarHBondContact O-ND2 2.97Å
157	L	66.1	Low	62	Low	114 Å²	114	102.6 Å²	102.6	60%	0.597	54%	0.54	S	S	*	.	H	α-helix	trans	-70.3	-36.6	175.3	-159.5	133.3	0	0	0	111.9	S153 L154 K155 K161	S153-L157 VanDerWaalsContact O-CB 3.26Å; S153-L157 WeakPolarHBondContact O-CB 3.22Å; S153-L157 PolarHBondContact O-N 2.89Å; L154-L157 PolarHBondContact O-N 3.41Å; K155-L157 VanDerWaalsContact C-N 3.34Å; L157-K161 WeakPolarHBondContact O-CB 3.43Å; L157-K161 PolarHBondContact O-N 2.9Å; L157-K161 VanDerWaalsContact O-N 3.14Å
158	L	61.8	Low	62.7	Low	96 Å²	96	100 Å²	100	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-69.5	-41.8	172.7	-76.3	166.6	0	0	0	111.8	L154 K155 K161 I162	L154-L158 HydrophobicContact CD1-CD1 4.47Å; L154-L158 HydrophobicContact CG-CD1 4Å; L154-L158 WeakPolarHBondContact O-CB 3.49Å; L154-L158 VanDerWaalsContact O-CG 3.24Å; L154-L158 WeakPolarHBondContact O-CG 3.46Å; L154-L158 PolarHBondContact O-N 3.32Å; K155-L158 PolarHBondContact O-N 2.9Å; L158-K161 WeakPolarHBondContact O-CB 3.31Å; L158-K161 PolarHBondContact O-N 3.18Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.4Å; L158-I162 PolarHBondContact O-N 2.98Å
159	Q	66.9	Low	63.4	Low	92 Å²	92	102 Å²	102	43%	0.43	53%	0.533	S	S	.	.	H	α-helix	trans	-65.4	-44.2	178.8	-163.9	63.6	45.1	0	0	111.3	K155 K161 I162 D163	K155-Q159 WeakPolarHBondContact O-CB 3.49Å; K155-Q159 PolarHBondContact O-N 3.43Å; Q159-K161 VanDerWaalsContact C-N 3.27Å; Q159-K161 PolarHBondContact O-N 2.87Å; Q159-I162 PolarHBondContact O-N 2.89Å; Q159-D163 PolarHBondContact O-N 3.24Å
160	N	74.1	Confident	63.7	Low	111 Å²	111	103.9 Å²	103.9	59%	0.594	53%	0.532	S	S	*	.	H	α-helix	trans	-62.5	-34	173.9	-76.3	-44.6	0	0	0	112.5	D156 D164	D156-N160 WeakPolarHBondContact O-CB 3.48Å; D156-N160 VanDerWaalsContact O-CG 3.28Å; D156-N160 PolarHBondContact O-N 3.34Å; D156-N160 PolarHBondContact O-ND2 2.97Å; N160-D164 WeakPolarHBondContact O-CB 3.3Å; N160-D164 PolarHBondContact O-N 3.49Å; N160-D164 VanDerWaalsContact O-N 3.11Å
161	K	71.3	Confident	64.3	Low	133 Å²	133	98.9 Å²	98.9	58%	0.578	52%	0.516	S	S	*	.	H	α-helix	trans	-70.4	-36.9	176	-157.5	86.8	179	-173.6	0	112	L157 L158 Q159 M165	L157-K161 WeakPolarHBondContact O-CB 3.43Å; L157-K161 PolarHBondContact O-N 2.9Å; L157-K161 VanDerWaalsContact O-N 3.14Å; L158-K161 WeakPolarHBondContact O-CB 3.31Å; L158-K161 PolarHBondContact O-N 3.18Å; Q159-K161 VanDerWaalsContact C-N 3.27Å; Q159-K161 PolarHBondContact O-N 2.87Å; K161-M165 WeakPolarHBondContact O-CB 3.24Å; K161-M165 WeakPolarHBondContact O-CG 3.45Å; K161-M165 PolarHBondContact O-N 3.4Å
162	I	75.4	Confident	64.7	Low	71 Å²	71	105 Å²	105	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-66.5	-47.3	176.4	-70.3	163.8	0	0	0	109.8	L158 Q159 D164 M165 E166	L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.4Å; L158-I162 PolarHBondContact O-N 2.98Å; Q159-I162 PolarHBondContact O-N 2.89Å; I162-D164 VanDerWaalsContact C-N 3.33Å; I162-D164 PolarHBondContact O-N 3.21Å; I162-M165 CarbonylContact O-C 3.26Å; I162-M165 PolarHBondContact O-N 3.47Å; I162-E166 PolarHBondContact O-N 3.4Å
163	D	69.6	Low	64.9	Low	67 Å²	67	105.2 Å²	105.2	36%	0.358	53%	0.531	S	S	.	.	H	α-helix	trans	-64.5	-35.7	179.5	-69	3.1	0	0	0	112.4	Q159 K167	Q159-D163 PolarHBondContact O-N 3.24Å; D163-K167 WeakPolarHBondContact O-CG 3.49Å; D163-K167 PolarHBondContact O-N 2.79Å
164	D	73.4	Confident	64.4	Low	95 Å²	95	107.8 Å²	107.8	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-69.7	-38	175	-163.3	54.7	0	0	0	111.8	N160 I162 K167 Q168	N160-D164 WeakPolarHBondContact O-CB 3.3Å; N160-D164 PolarHBondContact O-N 3.49Å; N160-D164 VanDerWaalsContact O-N 3.11Å; I162-D164 VanDerWaalsContact C-N 3.33Å; I162-D164 PolarHBondContact O-N 3.21Å; D164-K167 PolarHBondContact O-N 3.25Å; D164-Q168 PolarHBondContact O-N 2.89Å
165	M	67.4	Low	64.2	Low	103 Å²	103	109.3 Å²	109.3	51%	0.507	55%	0.546	S	S	.	.	H	α-helix	trans	-68.3	-39.1	172.7	-76.6	-168.3	-54.8	0	0	112.4	K161 I162 K167 Q168 V169	K161-M165 WeakPolarHBondContact O-CB 3.24Å; K161-M165 WeakPolarHBondContact O-CG 3.45Å; K161-M165 PolarHBondContact O-N 3.4Å; I162-M165 CarbonylContact O-C 3.26Å; I162-M165 PolarHBondContact O-N 3.47Å; M165-K167 VanDerWaalsContact C-N 3.34Å; M165-K167 PolarHBondContact O-N 2.8Å; M165-Q168 PolarHBondContact O-N 2.8Å; M165-V169 WeakPolarHBondContact O-CG2 3.42Å; M165-V169 PolarHBondContact O-N 3.37Å
166	E	69.5	Low	63.6	Low	114 Å²	114	109.3 Å²	109.3	53%	0.533	55%	0.548	S	S	.	.	H	α-helix	trans	-62.7	-41.5	174.5	-78.9	-171.2	165.4	0	0	111.3	I162 Q168 V169 L170	I162-E166 PolarHBondContact O-N 3.4Å; E166-Q168 PolarHBondContact O-N 2.89Å; E166-V169 PolarHBondContact O-N 2.81Å; E166-L170 WeakPolarHBondContact O-CB 3.1Å; E166-L170 VanDerWaalsContact O-CG 3.25Å; E166-L170 WeakPolarHBondContact O-CG 3.26Å; E166-L170 PolarHBondContact O-N 3.13Å
167	K	71.5	Confident	62.7	Low	147 Å²	147	113.1 Å²	113.1	64%	0.639	56%	0.563	S	S	*	*	H	α-helix	trans	-65.5	-36.1	173.6	-75.9	177.1	-177.9	171.1	0	112.8	D163 D164 M165 S171	D163-K167 WeakPolarHBondContact O-CG 3.49Å; D163-K167 PolarHBondContact O-N 2.79Å; D164-K167 PolarHBondContact O-N 3.25Å; M165-K167 VanDerWaalsContact C-N 3.34Å; M165-K167 PolarHBondContact O-N 2.8Å; K167-S171 VanDerWaalsContact O-CB 3.32Å; K167-S171 WeakPolarHBondContact O-CB 3.25Å; K167-S171 PolarHBondContact O-N 2.72Å; K167-S171 PolarHBondContact O-OG 3.4Å
168	Q	66.8	Low	61.5	Low	104 Å²	104	112.5 Å²	112.5	49%	0.486	57%	0.568	S	S	.	*	H	α-helix	trans	-67.2	-37.2	172.8	-86.8	-169.3	3.3	0	0	112.8	D164 M165 E166 S171 R172	D164-Q168 PolarHBondContact O-N 2.89Å; M165-Q168 PolarHBondContact O-N 2.8Å; E166-Q168 PolarHBondContact O-N 2.89Å; Q168-S171 WeakPolarHBondContact CA-OG 3.47Å; Q168-S171 PolarHBondContact O-OG 2.95Å; Q168-S171 VanDerWaalsContact O-OG 3.13Å; Q168-R172 WeakPolarHBondContact O-CB 3.31Å; Q168-R172 VanDerWaalsContact O-CG 3.31Å; Q168-R172 WeakPolarHBondContact O-CG 3.35Å; Q168-R172 PolarHBondContact O-N 2.97Å
169	V	66.4	Low	60.5	Low	91 Å²	91	119.6 Å²	119.6	55%	0.552	59%	0.588	S	S	*	*	H	α-helix	trans	-69.9	-47.2	175.9	171.6	0	0	0	0	110.2	M165 E166 S171 R172 V173	M165-V169 WeakPolarHBondContact O-CG2 3.42Å; M165-V169 PolarHBondContact O-N 3.37Å; E166-V169 PolarHBondContact O-N 2.81Å; V169-S171 PolarHBondContact O-N 3.42Å; V169-R172 PolarHBondContact O-N 2.79Å; V169-R172 VanDerWaalsContact O-N 3.14Å; V169-V173 HydrophobicContact CG1-CG2 4.24Å; V169-V173 VanDerWaalsContact O-CG2 3.25Å; V169-V173 WeakPolarHBondContact O-CG2 3.43Å; V169-V173 PolarHBondContact O-N 3.24Å
170	L	57.3	Low	59.7	Low	115 Å²	115	121.5 Å²	121.5	60%	0.602	61%	0.608	S	S	*	*	H	α-helix	trans	-63	-38.7	178.9	-72	166.5	0	0	0	112.3	E166 R172 V173 N174	E166-L170 WeakPolarHBondContact O-CB 3.1Å; E166-L170 VanDerWaalsContact O-CG 3.25Å; E166-L170 WeakPolarHBondContact O-CG 3.26Å; E166-L170 PolarHBondContact O-N 3.13Å; L170-R172 VanDerWaalsContact C-N 3.34Å; L170-R172 PolarHBondContact O-N 3.28Å; L170-V173 PolarHBondContact O-N 3.43Å; L170-N174 WeakPolarHBondContact O-CB 3.33Å; L170-N174 PolarHBondContact O-N 3.31Å
171	S	60.7	Low	58.2	Low	64 Å²	64	119.5 Å²	119.5	45%	0.448	61%	0.614	S	S	.	*	H	α-helix	trans	-70.9	-26.2	175.4	57.7	0	0	0	0	113.8	K167 Q168 V169	K167-S171 VanDerWaalsContact O-CB 3.32Å; K167-S171 WeakPolarHBondContact O-CB 3.25Å; K167-S171 PolarHBondContact O-N 2.72Å; K167-S171 PolarHBondContact O-OG 3.4Å; Q168-S171 WeakPolarHBondContact CA-OG 3.47Å; Q168-S171 PolarHBondContact O-OG 2.95Å; Q168-S171 VanDerWaalsContact O-OG 3.13Å; V169-S171 PolarHBondContact O-N 3.42Å
172	R	57	Low	56.8	Low	185 Å²	185	121.2 Å²	121.2	70%	0.698	62%	0.624	S	S	*	*	H	α-helix	trans	-79.6	-33.7	172	-73.7	-175.4	-178.5	-163.9	2.5	112.6	Q168 V169 L170	Q168-R172 WeakPolarHBondContact O-CB 3.31Å; Q168-R172 VanDerWaalsContact O-CG 3.31Å; Q168-R172 WeakPolarHBondContact O-CG 3.35Å; Q168-R172 PolarHBondContact O-N 2.97Å; V169-R172 PolarHBondContact O-N 2.79Å; V169-R172 VanDerWaalsContact O-N 3.14Å; L170-R172 VanDerWaalsContact C-N 3.34Å; L170-R172 PolarHBondContact O-N 3.28Å
173	V	55.6	Low	55.6	Low	91 Å²	91	127.8 Å²	127.8	55%	0.552	64%	0.644	S	S	*	*	H	α-helix	trans	-70.3	-34.2	175	173.7	0	0	0	0	111.2	V169 L170 I175 E176	V169-V173 HydrophobicContact CG1-CG2 4.24Å; V169-V173 VanDerWaalsContact O-CG2 3.25Å; V169-V173 WeakPolarHBondContact O-CG2 3.43Å; V169-V173 PolarHBondContact O-N 3.24Å; L170-V173 PolarHBondContact O-N 3.43Å; V173-I175 VanDerWaalsContact C-N 3.29Å; V173-I175 PolarHBondContact O-N 3.34Å; V173-E176 PolarHBondContact O-N 2.92Å
174	N	46.3	Very low	54.7	Low	131 Å²	131	130.4 Å²	130.4	70%	0.701	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-3.4	-178.1	-131.4	34.4	0	0	0	115.1	L170	L170-N174 WeakPolarHBondContact O-CB 3.33Å; L170-N174 PolarHBondContact O-N 3.31Å
175	I	48.8	Very low	53.6	Low	138 Å²	138	130.3 Å²	130.3	71%	0.708	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-13.3	173.5	-64.8	174.3	0	0	0	111.3	V173	V173-I175 VanDerWaalsContact C-N 3.29Å; V173-I175 PolarHBondContact O-N 3.34Å
176	E	46.4	Very low	53.1	Low	133 Å²	133	128.3 Å²	128.3	62%	0.621	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	6.2	-176.8	-83.6	-177.1	153.8	0	0	115.3	V173 S178	V173-E176 PolarHBondContact O-N 2.92Å; E176-S178 VanDerWaalsContact C-N 3.32Å; E176-S178 PolarHBondContact O-N 3.01Å
177	E	45.5	Very low	52.6	Low	180 Å²	180	126.5 Å²	126.5	84%	0.841	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	19.7	176.2	-129	-176.8	-168.7	0	0	114.6
178	S	40.8	Very low	52	Low	101 Å²	101	125.2 Å²	125.2	71%	0.706	64%	0.641	S	S	*	*	S	Bend	trans	-143.9	97	169.6	53.1	0	0	0	0	114.5	E176	E176-S178 VanDerWaalsContact C-N 3.32Å; E176-S178 PolarHBondContact O-N 3.01Å
179	R	40.1	Very low	52	Low	246 Å²	246	127.3 Å²	127.3	93%	0.928	65%	0.645	S	S	*	*			trans	93.8	147.5	159.8	-72.9	-177.4	170.6	169.4	-1.5	119.1
180	P	49.3	Very low	51.9	Low	131 Å²	131	127.2 Å²	127.2	85%	0.851	64%	0.641	S	S	*	*			trans	-100.8	141.9	-144.7	36.3	-29.6	0	0	0	113.2
181	G	42.5	Very low	52.6	Low	70 Å²	70	129.5 Å²	129.5	72%	0.722	64%	0.642	S	S	*	*			trans	152.3	126	157.3	0	0	0	0	0	116.8
182	H	42.1	Very low	53.3	Low	169 Å²	169	130.6 Å²	130.6	78%	0.782	65%	0.645	S	S	*	*			trans	90.3	98.2	145.5	-73.6	-59.2	0	0	0	122.1	N184	H182-N184 VanDerWaalsContact C-N 3.28Å; H182-N184 PolarHBondContact O-N 3.28Å
183	R	50.6	Low	54	Low	209 Å²	209	127.8 Å²	127.8	79%	0.789	64%	0.64	S	S	*	*	S	Bend		56.4	-21.7	129.4	-81.2	-175.7	173.5	177.4	-3.2	121.4	S186	R183-S186 PolarHBondContact O-OG 3.49Å
184	N	51.8	Low	55	Low	122 Å²	122	127.8 Å²	127.8	65%	0.652	64%	0.641	S	S	*	*	H	α-helix	trans	-87.1	-20	-174.8	-91	-1.7	0	0	0	114.5	H182 Q188	H182-N184 VanDerWaalsContact C-N 3.28Å; H182-N184 PolarHBondContact O-N 3.28Å; N184-Q188 WeakPolarHBondContact O-CB 3.31Å; N184-Q188 PolarHBondContact O-N 3.45Å; N184-Q188 VanDerWaalsContact O-N 3.12Å
185	E	50.1	Low	56.3	Low	92 Å²	92	125.4 Å²	125.4	43%	0.43	63%	0.631	S	S	.	*	H	α-helix	trans	-71.1	-36.6	177.4	-106.7	-157	123.4	0	0	112.7	D187 Q188 R189	E185-D187 VanDerWaalsContact C-N 3.33Å; E185-Q188 PolarHBondContact O-N 2.93Å; E185-R189 WeakPolarHBondContact O-CG 3.49Å; E185-R189 PolarHBondContact O-N 2.89Å; E185-R189 IonicContact OE1-CZ 2.76Å; E185-R189 IonicContact OE1-NH1 3.26Å; E185-R189 PolarHBondContact OE1-NH1 2.85Å; E185-R189 IonicContact OE1-NH2 2.82Å; E185-R189 PolarHBondContact OE1-NH2 3.45Å; E185-R189 IonicContact OE2-NH1 3.26Å; E185-R189 PolarHBondContact OE2-NH1 3.48Å; E185-R189 IonicContact OE2-NH2 3.96Å
186	S	57.1	Low	57.3	Low	61 Å²	61	123 Å²	123	43%	0.427	62%	0.619	S	S	.	*	H	α-helix	trans	-66.9	-38.6	177.3	61.7	0	0	0	0	111.1	R183 Q188 R189 N190	R183-S186 PolarHBondContact O-OG 3.49Å; S186-Q188 VanDerWaalsContact C-N 3.33Å; S186-R189 PolarHBondContact O-N 3.36Å; S186-N190 VanDerWaalsContact O-CB 3.28Å; S186-N190 WeakPolarHBondContact O-CB 3.42Å; S186-N190 PolarHBondContact O-N 2.87Å; S186-N190 PolarHBondContact O-ND2 2.97Å; S186-N190 VanDerWaalsContact O-ND2 3.17Å
187	D	58.7	Low	58.7	Low	77 Å²	77	119.7 Å²	119.7	41%	0.412	61%	0.611	S	S	.	*	H	α-helix	trans	-69.7	-34.2	177.8	-69.4	-13.5	0	0	0	111.5	E185 R191	E185-D187 VanDerWaalsContact C-N 3.33Å; D187-R191 WeakPolarHBondContact O-CB 3.47Å; D187-R191 VanDerWaalsContact O-CG 3.24Å; D187-R191 WeakPolarHBondContact O-CG 3.16Å; D187-R191 PolarHBondContact O-N 2.91Å
188	Q	59.3	Low	60.3	Low	120 Å²	120	114 Å²	114	56%	0.561	59%	0.591	S	S	*	*	H	α-helix	trans	-67.6	-44.3	173.2	-150.3	89	-9.4	0	0	111.5	N184 E185 S186 R191 V192	N184-Q188 WeakPolarHBondContact O-CB 3.31Å; N184-Q188 PolarHBondContact O-N 3.45Å; N184-Q188 VanDerWaalsContact O-N 3.12Å; E185-Q188 PolarHBondContact O-N 2.93Å; S186-Q188 VanDerWaalsContact C-N 3.33Å; Q188-R191 PolarHBondContact O-N 2.99Å; Q188-V192 WeakPolarHBondContact O-CG2 3.31Å; Q188-V192 PolarHBondContact O-N 2.66Å
189	R	64.9	Low	61.8	Low	148 Å²	148	113.3 Å²	113.3	56%	0.558	58%	0.579	S	S	*	*	H	α-helix	trans	-62.3	-45.7	174.6	-76.2	-175.9	179.4	103.4	11.1	111.6	E185 S186 R191 V192 E193	E185-R189 WeakPolarHBondContact O-CG 3.49Å; E185-R189 PolarHBondContact O-N 2.89Å; E185-R189 IonicContact OE1-CZ 2.76Å; E185-R189 IonicContact OE1-NH1 3.26Å; E185-R189 PolarHBondContact OE1-NH1 2.85Å; E185-R189 IonicContact OE1-NH2 2.82Å; E185-R189 PolarHBondContact OE1-NH2 3.45Å; E185-R189 IonicContact OE2-NH1 3.26Å; E185-R189 PolarHBondContact OE2-NH1 3.48Å; E185-R189 IonicContact OE2-NH2 3.96Å; S186-R189 PolarHBondContact O-N 3.36Å; R189-R191 VanDerWaalsContact C-N 3.28Å; R189-R191 PolarHBondContact O-N 2.93Å; R189-V192 PolarHBondContact O-N 2.75Å; R189-V192 VanDerWaalsContact O-N 3.15Å; R189-E193 WeakPolarHBondContact O-CB 3.25Å; R189-E193 PolarHBondContact O-N 2.67Å
190	N	64.9	Low	63.3	Low	89 Å²	89	107.3 Å²	107.3	48%	0.476	56%	0.561	S	S	.	*	H	α-helix	trans	-61.7	-36.1	176.8	-71	-20.5	0	0	0	112	S186 T194	S186-N190 VanDerWaalsContact O-CB 3.28Å; S186-N190 WeakPolarHBondContact O-CB 3.42Å; S186-N190 PolarHBondContact O-N 2.87Å; S186-N190 PolarHBondContact O-ND2 2.97Å; S186-N190 VanDerWaalsContact O-ND2 3.17Å; N190-T194 PolarHBondContact O-N 2.72Å; N190-T194 PolarHBondContact O-OG1 3.23Å
191	R	71.4	Confident	64.3	Low	162 Å²	162	106.1 Å²	106.1	61%	0.611	55%	0.547	S	S	*	.	H	α-helix	trans	-67.2	-42.9	173.6	-79.8	173.5	-179.1	158.4	2.3	112.4	D187 Q188 R189 E193 T194 T195	D187-R191 WeakPolarHBondContact O-CB 3.47Å; D187-R191 VanDerWaalsContact O-CG 3.24Å; D187-R191 WeakPolarHBondContact O-CG 3.16Å; D187-R191 PolarHBondContact O-N 2.91Å; Q188-R191 PolarHBondContact O-N 2.99Å; R189-R191 VanDerWaalsContact C-N 3.28Å; R189-R191 PolarHBondContact O-N 2.93Å; R191-E193 VanDerWaalsContact C-N 3.32Å; R191-T194 VanDerWaalsContact CA-OG1 3.3Å; R191-T194 WeakPolarHBondContact CA-OG1 3.46Å; R191-T194 PolarHBondContact O-OG1 3.45Å; R191-T194 VanDerWaalsContact O-OG1 3.08Å; R191-T195 WeakPolarHBondContact O-CB 3.44Å; R191-T195 PolarHBondContact O-N 3.44Å; R191-T195 PolarHBondContact O-OG1 3.1Å
192	V	77	Confident	65.8	Low	87 Å²	87	110.7 Å²	110.7	53%	0.527	54%	0.543	S	S	.	.	H	α-helix	trans	-63.3	-42.4	176.4	172.9	0	0	0	0	110.1	Q188 R189 T195 L196	Q188-V192 WeakPolarHBondContact O-CG2 3.31Å; Q188-V192 PolarHBondContact O-N 2.66Å; R189-V192 PolarHBondContact O-N 2.75Å; R189-V192 VanDerWaalsContact O-N 3.15Å; V192-T195 PolarHBondContact O-N 3.47Å; V192-L196 HydrophobicContact CG1-CD1 4.47Å; V192-L196 WeakPolarHBondContact O-CB 3.31Å; V192-L196 PolarHBondContact O-N 3.46Å
193	E	71.1	Confident	67.1	Low	126 Å²	126	106.8 Å²	106.8	59%	0.589	53%	0.527	S	S	*	.	H	α-helix	trans	-69.2	-38	-179.9	-166.8	165.8	-161.8	0	0	113.2	R189 R191 L196 S197	R189-E193 WeakPolarHBondContact O-CB 3.25Å; R189-E193 PolarHBondContact O-N 2.67Å; R191-E193 VanDerWaalsContact C-N 3.32Å; E193-L196 PolarHBondContact O-N 3.43Å; E193-S197 WeakPolarHBondContact O-CB 3.12Å; E193-S197 PolarHBondContact O-N 3.31Å; E193-S197 PolarHBondContact O-OG 3.23Å
194	T	75.9	Confident	68	Low	92 Å²	92	98.6 Å²	98.6	56%	0.564	50%	0.501	S	S	*	.	H	α-helix	trans	-67.1	-36.7	170.7	32.4	0	0	0	0	112.1	N190 R191 S197 S198	N190-T194 PolarHBondContact O-N 2.72Å; N190-T194 PolarHBondContact O-OG1 3.23Å; R191-T194 VanDerWaalsContact CA-OG1 3.3Å; R191-T194 WeakPolarHBondContact CA-OG1 3.46Å; R191-T194 PolarHBondContact O-OG1 3.45Å; R191-T194 VanDerWaalsContact O-OG1 3.08Å; T194-S197 PolarHBondContact O-N 2.96Å; T194-S198 VanDerWaalsContact O-CB 3.28Å; T194-S198 WeakPolarHBondContact O-CB 3.35Å; T194-S198 PolarHBondContact O-N 3.05Å
195	T	73.5	Confident	68.2	Low	81 Å²	81	97.4 Å²	97.4	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-39.9	174.6	-46.6	0	0	0	0	110.8	R191 V192 S198 L199	R191-T195 WeakPolarHBondContact O-CB 3.44Å; R191-T195 PolarHBondContact O-N 3.44Å; R191-T195 PolarHBondContact O-OG1 3.1Å; V192-T195 PolarHBondContact O-N 3.47Å; T195-S198 PolarHBondContact O-N 2.91Å; T195-L199 HydrophobicContact CG2-CD1 4.36Å; T195-L199 WeakPolarHBondContact O-CB 3.47Å; T195-L199 VanDerWaalsContact O-CG 3.25Å; T195-L199 WeakPolarHBondContact O-CG 3.31Å; T195-L199 PolarHBondContact O-N 2.95Å
196	L	71.2	Confident	68.6	Low	87 Å²	87	99.4 Å²	99.4	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-39.7	175.5	-117.2	160.6	0	0	0	112.2	V192 E193 L199 H200	V192-L196 HydrophobicContact CG1-CD1 4.47Å; V192-L196 WeakPolarHBondContact O-CB 3.31Å; V192-L196 PolarHBondContact O-N 3.46Å; E193-L196 PolarHBondContact O-N 3.43Å; L196-L199 PolarHBondContact O-N 3.44Å; L196-H200 WeakPolarHBondContact O-CB 3.38Å; L196-H200 PolarHBondContact O-N 2.78Å; L196-H200 PolarHBondContact O-ND1 2.83Å
197	S	74	Confident	68.7	Low	64 Å²	64	103.4 Å²	103.4	45%	0.448	52%	0.52	S	S	.	.	H	α-helix	trans	-68.5	-42.4	175.4	-58.8	0	0	0	0	111	E193 T194 L199 H200 D201	E193-S197 WeakPolarHBondContact O-CB 3.12Å; E193-S197 PolarHBondContact O-N 3.31Å; E193-S197 PolarHBondContact O-OG 3.23Å; T194-S197 PolarHBondContact O-N 2.96Å; S197-L199 VanDerWaalsContact C-N 3.3Å; S197-L199 PolarHBondContact O-N 2.88Å; S197-H200 PolarHBondContact O-N 3.43Å; S197-D201 PolarHBondContact O-N 2.89Å
198	S	79.9	Confident	68.4	Low	61 Å²	61	107 Å²	107	43%	0.427	53%	0.532	S	S	.	.	H	α-helix	trans	-64.2	-34.2	173.9	178.6	0	0	0	0	112.7	T194 T195 R202	T194-S198 VanDerWaalsContact O-CB 3.28Å; T194-S198 WeakPolarHBondContact O-CB 3.35Å; T194-S198 PolarHBondContact O-N 3.05Å; T195-S198 PolarHBondContact O-N 2.91Å; S198-R202 VanDerWaalsContact O-CB 3.31Å; S198-R202 WeakPolarHBondContact O-CB 3.48Å; S198-R202 PolarHBondContact O-N 3.38Å
199	L	71.9	Confident	67.6	Low	85 Å²	85	103.7 Å²	103.7	45%	0.445	53%	0.53	S	S	.	.	H	α-helix	trans	-71.6	-40.1	173.1	-76.1	170	0	0	0	111.8	T195 L196 S197 R202 I203	T195-L199 HydrophobicContact CG2-CD1 4.36Å; T195-L199 WeakPolarHBondContact O-CB 3.47Å; T195-L199 VanDerWaalsContact O-CG 3.25Å; T195-L199 WeakPolarHBondContact O-CG 3.31Å; T195-L199 PolarHBondContact O-N 2.95Å; L196-L199 PolarHBondContact O-N 3.44Å; S197-L199 VanDerWaalsContact C-N 3.3Å; S197-L199 PolarHBondContact O-N 2.88Å; L199-R202 PolarHBondContact O-N 3.21Å; L199-I203 WeakPolarHBondContact O-CB 3.16Å; L199-I203 WeakPolarHBondContact O-CG1 3.28Å; L199-I203 PolarHBondContact O-N 2.92Å
200	H	72.6	Confident	66.7	Low	120 Å²	120	103.6 Å²	103.6	56%	0.556	53%	0.534	S	S	*	.	H	α-helix	trans	-63	-42.8	173.1	-85.6	90.2	0	0	0	111.7	L196 S197 I203 S204	L196-H200 WeakPolarHBondContact O-CB 3.38Å; L196-H200 PolarHBondContact O-N 2.78Å; L196-H200 PolarHBondContact O-ND1 2.83Å; S197-H200 PolarHBondContact O-N 3.43Å; H200-I203 PolarHBondContact O-N 3.45Å; H200-S204 WeakPolarHBondContact O-CB 3.49Å; H200-S204 PolarHBondContact O-N 3Å
201	D	70.6	Confident	65.7	Low	106 Å²	106	107.1 Å²	107.1	57%	0.567	55%	0.547	S	S	*	.	H	α-helix	trans	-64.2	-42.6	173.8	-81.1	-11.8	0	0	0	111	S197 I203 S204 D205	S197-D201 PolarHBondContact O-N 2.89Å; D201-I203 VanDerWaalsContact C-N 3.34Å; D201-I203 PolarHBondContact O-N 3.34Å; D201-S204 CarbonylContact O-C 3.46Å; D201-S204 PolarHBondContact O-N 2.94Å; D201-D205 VanDerWaalsContact O-CB 3.25Å; D201-D205 WeakPolarHBondContact O-CB 3.02Å; D201-D205 PolarHBondContact O-N 3.15Å
202	R	72.1	Confident	64.6	Low	166 Å²	166	102.9 Å²	102.9	63%	0.626	54%	0.54	S	S	*	.	H	α-helix	trans	-63.1	-36.1	173.4	-92.9	173.6	158.9	179.5	-5.3	113.3	S198 L199 L206	S198-R202 VanDerWaalsContact O-CB 3.31Å; S198-R202 WeakPolarHBondContact O-CB 3.48Å; S198-R202 PolarHBondContact O-N 3.38Å; L199-R202 PolarHBondContact O-N 3.21Å; R202-L206 VanDerWaalsContact O-CB 3.26Å; R202-L206 WeakPolarHBondContact O-CB 3.4Å; R202-L206 WeakPolarHBondContact O-CD1 3.47Å; R202-L206 WeakPolarHBondContact O-CG 3.46Å; R202-L206 PolarHBondContact O-N 3.02Å
203	I	71.1	Confident	63.2	Low	88 Å²	88	106.4 Å²	106.4	45%	0.451	54%	0.543	S	S	.	.	H	α-helix	trans	-70	-43.8	174.9	-70.8	163.9	0	0	0	109.3	L199 H200 D201 D205 L206 E207	L199-I203 WeakPolarHBondContact O-CB 3.16Å; L199-I203 WeakPolarHBondContact O-CG1 3.28Å; L199-I203 PolarHBondContact O-N 2.92Å; H200-I203 PolarHBondContact O-N 3.45Å; D201-I203 VanDerWaalsContact C-N 3.34Å; D201-I203 PolarHBondContact O-N 3.34Å; I203-D205 VanDerWaalsContact C-N 3.26Å; I203-D205 PolarHBondContact O-N 3.31Å; I203-L206 CarbonylContact O-C 3.6Å; I203-L206 PolarHBondContact O-N 3.24Å; I203-L206 VanDerWaalsContact O-N 3.13Å; I203-E207 WeakPolarHBondContact O-CB 3.39Å; I203-E207 VanDerWaalsContact O-CG 3.31Å; I203-E207 WeakPolarHBondContact O-CG 3.44Å; I203-E207 PolarHBondContact O-N 2.99Å
204	S	68	Low	62.1	Low	36 Å²	36	106.1 Å²	106.1	25%	0.252	55%	0.552	S	S	.	*	H	α-helix	trans	-61.6	-35.8	174.3	-154	0	0	0	0	111.8	H200 D201 E207 K208	H200-S204 WeakPolarHBondContact O-CB 3.49Å; H200-S204 PolarHBondContact O-N 3Å; D201-S204 CarbonylContact O-C 3.46Å; D201-S204 PolarHBondContact O-N 2.94Å; S204-E207 PolarHBondContact O-N 2.9Å; S204-K208 VanDerWaalsContact O-CB 3.31Å; S204-K208 WeakPolarHBondContact O-CB 3.23Å; S204-K208 WeakPolarHBondContact O-CD 3.34Å; S204-K208 WeakPolarHBondContact O-CG 3.33Å; S204-K208 PolarHBondContact O-N 3.19Å
205	D	57.1	Low	61.1	Low	97 Å²	97	103.7 Å²	103.7	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-77.1	-28.2	175	-73	-15.4	0	0	0	112.4	D201 I203 G209	D201-D205 VanDerWaalsContact O-CB 3.25Å; D201-D205 WeakPolarHBondContact O-CB 3.02Å; D201-D205 PolarHBondContact O-N 3.15Å; I203-D205 VanDerWaalsContact C-N 3.26Å; I203-D205 PolarHBondContact O-N 3.31Å; D205-G209 WeakPolarHBondContact O-CA 3.24Å; D205-G209 PolarHBondContact O-N 3.18Å
206	L	57.2	Low	60.8	Low	134 Å²	134	101.1 Å²	101.1	70%	0.702	53%	0.525	S	S	*	.	H	α-helix	trans	-75.3	-30	170.2	-76.1	166.2	0	0	0	111.6	R202 I203 K210	R202-L206 VanDerWaalsContact O-CB 3.26Å; R202-L206 WeakPolarHBondContact O-CB 3.4Å; R202-L206 WeakPolarHBondContact O-CD1 3.47Å; R202-L206 WeakPolarHBondContact O-CG 3.46Å; R202-L206 PolarHBondContact O-N 3.02Å; I203-L206 CarbonylContact O-C 3.6Å; I203-L206 PolarHBondContact O-N 3.24Å; I203-L206 VanDerWaalsContact O-N 3.13Å; L206-K210 PolarHBondContact O-N 2.99Å
207	E	59.2	Low	61.3	Low	146 Å²	146	101.4 Å²	101.4	68%	0.682	52%	0.52	S	S	*	.	H	α-helix	trans	-73.2	-39.9	171.1	-74.1	176.9	162.1	0	0	111.6	I203 S204	I203-E207 WeakPolarHBondContact O-CB 3.39Å; I203-E207 VanDerWaalsContact O-CG 3.31Å; I203-E207 WeakPolarHBondContact O-CG 3.44Å; I203-E207 PolarHBondContact O-N 2.99Å; S204-E207 PolarHBondContact O-N 2.9Å
208	K	53.7	Low	62.2	Low	153 Å²	153	98.6 Å²	98.6	67%	0.665	50%	0.5	S	S	*	.	H	α-helix	trans	-77.5	-27.5	173.5	-70.3	167.1	-170.4	162.9	0	113.1	S204 K210	S204-K208 VanDerWaalsContact O-CB 3.31Å; S204-K208 WeakPolarHBondContact O-CB 3.23Å; S204-K208 WeakPolarHBondContact O-CD 3.34Å; S204-K208 WeakPolarHBondContact O-CG 3.33Å; S204-K208 PolarHBondContact O-N 3.19Å; K208-K210 VanDerWaalsContact C-N 3.31Å
209	G	41.5	Very low	62.9	Low	50 Å²	50	96.6 Å²	96.6	52%	0.515	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	13.8	-177.3	0	0	0	0	0	113.9	D205 E211	D205-G209 WeakPolarHBondContact O-CA 3.24Å; D205-G209 PolarHBondContact O-N 3.18Å; G209-E211 PolarHBondContact O-N 3Å
210	K	45.7	Very low	64	Low	146 Å²	146	92.5 Å²	92.5	64%	0.635	46%	0.462	S	S	*	.			trans	-72.2	56.3	153.9	-152.1	-177.5	-173.2	-174.1	0	108.6	L206 K208 T212	L206-K210 PolarHBondContact O-N 2.99Å; K208-K210 VanDerWaalsContact C-N 3.31Å; K210-T212 PolarHBondContact O-N 3.06Å
211	E	45.6	Very low	65.2	Low	163 Å²	163	88 Å²	88	76%	0.762	44%	0.443	S	S	*	.			trans	-48.4	126.8	155.7	-72	-162.3	162.6	0	0	105.8	G209 R213	G209-E211 PolarHBondContact O-N 3Å; E211-R213 PolarHBondContact O-N 2.92Å
212	T	46.9	Very low	66.5	Low	73 Å²	73	83 Å²	83	45%	0.448	42%	0.417	S	S	.	.			trans	-27.9	112	176.9	48.4	0	0	0	0	110.2	K210 R217	K210-T212 PolarHBondContact O-N 3.06Å; T212-R217 PolarHBondContact OG1-NE 2.89Å; T212-R217 PolarHBondContact OG1-NH2 2.9Å
213	R	47.3	Very low	67.6	Low	160 Å²	160	78.5 Å²	78.5	60%	0.604	41%	0.409	S	S	*	.			trans	-53.4	145.4	174.8	-71.9	177	176.6	178.4	-2.3	107.1	E211 A215 D216	E211-R213 PolarHBondContact O-N 2.92Å; R213-A215 HydrophobicContact CB-CB 4.46Å; R213-A215 PolarHBondContact O-N 3.16Å; R213-D216 PolarHBondContact O-N 2.71Å
214	P	48.7	Very low	68.7	Low	120 Å²	120	79.9 Å²	79.9	78%	0.779	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-52.2	-23.3	173.8	-25.8	32.8	0	0	0	113.3	D216	P214-D216 VanDerWaalsContact C-N 3.33Å; P214-D216 PolarHBondContact O-N 2.82Å
215	A	54.8	Low	70.1	Confident	41 Å²	41	82.3 Å²	82.3	34%	0.339	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-73.9	-11.3	175.5	0	0	0	0	0	115.1	R213 F218 E401	R213-A215 HydrophobicContact CB-CB 4.46Å; R213-A215 PolarHBondContact O-N 3.16Å; A215-F218 WeakPolarHBondContact O-CD1 3.34Å; A215-E401 VanDerWaalsContact O-CD 3.26Å; A215-E401 WeakPolarHBondContact O-CG 3.27Å
216	D	68.6	Low	72	Confident	27 Å²	27	78.3 Å²	78.3	14%	0.144	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-102.7	7.9	-179.4	-59	-35.5	0	0	0	112	R213 P214 T400	R213-D216 PolarHBondContact O-N 2.71Å; P214-D216 VanDerWaalsContact C-N 3.33Å; P214-D216 PolarHBondContact O-N 2.82Å; D216-T400 WeakPolarHBondContact OD1-CA 3.44Å; D216-T400 WeakPolarHBondContact OD1-CB 3.37Å; D216-T400 WeakPolarHBondContact OD1-CG2 3.48Å
217	R	81.7	Confident	73.9	Confident	93 Å²	93	76.2 Å²	76.2	35%	0.351	39%	0.389	S	S	.	.			trans	-107.5	70.4	178.3	-69.3	-176.6	-177.4	-178.4	6.2	110.4	T212 T414 F415 E416	T212-R217 PolarHBondContact OG1-NE 2.89Å; T212-R217 PolarHBondContact OG1-NH2 2.9Å; R217-T414 WeakPolarHBondContact O-CA 3.37Å; R217-F415 CarbonylContact C-O 3.57Å; R217-F415 VanDerWaalsContact C-O 3.26Å; R217-F415 WeakPolarHBondContact CA-O 3.38Å; R217-F415 WeakPolarHBondContact CB-O 3.29Å; R217-F415 PolarHBondContact O-N 3.41Å; R217-E416 IonicContact CZ-OE1 3.14Å; R217-E416 IonicContact NH1-OE1 3.61Å; R217-E416 PolarHBondContact NH1-OE1 3.06Å
218	F	91.1	Very high	75.7	Confident	5 Å²	5	75.6 Å²	75.6	2%	0.022	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.9	-179	73.3	-83.7	0	0	0	112.4	A215 L220 W399 E401 I404 K412 W413	A215-F218 WeakPolarHBondContact O-CD1 3.34Å; F218-L220 HydrophobicContact CD2-CD2 4.18Å; F218-L220 HydrophobicContact CD2-CG 4.47Å; F218-L220 HydrophobicContact CE2-CD2 3.99Å; F218-L220 HydrophobicContact CE2-CG 4.15Å; F218-W399 AromaticContact CD1-NE1 3.74Å; F218-W399 AromaticContact CD2-CZ2 3.9Å; F218-W399 HydrophobicContact CD2-CZ2 3.9Å; F218-W399 AromaticContact CD2-NE1 3.93Å; F218-W399 AromaticContact CE1-CD1 3.81Å; F218-W399 AromaticContact CE1-NE1 3.48Å; F218-W399 AromaticContact CE2-CE2 3.59Å; F218-W399 HydrophobicContact CE2-CH2 4.21Å; F218-W399 AromaticContact CE2-CZ2 3.36Å; F218-W399 HydrophobicContact CE2-CZ2 3.36Å; F218-W399 AromaticContact CE2-NE1 3.73Å; F218-W399 AromaticContact CG-NE1 3.95Å; F218-W399 HydrophobicContact CZ-CD2 4.17Å; F218-W399 AromaticContact CZ-CE2 3.53Å; F218-W399 AromaticContact CZ-CZ2 3.78Å; F218-W399 HydrophobicContact CZ-CZ2 3.78Å; F218-W399 AromaticContact CZ-NE1 3.5Å; F218-W399 PolarHBondContact O-NE1 2.77Å; F218-E401 HydrophobicContact CD1-CG 3.78Å; F218-E401 HydrophobicContact CE1-CB 4.41Å; F218-E401 HydrophobicContact CE1-CG 3.64Å; F218-E401 HydrophobicContact CG-CG 4.45Å; F218-E401 HydrophobicContact CZ-CG 4.17Å; F218-I404 HydrophobicContact CE2-CD1 4.34Å; F218-I404 HydrophobicContact CZ-CD1 3.92Å; F218-K412 HydrophobicContact CB-CD 4.12Å; F218-K412 HydrophobicContact CB-CG 3.92Å; F218-K412 HydrophobicContact CD2-CD 3.72Å; F218-K412 HydrophobicContact CD2-CG 3.7Å; F218-K412 HydrophobicContact CE2-CD 4.32Å; F218-K412 HydrophobicContact CG-CD 3.94Å; F218-K412 HydrophobicContact CG-CG 4.07Å; F218-W413 CarbonylContact C-O 3.43Å; F218-W413 WeakPolarHBondContact CA-O 3.24Å; F218-W413 VanDerWaalsContact CB-O 3.31Å; F218-W413 WeakPolarHBondContact CB-O 3.46Å
219	Q	94.7	Very high	77.8	Confident	19 Å²	19	68.9 Å²	68.9	9%	0.089	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	154.4	168	59.7	-178.3	81.3	0	0	110	T221 W302 E365 L366 A367 K412 W413 F415	Q219-T221 PolarHBondContact NE2-OG1 3.13Å; Q219-W302 HydrophobicContact CB-CH2 4.17Å; Q219-W302 HydrophobicContact CB-CZ2 4.46Å; Q219-E365 PolarHBondContact NE2-OE2 3.43Å; Q219-L366 CarbonylContact C-O 3.6Å; Q219-L366 WeakPolarHBondContact CA-O 3.41Å; Q219-A367 HydrophobicContact CB-CB 4Å; Q219-K412 WeakPolarHBondContact O-CA 3.19Å; Q219-W413 HydrophobicContact CG-CB 3.78Å; Q219-W413 PolarHBondContact N-O 2.89Å; Q219-W413 PolarHBondContact O-N 3.05Å; Q219-F415 HydrophobicContact CB-CB 3.71Å; Q219-F415 HydrophobicContact CB-CG 4.14Å; Q219-F415 HydrophobicContact CG-CB 3.92Å
220	L	96.7	Very high	80.5	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.7	166.2	-62.5	-178.6	0	0	0	109.2	F218 F222 A231 L345 E365 L366 W399 I404 I406 T411 K412	F218-L220 HydrophobicContact CD2-CD2 4.18Å; F218-L220 HydrophobicContact CD2-CG 4.47Å; F218-L220 HydrophobicContact CE2-CD2 3.99Å; F218-L220 HydrophobicContact CE2-CG 4.15Å; L220-F222 HydrophobicContact CB-CE2 3.74Å; L220-F222 HydrophobicContact CB-CZ 4.17Å; L220-F222 HydrophobicContact CD1-CZ 4.3Å; L220-A231 HydrophobicContact CD1-CB 3.62Å; L220-L345 HydrophobicContact CD1-CD1 4.14Å; L220-E365 CarbonylContact O-C 3.57Å; L220-E365 WeakPolarHBondContact O-CA 3.21Å; L220-L366 PolarHBondContact N-O 3.1Å; L220-L366 PolarHBondContact O-N 3.01Å; L220-W399 HydrophobicContact CD1-CH2 3.79Å; L220-W399 HydrophobicContact CD1-CZ2 4.4Å; L220-W399 HydrophobicContact CG-CH2 3.94Å; L220-W399 HydrophobicContact CG-CZ2 4.08Å; L220-I404 HydrophobicContact CD1-CG2 4.36Å; L220-I406 HydrophobicContact CD2-CD1 3.52Å; L220-I406 HydrophobicContact CD2-CG1 4.09Å; L220-T411 WeakPolarHBondContact CA-O 3.43Å; L220-K412 HydrophobicContact CD2-CB 4.3Å; L220-K412 HydrophobicContact CD2-CG 4.45Å
221	T	97.1	Very high	83	Confident	25 Å²	25	61.6 Å²	61.6	15%	0.153	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.7	177.6	-59.3	0	0	0	0	110	Q219 P223 E365 T411	Q219-T221 PolarHBondContact NE2-OG1 3.13Å; T221-P223 WeakPolarHBondContact O-CD 3.24Å; T221-E365 HydrophobicContact CG2-CG 4.33Å; T221-T411 WeakPolarHBondContact CB-OG1 3.34Å; T221-T411 PolarHBondContact N-O 2.84Å; T221-T411 PolarHBondContact O-N 3.36Å
222	F	97.4	Very high	85.5	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	92.7	176	-59.1	-89.3	0	0	0	107.9	L220 M229 L345 Y362 V363 G364 A410	L220-F222 HydrophobicContact CB-CE2 3.74Å; L220-F222 HydrophobicContact CB-CZ 4.17Å; L220-F222 HydrophobicContact CD1-CZ 4.3Å; F222-M229 HydrophobicContact CD1-CB 4.47Å; F222-L345 HydrophobicContact CZ-CB 4.46Å; F222-Y362 HydrophobicContact CB-CD1 4.14Å; F222-Y362 WeakPolarHBondContact CB-O 3.38Å; F222-Y362 AromaticContact CD2-CD1 3.56Å; F222-Y362 HydrophobicContact CD2-CD1 3.56Å; F222-Y362 AromaticContact CD2-CE1 4Å; F222-Y362 HydrophobicContact CD2-CE1 4Å; F222-Y362 HydrophobicContact CE2-CD1 4.23Å; F222-Y362 HydrophobicContact CG-CD1 4.04Å; F222-V363 WeakPolarHBondContact O-CA 3.45Å; F222-G364 PolarHBondContact N-O 2.81Å; F222-G364 PolarHBondContact O-N 2.99Å; F222-A410 HydrophobicContact CD1-CB 3.96Å; F222-A410 HydrophobicContact CE1-CB 3.78Å; F222-A410 HydrophobicContact CZ-CB 4.46Å
223	P	95.3	Very high	87.9	Confident	71 Å²	71	54.2 Å²	54.2	46%	0.461	27%	0.266	S	S	.	.			trans	-78.1	-22.7	-167.2	29.8	-36.1	0	0	0	113.7	T221 M229	T221-P223 WeakPolarHBondContact O-CD 3.24Å; P223-M229 HydrophobicContact CG-CE 4.3Å; P223-M229 HydrophobicContact CG-SD 4.39Å
224	L	95.3	Very high	90.2	Very high	116 Å²	116	51.7 Å²	51.7	61%	0.607	26%	0.259	S	S	*	.	S	Bend	trans	-145.3	150	-170.2	-64.1	168.2	0	0	0	110.4	T226 M229	L224-T226 PolarHBondContact O-N 2.85Å; L224-M229 HydrophobicContact CB-CE 3.98Å; L224-M229 WeakPolarHBondContact O-CE 3.46Å
225	R	96	Very high	92.3	Very high	88 Å²	88	54.1 Å²	54.1	33%	0.332	25%	0.253	S	S	.	.			trans	-68.5	117.1	169.9	-71.5	-165.2	-159.4	-81.9	0.8	110.2	G256 A358 A361 V363	R225-G256 PolarHBondContact NH2-O 2.92Å; R225-A358 WeakPolarHBondContact CB-O 3.16Å; R225-A358 WeakPolarHBondContact CD-O 3.43Å; R225-A361 PolarHBondContact NH1-O 3.21Å; R225-V363 HydrophobicContact CB-CG2 4.37Å; R225-V363 HydrophobicContact CG-CG2 3.39Å
226	T	97.2	Very high	94.2	Very high	13 Å²	13	54.8 Å²	54.8	8%	0.08	25%	0.253	C	S	.	.			trans	-142.9	162.1	174.2	64	0	0	0	0	108.6	L224 Y228 M229 Q347 A361	L224-T226 PolarHBondContact O-N 2.85Å; T226-Y228 VanDerWaalsContact C-N 3.34Å; T226-Y228 HydrophobicContact CG2-CE1 3.81Å; T226-Y228 HydrophobicContact CG2-CE2 4.2Å; T226-M229 HydrophobicContact CG2-CE 3.42Å; T226-M229 VanDerWaalsContact CG2-CE 3.42Å; T226-M229 VanDerWaalsContact OG1-CB 3.27Å; T226-M229 WeakPolarHBondContact OG1-CB 3.34Å; T226-M229 WeakPolarHBondContact OG1-CE 3.12Å; T226-M229 WeakPolarHBondContact OG1-CG 3.11Å; T226-M229 PolarHBondContact OG1-N 2.96Å; T226-M229 VanDerWaalsContact OG1-N 3.09Å; T226-Q347 PolarHBondContact O-NE2 3.26Å; T226-Q347 PolarHBondContact O-OE1 2.9Å; T226-A361 WeakPolarHBondContact O-CB 3.32Å
227	N	97.6	Very high	95.5	Very high	90 Å²	90	53.5 Å²	53.5	48%	0.481	25%	0.246	S	C	.	.	S	Bend	trans	-97.5	20.5	172.7	63.7	-15.6	0	0	0	112.6	F356 A358	N227-F356 HydrophobicContact CB-CB 4.12Å; N227-F356 VanDerWaalsContact CB-O 3.28Å; N227-F356 WeakPolarHBondContact CB-O 3.43Å; N227-F356 WeakPolarHBondContact O-CD2 3.07Å; N227-A358 HydrophobicContact CB-CB 4.23Å
228	Y	97.2	Very high	96.3	Very high	132 Å²	132	51.9 Å²	51.9	52%	0.518	25%	0.247	S	C	.	.	S	Bend	trans	-141.2	-15.4	-175	62.7	-104	0	0	0	114.7	T226 Y230 G408	T226-Y228 VanDerWaalsContact C-N 3.34Å; T226-Y228 HydrophobicContact CG2-CE1 3.81Å; T226-Y228 HydrophobicContact CG2-CE2 4.2Å; Y228-Y230 WeakPolarHBondContact O-CD1 3.38Å; Y228-G408 WeakPolarHBondContact CE2-O 3.39Å; Y228-G408 WeakPolarHBondContact O-CA 3.5Å
229	M	97.9	Very high	96.6	Very high	12 Å²	12	56.3 Å²	56.3	6%	0.059	27%	0.268	C	S	.	.			trans	-82.9	112.6	171.4	-74.1	-167.6	-76.5	0	0	110.5	F222 P223 L224 T226 Q347 G408	F222-M229 HydrophobicContact CD1-CB 4.47Å; P223-M229 HydrophobicContact CG-CE 4.3Å; P223-M229 HydrophobicContact CG-SD 4.39Å; L224-M229 HydrophobicContact CB-CE 3.98Å; L224-M229 WeakPolarHBondContact O-CE 3.46Å; T226-M229 HydrophobicContact CG2-CE 3.42Å; T226-M229 VanDerWaalsContact CG2-CE 3.42Å; T226-M229 VanDerWaalsContact OG1-CB 3.27Å; T226-M229 WeakPolarHBondContact OG1-CB 3.34Å; T226-M229 WeakPolarHBondContact OG1-CE 3.12Å; T226-M229 WeakPolarHBondContact OG1-CG 3.11Å; T226-M229 PolarHBondContact OG1-N 2.96Å; T226-M229 VanDerWaalsContact OG1-N 3.09Å; M229-Q347 PolarHBondContact O-NE2 3.35Å; M229-G408 WeakPolarHBondContact CG-O 3.25Å
230	Y	98.3	Very high	96.8	Very high	44 Å²	44	55.5 Å²	55.5	17%	0.173	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	164.1	177.9	70.2	-80	0	0	0	110.6	Y228 K232 V344 L345 F356 F407	Y228-Y230 WeakPolarHBondContact O-CD1 3.38Å; Y230-K232 HydrophobicContact CD2-CB 4.35Å; Y230-K232 HydrophobicContact CE2-CB 4.07Å; Y230-V344 HydrophobicContact CD2-CG1 3.85Å; Y230-V344 HydrophobicContact CG-CG1 4.21Å; Y230-L345 WeakPolarHBondContact CA-O 3.23Å; Y230-L345 WeakPolarHBondContact CB-O 3.47Å; Y230-F356 HydrophobicContact CD1-CD2 4.31Å; Y230-F356 AromaticContact CD1-CE2 3.53Å; Y230-F356 HydrophobicContact CD1-CE2 3.53Å; Y230-F356 HydrophobicContact CD1-CZ 4.25Å; Y230-F356 HydrophobicContact CD2-CE2 4.29Å; Y230-F356 HydrophobicContact CD2-CZ 4.2Å; Y230-F356 AromaticContact CE1-CE2 3.7Å; Y230-F356 HydrophobicContact CE1-CE2 3.7Å; Y230-F356 HydrophobicContact CE1-CZ 4.43Å; Y230-F356 HydrophobicContact CE2-CE2 4.4Å; Y230-F356 HydrophobicContact CE2-CZ 4.37Å; Y230-F356 AromaticContact CG-CE2 3.85Å; Y230-F356 HydrophobicContact CG-CE2 3.85Å; Y230-F356 HydrophobicContact CG-CZ 4.14Å; Y230-F407 HydrophobicContact CD1-CB 3.77Å; Y230-F407 HydrophobicContact CD2-CD2 4.04Å; Y230-F407 HydrophobicContact CE1-CB 3.43Å; Y230-F407 VanDerWaalsContact CE1-CB 3.43Å; Y230-F407 HydrophobicContact CE1-CD2 4.22Å; Y230-F407 AromaticContact CE1-CG 3.89Å; Y230-F407 HydrophobicContact CE1-CG 3.89Å; Y230-F407 HydrophobicContact CE2-CB 4.24Å; Y230-F407 AromaticContact CE2-CD2 3.48Å; Y230-F407 HydrophobicContact CE2-CD2 3.48Å; Y230-F407 VanDerWaalsContact CE2-CD2 3.48Å; Y230-F407 HydrophobicContact CE2-CE2 4.07Å; Y230-F407 HydrophobicContact CE2-CG 4.01Å; Y230-F407 HydrophobicContact CG-CB 4.29Å; Y230-F407 AromaticContact CZ-CD2 3.58Å; Y230-F407 AromaticContact CZ-CG 3.6Å; Y230-F407 PolarHBondContact N-O 2.86Å; Y230-F407 PolarHBondContact O-N 2.88Å
231	A	98.1	Very high	96.8	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.2	164	0	0	0	0	0	110.1	L220 V344 L345 I404 E405 I406	L220-A231 HydrophobicContact CD1-CB 3.62Å; A231-V344 CarbonylContact O-C 3.53Å; A231-V344 WeakPolarHBondContact O-CA 3.33Å; A231-L345 HydrophobicContact CB-CB 4.15Å; A231-L345 HydrophobicContact CB-CD1 4.27Å; A231-L345 HydrophobicContact CB-CG 4.43Å; A231-L345 PolarHBondContact N-O 3.09Å; A231-L345 PolarHBondContact O-N 2.81Å; A231-I404 HydrophobicContact CB-CG2 3.66Å; A231-E405 CarbonylContact C-O 3.19Å; A231-E405 WeakPolarHBondContact CA-O 3.36Å; A231-I406 HydrophobicContact CB-CG1 4.48Å
232	K	97.8	Very high	96.9	Very high	74 Å²	74	61.9 Å²	61.9	32%	0.322	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134	-176.9	-176.3	177.6	172.7	177.4	0	109.7	Y230 V342 I404 E405 F407	Y230-K232 HydrophobicContact CD2-CB 4.35Å; Y230-K232 HydrophobicContact CE2-CB 4.07Å; K232-V342 HydrophobicContact CD-CG1 4.28Å; K232-V342 HydrophobicContact CG-CG1 4.25Å; K232-I404 WeakPolarHBondContact O-CA 3.27Å; K232-E405 PolarHBondContact N-O 2.78Å; K232-E405 PolarHBondContact O-N 2.83Å; K232-F407 HydrophobicContact CB-CD2 4.39Å; K232-F407 HydrophobicContact CB-CE2 3.91Å
233	A	97.3	Very high	96.9	Very high	7 Å²	7	61.8 Å²	61.8	6%	0.058	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131.3	169.4	0	0	0	0	0	110.1	R235 L343 F397 N403	A233-R235 VanDerWaalsContact C-N 3.3Å; A233-L343 HydrophobicContact CB-CB 3.85Å; A233-L343 HydrophobicContact CB-CD2 3.93Å; A233-L343 HydrophobicContact CB-CG 4.07Å; A233-L343 PolarHBondContact N-O 2.81Å; A233-F397 HydrophobicContact CB-CD2 4.09Å; A233-F397 HydrophobicContact CB-CE2 3.58Å; A233-F397 HydrophobicContact CB-CZ 4.48Å; A233-N403 CarbonylContact C-O 3.58Å; A233-N403 WeakPolarHBondContact CA-O 3.43Å
234	K	95.6	Very high	97.1	Very high	107 Å²	107	58.4 Å²	58.4	47%	0.465	27%	0.269	S	S	.	.	S	Bend	trans	-70.4	-29.3	176.2	-65.3	-165.7	-167	155.3	0	113	S402 N403 E405	K234-S402 VanDerWaalsContact CD-O 3.23Å; K234-S402 WeakPolarHBondContact CD-O 3.49Å; K234-S402 WeakPolarHBondContact CE-O 3.47Å; K234-S402 PolarHBondContact NZ-O 2.9Å; K234-N403 PolarHBondContact N-O 2.66Å; K234-E405 HydrophobicContact CD-CG 3.98Å; K234-E405 WeakPolarHBondContact CD-OE1 3.46Å; K234-E405 VanDerWaalsContact CE-OE1 3.24Å; K234-E405 WeakPolarHBondContact CE-OE1 3.47Å; K234-E405 HydrophobicContact CG-CG 3.68Å; K234-E405 WeakPolarHBondContact CG-OE1 3.46Å
235	R	92.1	Very high	97.2	Very high	170 Å²	170	53 Å²	53	64%	0.642	24%	0.24	S	C	*	.	S	Bend	trans	-101.9	139.3	178.1	-62.6	-172.7	68.8	-171.7	-1.2	109.3	A233	A233-R235 VanDerWaalsContact C-N 3.3Å
236	T	94.5	Very high	97.3	Very high	55 Å²	55	48.9 Å²	48.9	34%	0.337	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-79.6	167	171.6	-167.7	0	0	0	0	111.6	D340 G341	T236-D340 WeakPolarHBondContact CG2-OD1 3.27Å; T236-D340 WeakPolarHBondContact OG1-CA 3.44Å; T236-D340 PolarHBondContact OG1-N 3.19Å; T236-G341 WeakPolarHBondContact CB-O 3.48Å; T236-G341 PolarHBondContact OG1-N 3.32Å; T236-G341 PolarHBondContact OG1-O 2.96Å
237	L	97.2	Very high	97.3	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-88.6	143.4	176.1	-52.7	-177.8	0	0	0	109.8	M240 Y263 A339 D340 L343 I371 V396	L237-M240 HydrophobicContact CB-CE 4.46Å; L237-M240 HydrophobicContact CD1-CE 4.27Å; L237-Y263 HydrophobicContact CB-CE2 3.91Å; L237-Y263 HydrophobicContact CD1-CD1 4.06Å; L237-Y263 HydrophobicContact CD1-CD2 3.64Å; L237-Y263 HydrophobicContact CD1-CE1 4.15Å; L237-Y263 HydrophobicContact CD1-CE2 3.75Å; L237-Y263 HydrophobicContact CD1-CG 3.8Å; L237-Y263 HydrophobicContact CG-CD2 3.96Å; L237-Y263 HydrophobicContact CG-CE2 3.66Å; L237-A339 VanDerWaalsContact O-CA 3.31Å; L237-A339 WeakPolarHBondContact O-CA 3.45Å; L237-D340 PolarHBondContact O-N 2.78Å; L237-D340 VanDerWaalsContact O-N 3.1Å; L237-L343 HydrophobicContact CD2-CD2 4.36Å; L237-I371 HydrophobicContact CD1-CD1 4.35Å; L237-I371 HydrophobicContact CD2-CD1 4.01Å; L237-V396 HydrophobicContact CD2-CG1 3.61Å
238	P	97.7	Very high	97.2	Very high	59 Å²	59	44.6 Å²	44.6	38%	0.383	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-75.7	173.9	170.5	35.3	-35.3	0	0	0	110.5	M240 V396	P238-M240 HydrophobicContact CG-CG 4.2Å; P238-M240 PolarHBondContact O-N 2.97Å; P238-V396 HydrophobicContact CG-CG1 4.21Å; P238-V396 HydrophobicContact CG-CG2 4.24Å
239	E	97.9	Very high	97.2	Very high	98 Å²	98	38.4 Å²	38.4	46%	0.458	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-64.7	131.7	168.1	-172.5	-178.1	-122.9	0	0	109.9	Y241 P336 I337 A339	E239-Y241 HydrophobicContact CG-CE2 4.2Å; E239-Y241 WeakPolarHBondContact OE2-CE2 3.47Å; E239-Y241 PolarHBondContact OE2-OH 3.46Å; E239-P336 HydrophobicContact CG-CB 4.01Å; E239-I337 VanDerWaalsContact CA-O 3.24Å; E239-I337 WeakPolarHBondContact CA-O 3.12Å; E239-A339 HydrophobicContact CB-CB 4.29Å
240	M	98	Very high	97	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-131.5	130.5	-177.8	-59.8	-178.9	-66.7	0	0	112.5	L237 P238 F243 I337 I371 N373 V396	L237-M240 HydrophobicContact CB-CE 4.46Å; L237-M240 HydrophobicContact CD1-CE 4.27Å; P238-M240 HydrophobicContact CG-CG 4.2Å; P238-M240 PolarHBondContact O-N 2.97Å; M240-F243 HydrophobicContact CE-CB 4.18Å; M240-F243 HydrophobicContact CE-CG 4.37Å; M240-F243 HydrophobicContact SD-CB 3.87Å; M240-I337 HydrophobicContact CB-CB 4.2Å; M240-I337 HydrophobicContact CE-CB 4.2Å; M240-I337 HydrophobicContact CE-CG1 4.49Å; M240-I337 HydrophobicContact CE-CG2 3.93Å; M240-I337 PolarHBondContact N-O 2.72Å; M240-I337 PolarHBondContact O-N 3.35Å; M240-I371 HydrophobicContact CE-CG2 4.49Å; M240-I371 HydrophobicContact SD-CG2 4.35Å; M240-N373 HydrophobicContact CG-CB 4.08Å; M240-N373 HydrophobicContact SD-CB 4.16Å; M240-V396 HydrophobicContact SD-CG1 4.16Å; M240-V396 HydrophobicContact SD-CG2 3.97Å
241	Y	98.1	Very high	96.8	Very high	127 Å²	127	38.8 Å²	38.8	50%	0.498	18%	0.18	S	C	.	.	S	Bend	trans	-95.8	-15.2	175.5	-62.7	-91.8	0	0	0	112.4	E239 I311 P336	E239-Y241 HydrophobicContact CG-CE2 4.2Å; E239-Y241 WeakPolarHBondContact OE2-CE2 3.47Å; E239-Y241 PolarHBondContact OE2-OH 3.46Å; Y241-I311 HydrophobicContact CD1-CD1 3.76Å; Y241-I311 HydrophobicContact CD1-CG2 4.34Å; Y241-I311 HydrophobicContact CE1-CD1 4.37Å; Y241-I311 WeakPolarHBondContact O-CB 3.27Å; Y241-I311 WeakPolarHBondContact O-CG2 3.41Å; Y241-I311 PolarHBondContact O-N 3.26Å; Y241-P336 HydrophobicContact CD1-CB 4.28Å; Y241-P336 HydrophobicContact CE1-CB 4.08Å
242	S	98.1	Very high	96.4	Very high	32 Å²	32	43.7 Å²	43.7	22%	0.224	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	150	170.2	63.2	0	0	0	0	107.2	W309 N373 R374	S242-W309 CarbonylContact C-O 3.55Å; S242-W309 VanDerWaalsContact CA-O 3.27Å; S242-W309 WeakPolarHBondContact CA-O 3.39Å; S242-W309 WeakPolarHBondContact CB-O 3.13Å; S242-N373 CarbonylContact O-C 3.51Å; S242-N373 WeakPolarHBondContact O-CA 3.28Å; S242-N373 VanDerWaalsContact O-O 3.04Å; S242-R374 PolarHBondContact O-N 3.49Å
243	F	98.5	Very high	95.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	166.7	175.7	70	-88.8	0	0	0	111.6	M240 V245 L272 F284 I286 T308 W309 I337 W372 R374	M240-F243 HydrophobicContact CE-CB 4.18Å; M240-F243 HydrophobicContact CE-CG 4.37Å; M240-F243 HydrophobicContact SD-CB 3.87Å; F243-V245 HydrophobicContact CD2-CB 4.49Å; F243-V245 HydrophobicContact CD2-CG1 4.49Å; F243-V245 HydrophobicContact CE2-CB 4.44Å; F243-V245 HydrophobicContact CE2-CG1 4.02Å; F243-L272 HydrophobicContact CE1-CD1 4.35Å; F243-L272 HydrophobicContact CE2-CD1 3.99Å; F243-L272 HydrophobicContact CE2-CD2 4.21Å; F243-L272 HydrophobicContact CZ-CD1 3.47Å; F243-L272 VanDerWaalsContact CZ-CD1 3.47Å; F243-L272 HydrophobicContact CZ-CD2 4.27Å; F243-F284 AromaticContact CE2-CZ 3.8Å; F243-F284 HydrophobicContact CE2-CZ 3.8Å; F243-F284 HydrophobicContact CZ-CE1 4.05Å; F243-F284 AromaticContact CZ-CZ 3.62Å; F243-F284 HydrophobicContact CZ-CZ 3.62Å; F243-I286 HydrophobicContact CE1-CD1 3.93Å; F243-I286 HydrophobicContact CZ-CD1 3.92Å; F243-T308 WeakPolarHBondContact O-CA 3.06Å; F243-W309 HydrophobicContact CD1-CB 4.42Å; F243-W309 HydrophobicContact CD1-CD2 4.42Å; F243-W309 AromaticContact CD1-CE3 3.56Å; F243-W309 HydrophobicContact CD1-CE3 3.56Å; F243-W309 HydrophobicContact CD1-CZ3 4.22Å; F243-W309 HydrophobicContact CE1-CB 3.88Å; F243-W309 AromaticContact CE1-CD2 3.88Å; F243-W309 HydrophobicContact CE1-CD2 3.88Å; F243-W309 AromaticContact CE1-CE3 3.41Å; F243-W309 HydrophobicContact CE1-CE3 3.41Å; F243-W309 VanDerWaalsContact CE1-CE3 3.41Å; F243-W309 HydrophobicContact CE1-CG 4.12Å; F243-W309 HydrophobicContact CE1-CZ3 4.19Å; F243-W309 HydrophobicContact CZ-CB 3.99Å; F243-W309 PolarHBondContact N-O 2.92Å; F243-W309 PolarHBondContact O-N 3.17Å; F243-I337 HydrophobicContact CD1-CG1 3.89Å; F243-I337 HydrophobicContact CE1-CD1 3.98Å; F243-I337 HydrophobicContact CE1-CG1 3.76Å; F243-W372 CarbonylContact C-O 3.54Å; F243-W372 WeakPolarHBondContact CA-O 3.09Å; F243-W372 WeakPolarHBondContact CB-O 3.48Å; F243-R374 CarbonylContact C-O 3.59Å
244	S	98.6	Very high	95.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.3	165.8	-51.9	0	0	0	0	108.2	I307 T308 I371 W372 R374 K375 L376	S244-I307 CarbonylContact C-O 3.39Å; S244-I307 VanDerWaalsContact CA-O 3.31Å; S244-I307 WeakPolarHBondContact CA-O 3.35Å; S244-T308 WeakPolarHBondContact OG-CG2 3.27Å; S244-I371 WeakPolarHBondContact O-CA 3.01Å; S244-W372 PolarHBondContact N-O 3.41Å; S244-W372 PolarHBondContact O-N 2.97Å; S244-R374 PolarHBondContact N-O 3.49Å; S244-R374 PolarHBondContact OG-O 3.09Å; S244-K375 WeakPolarHBondContact OG-CA 3.39Å; S244-L376 WeakPolarHBondContact OG-CG 3.36Å; S244-L376 PolarHBondContact OG-N 2.91Å
245	V	98.4	Very high	94.7	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.3	173.4	57.3	0	0	0	0	108	F243 F261 F284 C306 I307 L369 N370 I371	F243-V245 HydrophobicContact CD2-CB 4.49Å; F243-V245 HydrophobicContact CD2-CG1 4.49Å; F243-V245 HydrophobicContact CE2-CB 4.44Å; F243-V245 HydrophobicContact CE2-CG1 4.02Å; V245-F261 HydrophobicContact CG1-CZ 4.09Å; V245-F261 HydrophobicContact CG2-CE1 3.99Å; V245-F261 HydrophobicContact CG2-CZ 3.86Å; V245-F284 HydrophobicContact CG1-CE2 4.43Å; V245-F284 HydrophobicContact CG1-CZ 4.37Å; V245-C306 CarbonylContact O-C 3.57Å; V245-C306 VanDerWaalsContact O-CA 3.27Å; V245-C306 WeakPolarHBondContact O-CA 3.33Å; V245-I307 HydrophobicContact CG1-CB 4.03Å; V245-I307 PolarHBondContact N-O 3.25Å; V245-I307 PolarHBondContact O-N 3.09Å; V245-L369 HydrophobicContact CG2-CD1 3.57Å; V245-N370 WeakPolarHBondContact CA-O 3.3Å; V245-I371 HydrophobicContact CB-CG1 4.38Å; V245-I371 HydrophobicContact CG2-CG1 4.06Å
246	C	97.8	Very high	94.5	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.014	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.1	177.8	-62.4	0	0	0	0	110.2	L305 C306 L369 N370 W372	C246-L305 CarbonylContact C-O 3.45Å; C246-L305 WeakPolarHBondContact CA-O 3.46Å; C246-C306 HydrophobicContact CB-CB 4.16Å; C246-C306 WeakPolarHBondContact CB-SG 3.5Å; C246-C306 WeakPolarHBondContact SG-CB 3.28Å; C246-C306 CovalentContact SG-SG 2.03Å; C246-C306 PolarHBondContact SG-SG 3.48Å; C246-L369 CarbonylContact O-C 3.4Å; C246-L369 VanDerWaalsContact O-CA 3.28Å; C246-L369 WeakPolarHBondContact O-CA 3.41Å; C246-N370 PolarHBondContact N-O 3.21Å; C246-N370 PolarHBondContact O-N 3.41Å; C246-W372 HydrophobicContact CB-CH2 4.25Å; C246-W372 HydrophobicContact CB-CZ3 3.85Å
247	L	96.6	Very high	94.5	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	157	176.3	64.8	161.2	0	0	0	111.4	I249 P260 F261 L274 L305 L366 L369	L247-I249 HydrophobicContact CD1-CG2 3.28Å; L247-I249 HydrophobicContact CG-CG2 3.89Å; L247-P260 HydrophobicContact CD1-CB 4.09Å; L247-F261 HydrophobicContact CD2-CE1 4.35Å; L247-L274 HydrophobicContact CD2-CD2 4.3Å; L247-L305 HydrophobicContact CD2-CB 4.32Å; L247-L305 PolarHBondContact N-O 2.96Å; L247-L305 PolarHBondContact O-N 3.34Å; L247-L366 HydrophobicContact CD1-CD1 3.73Å; L247-L366 HydrophobicContact CD1-CG 4.14Å; L247-L369 HydrophobicContact CB-CB 4.25Å; L247-L369 HydrophobicContact CB-CD1 3.84Å; L247-L369 HydrophobicContact CD1-CD1 4.5Å; L247-L369 HydrophobicContact CD2-CD1 4.25Å; L247-L369 HydrophobicContact CG-CD1 4.43Å
248	W	95.8	Very high	94.4	Very high	12 Å²	12	33.2 Å²	33.2	5%	0.045	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.6	164.7	-74.9	80.1	0	0	0	109	W302 H303 H304 L366 A367 A385 F415 P417 I421	W248-W302 HydrophobicContact CB-CE3 3.86Å; W248-W302 HydrophobicContact CB-CZ3 3.82Å; W248-W302 HydrophobicContact CE3-CB 4.09Å; W248-W302 HydrophobicContact CE3-CE3 4.39Å; W248-W302 HydrophobicContact CZ3-CB 4.25Å; W248-H303 WeakPolarHBondContact CA-O 3.29Å; W248-H304 AromaticContact CD1-CD2 3.71Å; W248-H304 HydrophobicContact CD2-CB 3.98Å; W248-H304 AromaticContact CE2-CD2 3.79Å; W248-H304 HydrophobicContact CE3-CB 4.11Å; W248-H304 HydrophobicContact CH2-CB 3.88Å; W248-H304 HydrophobicContact CZ2-CB 3.76Å; W248-H304 HydrophobicContact CZ3-CB 4.06Å; W248-H304 AromaticContact NE1-CD2 3.39Å; W248-H304 PolarHBondContact NE1-CD2 3.13Å; W248-L366 WeakPolarHBondContact O-CA 3.4Å; W248-A367 HydrophobicContact CB-CB 4.3Å; W248-A367 PolarHBondContact N-O 3.44Å; W248-A367 PolarHBondContact O-N 2.9Å; W248-A385 WeakPolarHBondContact CZ2-O 3.24Å; W248-F415 HydrophobicContact CB-CE1 4.23Å; W248-F415 HydrophobicContact CB-CZ 4.45Å; W248-F415 HydrophobicContact CG-CE1 4.3Å; W248-P417 HydrophobicContact CZ2-CB 4.47Å; W248-I421 HydrophobicContact CH2-CD1 3.41Å; W248-I421 VanDerWaalsContact CH2-CD1 3.41Å; W248-I421 HydrophobicContact CZ3-CD1 3.55Å; W248-I421 HydrophobicContact CZ3-CG1 4.42Å
249	I	96.1	Very high	94.5	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	152.7	175.9	59.2	173.6	0	0	0	111.6	L247 I297 W302 H303 L305 E365 L366	L247-I249 HydrophobicContact CD1-CG2 3.28Å; L247-I249 HydrophobicContact CG-CG2 3.89Å; I249-I297 HydrophobicContact CD1-CD1 3.47Å; I249-I297 VanDerWaalsContact CD1-CD1 3.47Å; I249-W302 VanDerWaalsContact C-CE3 3.46Å; I249-W302 WeakPolarHBondContact O-CA 3.34Å; I249-H303 PolarHBondContact N-O 3.44Å; I249-H303 PolarHBondContact O-N 3.03Å; I249-L305 HydrophobicContact CD1-CD1 3.41Å; I249-L305 VanDerWaalsContact CD1-CD1 3.41Å; I249-L305 HydrophobicContact CD1-CG 4.05Å; I249-L305 HydrophobicContact CG1-CD1 4.16Å; I249-L305 HydrophobicContact CG1-CG 4.27Å; I249-E365 CarbonylContact C-O 3.33Å; I249-E365 VanDerWaalsContact CA-O 3.3Å; I249-E365 WeakPolarHBondContact CA-O 3.16Å; I249-L366 HydrophobicContact CG2-CD1 4.35Å; I249-L366 HydrophobicContact CG2-CG 4.29Å
250	K	95.3	Very high	94.5	Very high	57 Å²	57	25.7 Å²	25.7	25%	0.248	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	127.4	171.3	170.2	176.8	170.7	-135.6	0	109.4	G300 K301 W302 Y362 G364 E365	K250-G300 WeakPolarHBondContact CE-O 3.29Å; K250-G300 WeakPolarHBondContact CG-O 3.39Å; K250-K301 WeakPolarHBondContact CA-O 3.42Å; K250-K301 WeakPolarHBondContact CB-O 3.21Å; K250-W302 HydrophobicContact CB-CD2 3.67Å; K250-W302 HydrophobicContact CB-CE3 3.84Å; K250-W302 HydrophobicContact CB-CG 4.07Å; K250-W302 HydrophobicContact CB-CH2 4.49Å; K250-W302 HydrophobicContact CB-CZ2 4.32Å; K250-W302 HydrophobicContact CB-CZ3 4.26Å; K250-W302 HydrophobicContact CD-CD2 4.2Å; K250-W302 HydrophobicContact CD-CG 4.09Å; K250-Y362 PolarHBondContact O-OH 3.08Å; K250-G364 CarbonylContact O-C 3.58Å; K250-G364 VanDerWaalsContact O-CA 3.26Å; K250-G364 WeakPolarHBondContact O-CA 3.47Å; K250-E365 HydrophobicContact CB-CB 4.27Å; K250-E365 WeakPolarHBondContact CE-OE1 3.43Å; K250-E365 PolarHBondContact N-O 3.39Å; K250-E365 IonicContact NZ-OE1 3.7Å; K250-E365 PolarHBondContact NZ-OE1 2.73Å; K250-E365 IonicContact NZ-OE2 3.91Å; K250-E365 PolarHBondContact O-N 2.96Å
251	S	93.8	Very high	94.5	Very high	6 Å²	6	25.6 Å²	25.6	4%	0.042	15%	0.15	C	C	.	.			trans	-150.7	147.8	177.3	-172.1	0	0	0	0	111.4	A253 G300 V363	S251-A253 WeakPolarHBondContact OG-CB 3.33Å; S251-A253 PolarHBondContact OG-N 3.32Å; S251-A253 VanDerWaalsContact OG-N 3.11Å; S251-G300 WeakPolarHBondContact O-CA 3.34Å; S251-G300 PolarHBondContact O-N 3.15Å; S251-G300 VanDerWaalsContact O-N 3.09Å; S251-V363 WeakPolarHBondContact CB-O 3.44Å; S251-V363 PolarHBondContact OG-O 3.42Å
252	S	89.8	Confident	94.5	Very high	103 Å²	103	19.6 Å²	19.6	72%	0.72	13%	0.127	S	C	*	.			trans	-120	15.3	168.1	55.8	0	0	0	0	111.4
253	A	87.3	Confident	94.6	Very high	15 Å²	15	18 Å²	18	12%	0.124	12%	0.116	C	C	.	.			trans	-71.2	142.1	-179.1	0	0	0	0	0	111.3	S251 V363	S251-A253 WeakPolarHBondContact OG-CB 3.33Å; S251-A253 PolarHBondContact OG-N 3.32Å; S251-A253 VanDerWaalsContact OG-N 3.11Å; A253-V363 HydrophobicContact CB-CB 3.94Å; A253-V363 HydrophobicContact CB-CG1 4.22Å
254	S	85.1	Confident	94.6	Very high	103 Å²	103	18 Å²	18	72%	0.72	12%	0.116	S	C	*	.	S	Bend	trans	-136.7	144	179.1	176.5	0	0	0	0	108.7
255	P	83	Confident	94.5	Very high	74 Å²	74	18.3 Å²	18.3	48%	0.481	12%	0.118	S	C	.	.	S	Bend	cis	-80.2	-11.5	6.9	32.5	-36.3	0	0	0	116	G278 N279	P255-G278 CarbonylContact C-O 3.57Å; P255-G278 VanDerWaalsContact C-O 3.29Å; P255-G278 WeakPolarHBondContact CB-O 3.31Å; P255-N279 WeakPolarHBondContact CB-OD1 3.23Å
256	G	87.6	Confident	94.5	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.01	15%	0.146	C	C	.	.			trans	-152.4	160	173.2	0	0	0	0	0	111.1	R225 G258 E276	R225-G256 PolarHBondContact NH2-O 2.92Å; G256-G258 PolarHBondContact O-N 3.45Å; G256-E276 CarbonylContact C-O 3.54Å; G256-E276 WeakPolarHBondContact CA-OE2 3.18Å
257	L	93.6	Very high	94.4	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	19%	0.189	C	C	.	.			trans	-77.9	-13.1	-173.6	56.6	82.5	0	0	0	115.8	P260 E276 M282 I297 Y362 V363	L257-P260 HydrophobicContact CD1-CG 3.57Å; L257-E276 HydrophobicContact CD1-CB 4.11Å; L257-E276 WeakPolarHBondContact CD2-OE2 3.32Å; L257-E276 HydrophobicContact CG-CB 3.89Å; L257-E276 VanDerWaalsContact CG-OE2 3.25Å; L257-E276 WeakPolarHBondContact CG-OE2 3.42Å; L257-E276 PolarHBondContact N-O 3.06Å; L257-E276 PolarHBondContact N-OE2 2.93Å; L257-M282 HydrophobicContact CD1-CE 3.62Å; L257-M282 HydrophobicContact CD2-CE 3.66Å; L257-M282 HydrophobicContact CG-CE 4.03Å; L257-I297 HydrophobicContact CD2-CD1 3.32Å; L257-I297 HydrophobicContact CD2-CG1 3.86Å; L257-Y362 HydrophobicContact CB-CD2 4.36Å; L257-Y362 HydrophobicContact CB-CE2 4.12Å; L257-Y362 HydrophobicContact CD1-CD2 3.83Å; L257-Y362 HydrophobicContact CD1-CE2 3.77Å; L257-Y362 HydrophobicContact CG-CE2 4.39Å; L257-Y362 CarbonylContact O-C 3.53Å; L257-Y362 VanDerWaalsContact O-CA 3.27Å; L257-Y362 WeakPolarHBondContact O-CA 3.34Å; L257-Y362 VanDerWaalsContact O-CD2 3.3Å; L257-Y362 WeakPolarHBondContact O-CD2 3.31Å; L257-V363 PolarHBondContact O-N 3.17Å
258	G	96.4	Very high	94.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.9	-143.1	-175.8	0	0	0	0	0	112.4	G256 P260 I275 E276 Q360	G256-G258 PolarHBondContact O-N 3.45Å; G258-P260 VanDerWaalsContact O-CD 3.26Å; G258-P260 WeakPolarHBondContact O-CD 3.34Å; G258-I275 CarbonylContact O-C 3.55Å; G258-I275 WeakPolarHBondContact O-CA 3.31Å; G258-E276 WeakPolarHBondContact CA-O 3.47Å; G258-E276 PolarHBondContact N-O 3.29Å; G258-E276 PolarHBondContact O-N 2.83Å; G258-Q360 CarbonylContact C-O 3.48Å; G258-Q360 VanDerWaalsContact CA-O 3.28Å; G258-Q360 WeakPolarHBondContact CA-O 3.37Å
259	T	98.2	Very high	94.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	91.2	-168.3	-50.2	0	0	0	0	112.5	F261 V273 L274 I275 G346 Q347 E348 Q360 Y362	T259-F261 VanDerWaalsContact C-N 3.26Å; T259-F261 PolarHBondContact O-N 2.98Å; T259-V273 HydrophobicContact CG2-CG1 3.78Å; T259-L274 WeakPolarHBondContact CA-O 3.2Å; T259-L274 WeakPolarHBondContact CG2-O 3.4Å; T259-I275 HydrophobicContact CG2-CB 4.35Å; T259-I275 VanDerWaalsContact OG1-CD1 3.26Å; T259-I275 WeakPolarHBondContact OG1-CD1 3.34Å; T259-I275 VanDerWaalsContact OG1-CG1 3.31Å; T259-I275 WeakPolarHBondContact OG1-CG1 3.45Å; T259-G346 CarbonylContact O-C 3.55Å; T259-G346 VanDerWaalsContact O-CA 3.23Å; T259-G346 WeakPolarHBondContact O-CA 3.16Å; T259-G346 PolarHBondContact O-N 3.47Å; T259-Q347 PolarHBondContact O-N 3.08Å; T259-E348 HydrophobicContact CG2-CB 4.03Å; T259-E348 HydrophobicContact CG2-CG 4.3Å; T259-Q360 WeakPolarHBondContact CB-O 3.36Å; T259-Q360 PolarHBondContact N-O 3.14Å; T259-Q360 PolarHBondContact OG1-O 3.4Å; T259-Y362 WeakPolarHBondContact O-CB 3.5Å
260	P	97.9	Very high	94.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	-43.6	177.6	-31.3	34.7	0	0	0	113.7	L247 L257 G258 L274 L345 G346 Y362 L366	L247-P260 HydrophobicContact CD1-CB 4.09Å; L257-P260 HydrophobicContact CD1-CG 3.57Å; G258-P260 VanDerWaalsContact O-CD 3.26Å; G258-P260 WeakPolarHBondContact O-CD 3.34Å; P260-L274 HydrophobicContact CB-CD2 4.35Å; P260-L274 VanDerWaalsContact CD-O 3.26Å; P260-L274 WeakPolarHBondContact CD-O 3.46Å; P260-L274 HydrophobicContact CG-CD2 4.27Å; P260-L345 WeakPolarHBondContact O-CA 3.47Å; P260-G346 PolarHBondContact O-N 2.96Å; P260-Y362 HydrophobicContact CG-CD2 3.92Å; P260-Y362 HydrophobicContact CG-CE2 3.98Å; P260-L366 HydrophobicContact CB-CD1 4.02Å
261	F	98.6	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	154.1	174.1	73.9	-89.8	0	0	0	112.5	V245 L247 T259 L272 L274 F284 L343 V344 L345 L369	V245-F261 HydrophobicContact CG1-CZ 4.09Å; V245-F261 HydrophobicContact CG2-CE1 3.99Å; V245-F261 HydrophobicContact CG2-CZ 3.86Å; L247-F261 HydrophobicContact CD2-CE1 4.35Å; T259-F261 VanDerWaalsContact C-N 3.26Å; T259-F261 PolarHBondContact O-N 2.98Å; F261-L272 HydrophobicContact CE2-CD2 3.97Å; F261-L272 HydrophobicContact CE2-CG 3.94Å; F261-L274 HydrophobicContact CD1-CB 3.85Å; F261-L274 HydrophobicContact CD1-CD2 4.22Å; F261-L274 HydrophobicContact CE1-CB 3.42Å; F261-L274 VanDerWaalsContact CE1-CB 3.42Å; F261-L274 HydrophobicContact CE1-CD2 3.72Å; F261-L274 HydrophobicContact CE1-CG 4.2Å; F261-L274 HydrophobicContact CZ-CB 3.81Å; F261-L274 PolarHBondContact O-N 3.49Å; F261-L274 VanDerWaalsContact O-N 3.08Å; F261-F284 HydrophobicContact CZ-CE2 4.15Å; F261-L343 HydrophobicContact CB-CD1 4.36Å; F261-L343 HydrophobicContact CD2-CD1 4.06Å; F261-V344 CarbonylContact C-O 3.41Å; F261-V344 VanDerWaalsContact CA-O 3.23Å; F261-V344 WeakPolarHBondContact CA-O 3.26Å; F261-L345 HydrophobicContact CB-CD2 3.69Å; F261-L369 HydrophobicContact CD1-CD1 4.37Å
262	S	98.7	Very high	94.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.9	172.2	62.5	0	0	0	0	110.1	L272 L343 V344 Q347 Q349	S262-L272 CarbonylContact C-O 3.57Å; S262-L272 WeakPolarHBondContact CA-O 3.35Å; S262-L343 WeakPolarHBondContact O-CA 3.36Å; S262-L343 WeakPolarHBondContact O-CD1 3.41Å; S262-V344 PolarHBondContact N-O 2.74Å; S262-V344 PolarHBondContact O-N 3.37Å; S262-Q347 WeakPolarHBondContact CB-O 3.37Å; S262-Q347 PolarHBondContact OG-O 2.69Å; S262-Q349 VanDerWaalsContact C-NE2 3.31Å; S262-Q349 PolarHBondContact O-NE2 2.92Å; S262-Q349 VanDerWaalsContact O-NE2 3.08Å; S262-Q349 WeakPolarHBondContact OG-CG 3.41Å; S262-Q349 PolarHBondContact OG-NE2 2.93Å
263	Y	98.8	Very high	95.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.1	173.8	173.1	-104.9	0	0	0	108.9	L237 V265 E271 L272 I337 K338 G341 V342 L343	L237-Y263 HydrophobicContact CB-CE2 3.91Å; L237-Y263 HydrophobicContact CD1-CD1 4.06Å; L237-Y263 HydrophobicContact CD1-CD2 3.64Å; L237-Y263 HydrophobicContact CD1-CE1 4.15Å; L237-Y263 HydrophobicContact CD1-CE2 3.75Å; L237-Y263 HydrophobicContact CD1-CG 3.8Å; L237-Y263 HydrophobicContact CG-CD2 3.96Å; L237-Y263 HydrophobicContact CG-CE2 3.66Å; Y263-V265 HydrophobicContact CD1-CG1 4.37Å; Y263-V265 HydrophobicContact CE1-CG1 3.53Å; Y263-E271 HydrophobicContact CD1-CB 3.92Å; Y263-E271 HydrophobicContact CD1-CG 3.73Å; Y263-E271 HydrophobicContact CE1-CB 4.32Å; Y263-E271 HydrophobicContact CE1-CG 3.76Å; Y263-E271 WeakPolarHBondContact O-CB 3.47Å; Y263-E271 PolarHBondContact O-N 2.88Å; Y263-L272 HydrophobicContact CD1-CB 4.32Å; Y263-L272 PolarHBondContact N-O 2.85Å; Y263-L272 PolarHBondContact O-N 3.06Å; Y263-L272 VanDerWaalsContact O-N 3.13Å; Y263-I337 HydrophobicContact CD1-CG2 4.43Å; Y263-I337 HydrophobicContact CE1-CG2 4.07Å; Y263-K338 WeakPolarHBondContact CE1-O 3.41Å; Y263-K338 PolarHBondContact OH-O 3.46Å; Y263-G341 VanDerWaalsContact CE2-CA 3.43Å; Y263-G341 WeakPolarHBondContact OH-CA 3.3Å; Y263-G341 PolarHBondContact OH-N 3.31Å; Y263-V342 WeakPolarHBondContact CA-O 3.49Å; Y263-L343 HydrophobicContact CD2-CB 4Å
264	A	98.6	Very high	95.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144.4	-178.1	0	0	0	0	0	110.2	A269 G341 V342 Q349 L352	A264-A269 WeakPolarHBondContact CA-O 3.47Å; A264-A269 WeakPolarHBondContact CB-O 3.18Å; A264-G341 CarbonylContact O-C 3.53Å; A264-G341 WeakPolarHBondContact O-CA 3.36Å; A264-V342 PolarHBondContact N-O 3.14Å; A264-V342 VanDerWaalsContact N-O 3.13Å; A264-V342 PolarHBondContact O-N 3.22Å; A264-Q349 HydrophobicContact CB-CB 4.02Å; A264-Q349 HydrophobicContact CB-CG 4.39Å; A264-L352 HydrophobicContact CB-CD1 4.21Å; A264-L352 WeakPolarHBondContact O-CD1 3.36Å
265	V	98.3	Very high	96.5	Very high	6 Å²	6	16.8 Å²	16.8	4%	0.036	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	161.5	172.3	-63.1	0	0	0	0	109.6	Y263 G267 Q268 E271 K338	Y263-V265 HydrophobicContact CD1-CG1 4.37Å; Y263-V265 HydrophobicContact CE1-CG1 3.53Å; V265-G267 PolarHBondContact O-N 2.65Å; V265-Q268 HydrophobicContact CG2-CB 3.84Å; V265-Q268 PolarHBondContact N-O 3.14Å; V265-Q268 CarbonylContact O-C 3.56Å; V265-Q268 PolarHBondContact O-N 2.95Å; V265-E271 HydrophobicContact CG1-CB 4.32Å; V265-E271 HydrophobicContact CG1-CG 4.01Å; V265-E271 HydrophobicContact CG2-CB 3.99Å; V265-E271 HydrophobicContact CG2-CG 4.02Å; V265-K338 HydrophobicContact CB-CB 4.32Å; V265-K338 HydrophobicContact CG1-CB 3.91Å; V265-K338 HydrophobicContact CG2-CB 4.07Å; V265-K338 HydrophobicContact CG2-CD 3.74Å
266	P	97.1	Very high	97.1	Very high	92 Å²	92	14.2 Å²	14.2	60%	0.597	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	119.7	175.4	-26.9	34.7	0	0	0	112	Q268 L352	P266-Q268 VanDerWaalsContact C-N 3.35Å; P266-L352 HydrophobicContact CG-CD2 4.11Å
267	G	95.1	Very high	97.4	Very high	89 Å²	89	20 Å²	20	92%	0.918	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.3	0.1	179.7	0	0	0	0	0	116	V265	V265-G267 PolarHBondContact O-N 2.65Å
268	Q	97.6	Very high	97.2	Very high	21 Å²	21	21.3 Å²	21.3	10%	0.098	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	103	171.5	177.2	51.8	-74	0	0	109.9	V265 P266 E271 N287 D288	V265-Q268 HydrophobicContact CG2-CB 3.84Å; V265-Q268 PolarHBondContact N-O 3.14Å; V265-Q268 CarbonylContact O-C 3.56Å; V265-Q268 PolarHBondContact O-N 2.95Å; P266-Q268 VanDerWaalsContact C-N 3.35Å; Q268-E271 HydrophobicContact CG-CB 4.14Å; Q268-E271 WeakPolarHBondContact CG-OE2 3.36Å; Q268-N287 PolarHBondContact NE2-OD1 3.35Å; Q268-D288 PolarHBondContact NE2-OD2 3.24Å; Q268-D288 PolarHBondContact OE1-OD2 3.38Å
269	A	97.3	Very high	96.8	Very high	22 Å²	22	28.5 Å²	28.5	18%	0.182	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-30.4	-176.9	0	0	0	0	0	111.9	A264 E271 Q349	A264-A269 WeakPolarHBondContact CA-O 3.47Å; A264-A269 WeakPolarHBondContact CB-O 3.18Å; A269-E271 PolarHBondContact O-N 3.17Å; A269-Q349 WeakPolarHBondContact CB-O 3.13Å
270	N	97.9	Very high	96.5	Very high	33 Å²	33	32 Å²	32	18%	0.176	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	46.9	179	-61.9	-32.8	0	0	0	111.5	L272 V273 N287 D288 E348	N270-L272 VanDerWaalsContact C-N 3.34Å; N270-V273 HydrophobicContact CB-CG2 4.25Å; N270-N287 WeakPolarHBondContact O-CA 3.36Å; N270-N287 PolarHBondContact O-N 3.15Å; N270-D288 WeakPolarHBondContact CB-OD1 3.4Å; N270-D288 PolarHBondContact ND2-OD1 2.88Å; N270-D288 PolarHBondContact O-N 3.43Å; N270-E348 PolarHBondContact OD1-OE1 2.67Å; N270-E348 VanDerWaalsContact OD1-OE1 3.06Å
271	E	98.4	Very high	96.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-41.9	179.5	-178.5	64.8	-165.4	0	0	110.5	Y263 V265 Q268 A269 I286 N287 H335 I337 K338	Y263-E271 HydrophobicContact CD1-CB 3.92Å; Y263-E271 HydrophobicContact CD1-CG 3.73Å; Y263-E271 HydrophobicContact CE1-CB 4.32Å; Y263-E271 HydrophobicContact CE1-CG 3.76Å; Y263-E271 WeakPolarHBondContact O-CB 3.47Å; Y263-E271 PolarHBondContact O-N 2.88Å; V265-E271 HydrophobicContact CG1-CB 4.32Å; V265-E271 HydrophobicContact CG1-CG 4.01Å; V265-E271 HydrophobicContact CG2-CB 3.99Å; V265-E271 HydrophobicContact CG2-CG 4.02Å; Q268-E271 HydrophobicContact CG-CB 4.14Å; Q268-E271 WeakPolarHBondContact CG-OE2 3.36Å; A269-E271 PolarHBondContact O-N 3.17Å; E271-I286 WeakPolarHBondContact O-CA 3.39Å; E271-N287 PolarHBondContact O-N 3.13Å; E271-N287 VanDerWaalsContact O-N 3.16Å; E271-H335 IonicContact OE1-CD2 2.65Å; E271-H335 IonicContact OE1-CE1 3.23Å; E271-H335 IonicContact OE1-NE2 3.17Å; E271-H335 PolarHBondContact OE1-NE2 2.8Å; E271-H335 IonicContact OE2-CE1 2.67Å; E271-H335 IonicContact OE2-NE2 2.88Å; E271-H335 PolarHBondContact OE2-NE2 2.99Å; E271-I337 HydrophobicContact CG-CG2 4.28Å; E271-I337 WeakPolarHBondContact OE1-CA 3.19Å; E271-K338 PolarHBondContact OE1-N 3.06Å
272	L	98.6	Very high	96.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	118	172.2	173.3	73	0	0	0	110.5	F243 F261 S262 Y263 N270 F284 L285 I286	F243-L272 HydrophobicContact CE1-CD1 4.35Å; F243-L272 HydrophobicContact CE2-CD1 3.99Å; F243-L272 HydrophobicContact CE2-CD2 4.21Å; F243-L272 HydrophobicContact CZ-CD1 3.47Å; F243-L272 VanDerWaalsContact CZ-CD1 3.47Å; F243-L272 HydrophobicContact CZ-CD2 4.27Å; F261-L272 HydrophobicContact CE2-CD2 3.97Å; F261-L272 HydrophobicContact CE2-CG 3.94Å; S262-L272 CarbonylContact C-O 3.57Å; S262-L272 WeakPolarHBondContact CA-O 3.35Å; Y263-L272 HydrophobicContact CD1-CB 4.32Å; Y263-L272 PolarHBondContact N-O 2.85Å; Y263-L272 PolarHBondContact O-N 3.06Å; Y263-L272 VanDerWaalsContact O-N 3.13Å; N270-L272 VanDerWaalsContact C-N 3.34Å; L272-F284 HydrophobicContact CD1-CE1 4.22Å; L272-F284 HydrophobicContact CD1-CE2 3.49Å; L272-F284 VanDerWaalsContact CD1-CE2 3.49Å; L272-F284 HydrophobicContact CD1-CZ 3.34Å; L272-F284 HydrophobicContact CG-CE2 4.46Å; L272-L285 CarbonylContact C-O 3.56Å; L272-L285 VanDerWaalsContact CA-O 3.31Å; L272-L285 WeakPolarHBondContact CA-O 3.03Å; L272-I286 HydrophobicContact CD1-CD1 4.48Å; L272-I286 HydrophobicContact CD1-CG1 3.92Å
273	V	98.7	Very high	96.1	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.4	-176.7	-172.8	0	0	0	0	111.2	T259 N270 I275 F284 L285 E348	T259-V273 HydrophobicContact CG2-CG1 3.78Å; N270-V273 HydrophobicContact CB-CG2 4.25Å; V273-I275 HydrophobicContact CG1-CB 4.19Å; V273-I275 HydrophobicContact CG1-CG2 4.29Å; V273-F284 CarbonylContact O-C 3.53Å; V273-F284 WeakPolarHBondContact O-CA 3.41Å; V273-F284 WeakPolarHBondContact O-CD2 3.48Å; V273-L285 HydrophobicContact CB-CB 4.08Å; V273-L285 HydrophobicContact CB-CD1 4.28Å; V273-L285 PolarHBondContact N-O 3.49Å; V273-L285 PolarHBondContact O-N 3.13Å; V273-E348 HydrophobicContact CG1-CG 4.37Å
274	L	98.6	Very high	96.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	120.9	165.4	-176	68.7	0	0	0	108.3	L247 T259 P260 F261 M282 F284 L293 I307	L247-L274 HydrophobicContact CD2-CD2 4.3Å; T259-L274 WeakPolarHBondContact CA-O 3.2Å; T259-L274 WeakPolarHBondContact CG2-O 3.4Å; P260-L274 HydrophobicContact CB-CD2 4.35Å; P260-L274 VanDerWaalsContact CD-O 3.26Å; P260-L274 WeakPolarHBondContact CD-O 3.46Å; P260-L274 HydrophobicContact CG-CD2 4.27Å; F261-L274 HydrophobicContact CD1-CB 3.85Å; F261-L274 HydrophobicContact CD1-CD2 4.22Å; F261-L274 HydrophobicContact CE1-CB 3.42Å; F261-L274 VanDerWaalsContact CE1-CB 3.42Å; F261-L274 HydrophobicContact CE1-CD2 3.72Å; F261-L274 HydrophobicContact CE1-CG 4.2Å; F261-L274 HydrophobicContact CZ-CB 3.81Å; F261-L274 PolarHBondContact O-N 3.49Å; F261-L274 VanDerWaalsContact O-N 3.08Å; L274-M282 HydrophobicContact CD1-CG 3.65Å; L274-M282 HydrophobicContact CD1-SD 3.6Å; L274-M282 VanDerWaalsContact CD1-SD 3.6Å; L274-M282 HydrophobicContact CD2-SD 4Å; L274-M282 HydrophobicContact CG-CE 4.5Å; L274-M282 HydrophobicContact CG-CG 4.27Å; L274-M282 HydrophobicContact CG-SD 3.88Å; L274-F284 HydrophobicContact CB-CD2 4.42Å; L274-F284 HydrophobicContact CD1-CB 4.44Å; L274-F284 HydrophobicContact CD1-CD2 4.05Å; L274-L293 HydrophobicContact CD1-CD1 3.77Å; L274-I307 HydrophobicContact CD1-CD1 3.73Å; L274-I307 HydrophobicContact CD2-CD1 4.49Å
275	I	97.6	Very high	96.1	Very high	13 Å²	13	37.6 Å²	37.6	7%	0.067	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	144.1	-173.6	-174.9	169.3	0	0	0	111.6	G258 T259 V273 W277 M282 E283 L285 E348 Q360	G258-I275 CarbonylContact O-C 3.55Å; G258-I275 WeakPolarHBondContact O-CA 3.31Å; T259-I275 HydrophobicContact CG2-CB 4.35Å; T259-I275 VanDerWaalsContact OG1-CD1 3.26Å; T259-I275 WeakPolarHBondContact OG1-CD1 3.34Å; T259-I275 VanDerWaalsContact OG1-CG1 3.31Å; T259-I275 WeakPolarHBondContact OG1-CG1 3.45Å; V273-I275 HydrophobicContact CG1-CB 4.19Å; V273-I275 HydrophobicContact CG1-CG2 4.29Å; I275-W277 HydrophobicContact CD1-CB 3.92Å; I275-W277 HydrophobicContact CG1-CB 3.95Å; I275-M282 CarbonylContact O-C 3.56Å; I275-M282 WeakPolarHBondContact O-CA 3.34Å; I275-E283 HydrophobicContact CG2-CB 4.2Å; I275-E283 PolarHBondContact N-O 3.09Å; I275-E283 PolarHBondContact O-N 3.43Å; I275-L285 HydrophobicContact CG2-CD1 3.6Å; I275-E348 HydrophobicContact CD1-CG 4.04Å; I275-Q360 HydrophobicContact CD1-CB 4.17Å; I275-Q360 HydrophobicContact CD1-CG 4.21Å
276	E	96.3	Very high	96.1	Very high	19 Å²	19	37.3 Å²	37.3	9%	0.089	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	106	164.7	-174.6	-174.7	-116.6	0	0	108.2	G256 L257 G258 M282	G256-E276 CarbonylContact C-O 3.54Å; G256-E276 WeakPolarHBondContact CA-OE2 3.18Å; L257-E276 HydrophobicContact CD1-CB 4.11Å; L257-E276 WeakPolarHBondContact CD2-OE2 3.32Å; L257-E276 HydrophobicContact CG-CB 3.89Å; L257-E276 VanDerWaalsContact CG-OE2 3.25Å; L257-E276 WeakPolarHBondContact CG-OE2 3.42Å; L257-E276 PolarHBondContact N-O 3.06Å; L257-E276 PolarHBondContact N-OE2 2.93Å; G258-E276 WeakPolarHBondContact CA-O 3.47Å; G258-E276 PolarHBondContact N-O 3.29Å; G258-E276 PolarHBondContact O-N 2.83Å; E276-M282 HydrophobicContact CB-CB 4.31Å; E276-M282 HydrophobicContact CB-CE 4.18Å
277	W	92.5	Very high	96.1	Very high	124 Å²	124	35 Å²	35	47%	0.47	21%	0.209	S	C	.	.			trans	-128.2	133.9	-171.4	-176.9	62.9	0	0	0	112.5	I275 N280 T359 Q360	I275-W277 HydrophobicContact CD1-CB 3.92Å; I275-W277 HydrophobicContact CG1-CB 3.95Å; W277-N280 WeakPolarHBondContact O-CB 3.33Å; W277-N280 PolarHBondContact O-N 3.02Å; W277-N280 PolarHBondContact O-ND2 3.06Å; W277-N280 VanDerWaalsContact O-ND2 3.15Å; W277-T359 PolarHBondContact NE1-O 2.89Å; W277-T359 PolarHBondContact NE1-OG1 2.86Å; W277-Q360 HydrophobicContact CD2-CG 4.3Å; W277-Q360 HydrophobicContact CG-CG 4.2Å
278	G	89.6	Confident	96.2	Very high	28 Å²	28	34.6 Å²	34.6	29%	0.289	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	-135.3	-175.1	0	0	0	0	0	111.8	P255	P255-G278 CarbonylContact C-O 3.57Å; P255-G278 VanDerWaalsContact C-O 3.29Å; P255-G278 WeakPolarHBondContact CB-O 3.31Å
279	N	88.6	Confident	96.2	Very high	150 Å²	150	39.2 Å²	39.2	80%	0.802	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	17.9	177.1	-66.6	-19.1	0	0	0	112.3	P255	P255-N279 WeakPolarHBondContact CB-OD1 3.23Å
280	N	90.9	Very high	96.3	Very high	74 Å²	74	41.7 Å²	41.7	40%	0.396	22%	0.218	S	C	.	.	S	Bend	trans	-84.2	148.9	177.5	-62.6	-55.6	0	0	0	109.7	W277	W277-N280 WeakPolarHBondContact O-CB 3.33Å; W277-N280 PolarHBondContact O-N 3.02Å; W277-N280 PolarHBondContact O-ND2 3.06Å; W277-N280 VanDerWaalsContact O-ND2 3.15Å
281	P	93.7	Very high	96.3	Very high	58 Å²	58	40.4 Å²	40.4	38%	0.377	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-60.7	166.8	168.2	30.3	-36	0	0	0	110	E283 K292	P281-E283 PolarHBondContact O-N 3.22Å; P281-K292 HydrophobicContact CG-CB 4.12Å; P281-K292 HydrophobicContact CG-CD 3.95Å; P281-K292 HydrophobicContact CG-CG 4.1Å
282	M	96.1	Very high	96.3	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-55.6	128.8	170.8	-176	163.8	-79.4	0	0	110.6	L257 L274 I275 E276 L293 F295 I297 L305	L257-M282 HydrophobicContact CD1-CE 3.62Å; L257-M282 HydrophobicContact CD2-CE 3.66Å; L257-M282 HydrophobicContact CG-CE 4.03Å; L274-M282 HydrophobicContact CD1-CG 3.65Å; L274-M282 HydrophobicContact CD1-SD 3.6Å; L274-M282 VanDerWaalsContact CD1-SD 3.6Å; L274-M282 HydrophobicContact CD2-SD 4Å; L274-M282 HydrophobicContact CG-CE 4.5Å; L274-M282 HydrophobicContact CG-CG 4.27Å; L274-M282 HydrophobicContact CG-SD 3.88Å; I275-M282 CarbonylContact O-C 3.56Å; I275-M282 WeakPolarHBondContact O-CA 3.34Å; E276-M282 HydrophobicContact CB-CB 4.31Å; E276-M282 HydrophobicContact CB-CE 4.18Å; M282-L293 HydrophobicContact CB-CB 4.42Å; M282-L293 HydrophobicContact CG-CD1 4.34Å; M282-L293 WeakPolarHBondContact O-CB 3.5Å; M282-L293 PolarHBondContact O-N 2.88Å; M282-F295 HydrophobicContact CG-CD2 4.38Å; M282-F295 HydrophobicContact SD-CD2 3.63Å; M282-F295 HydrophobicContact SD-CE2 4.26Å; M282-I297 HydrophobicContact CE-CD1 3.44Å; M282-I297 VanDerWaalsContact CE-CD1 3.44Å; M282-I297 HydrophobicContact SD-CD1 4.13Å; M282-L305 HydrophobicContact SD-CD1 4Å
283	E	97.7	Very high	96.2	Very high	39 Å²	39	46.5 Å²	46.5	18%	0.182	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.9	-178.3	-76.4	178.2	169.2	0	0	110	I275 P281 L285 V290 A291 K292	I275-E283 HydrophobicContact CG2-CB 4.2Å; I275-E283 PolarHBondContact N-O 3.09Å; I275-E283 PolarHBondContact O-N 3.43Å; P281-E283 PolarHBondContact O-N 3.22Å; E283-L285 HydrophobicContact CB-CD1 4.07Å; E283-V290 HydrophobicContact CB-CG1 4.01Å; E283-V290 HydrophobicContact CG-CG1 3.72Å; E283-A291 CarbonylContact C-O 3.6Å; E283-A291 WeakPolarHBondContact CA-O 3.16Å; E283-K292 HydrophobicContact CG-CG 4.18Å
284	F	98.4	Very high	96.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	119.3	175	-171.7	-123.6	0	0	0	109.3	F243 V245 F261 L272 V273 L274 I286 A291 L293 I307 L331	F243-F284 AromaticContact CE2-CZ 3.8Å; F243-F284 HydrophobicContact CE2-CZ 3.8Å; F243-F284 HydrophobicContact CZ-CE1 4.05Å; F243-F284 AromaticContact CZ-CZ 3.62Å; F243-F284 HydrophobicContact CZ-CZ 3.62Å; V245-F284 HydrophobicContact CG1-CE2 4.43Å; V245-F284 HydrophobicContact CG1-CZ 4.37Å; F261-F284 HydrophobicContact CZ-CE2 4.15Å; L272-F284 HydrophobicContact CD1-CE1 4.22Å; L272-F284 HydrophobicContact CD1-CE2 3.49Å; L272-F284 VanDerWaalsContact CD1-CE2 3.49Å; L272-F284 HydrophobicContact CD1-CZ 3.34Å; L272-F284 HydrophobicContact CG-CE2 4.46Å; V273-F284 CarbonylContact O-C 3.53Å; V273-F284 WeakPolarHBondContact O-CA 3.41Å; V273-F284 WeakPolarHBondContact O-CD2 3.48Å; L274-F284 HydrophobicContact CB-CD2 4.42Å; L274-F284 HydrophobicContact CD1-CB 4.44Å; L274-F284 HydrophobicContact CD1-CD2 4.05Å; F284-I286 HydrophobicContact CD1-CD1 4.46Å; F284-I286 HydrophobicContact CD1-CG1 4.47Å; F284-I286 HydrophobicContact CE1-CD1 3.81Å; F284-I286 HydrophobicContact CE1-CG1 4.06Å; F284-I286 HydrophobicContact CZ-CD1 4.46Å; F284-A291 PolarHBondContact N-O 3.06Å; F284-A291 PolarHBondContact O-N 3.4Å; F284-L293 HydrophobicContact CB-CD1 3.81Å; F284-L293 HydrophobicContact CB-CD2 4.14Å; F284-L293 HydrophobicContact CB-CG 3.99Å; F284-I307 HydrophobicContact CD1-CG2 3.83Å; F284-I307 HydrophobicContact CD2-CD1 3.81Å; F284-I307 HydrophobicContact CE1-CG2 3.54Å; F284-I307 HydrophobicContact CE2-CD1 3.98Å; F284-I307 HydrophobicContact CE2-CG2 4.48Å; F284-I307 HydrophobicContact CG-CD1 4.15Å; F284-I307 HydrophobicContact CG-CG2 4.39Å; F284-I307 HydrophobicContact CZ-CB 4.41Å; F284-I307 HydrophobicContact CZ-CD1 4.44Å; F284-I307 HydrophobicContact CZ-CG2 3.86Å; F284-L331 HydrophobicContact CD1-CD2 3.71Å; F284-L331 HydrophobicContact CE1-CD2 4.19Å
285	L	98.6	Very high	95.9	Very high	20 Å²	20	50.3 Å²	50.3	11%	0.105	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.1	-176	-63.2	78.7	0	0	0	110.2	L272 V273 I275 E283 K289 V290	L272-L285 CarbonylContact C-O 3.56Å; L272-L285 VanDerWaalsContact CA-O 3.31Å; L272-L285 WeakPolarHBondContact CA-O 3.03Å; V273-L285 HydrophobicContact CB-CB 4.08Å; V273-L285 HydrophobicContact CB-CD1 4.28Å; V273-L285 PolarHBondContact N-O 3.49Å; V273-L285 PolarHBondContact O-N 3.13Å; I275-L285 HydrophobicContact CG2-CD1 3.6Å; E283-L285 HydrophobicContact CB-CD1 4.07Å; L285-K289 CarbonylContact C-O 2.99Å; L285-K289 WeakPolarHBondContact CA-O 3.17Å; L285-V290 HydrophobicContact CD2-CG2 4.23Å; L285-V290 HydrophobicContact CG-CG2 4.09Å
286	I	98.6	Very high	95.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	120.9	165.8	-61.3	178.1	0	0	0	107.2	F243 E271 L272 F284 D288 K289 W309 L331 A332 I337	F243-I286 HydrophobicContact CE1-CD1 3.93Å; F243-I286 HydrophobicContact CZ-CD1 3.92Å; E271-I286 WeakPolarHBondContact O-CA 3.39Å; L272-I286 HydrophobicContact CD1-CD1 4.48Å; L272-I286 HydrophobicContact CD1-CG1 3.92Å; F284-I286 HydrophobicContact CD1-CD1 4.46Å; F284-I286 HydrophobicContact CD1-CG1 4.47Å; F284-I286 HydrophobicContact CE1-CD1 3.81Å; F284-I286 HydrophobicContact CE1-CG1 4.06Å; F284-I286 HydrophobicContact CZ-CD1 4.46Å; I286-D288 VanDerWaalsContact C-N 3.34Å; I286-D288 PolarHBondContact O-N 2.81Å; I286-K289 PolarHBondContact N-O 3.13Å; I286-K289 VanDerWaalsContact O-CB 3.32Å; I286-K289 WeakPolarHBondContact O-CB 3.38Å; I286-K289 PolarHBondContact O-N 3.19Å; I286-W309 HydrophobicContact CD1-CB 4.16Å; I286-W309 VanDerWaalsContact CD1-CD1 3.48Å; I286-W309 HydrophobicContact CD1-CD2 3.6Å; I286-W309 HydrophobicContact CD1-CE3 4.37Å; I286-W309 HydrophobicContact CD1-CG 3.47Å; I286-W309 VanDerWaalsContact CD1-CG 3.47Å; I286-W309 HydrophobicContact CD1-CZ2 4.41Å; I286-L331 HydrophobicContact CB-CG 4.32Å; I286-L331 HydrophobicContact CD1-CD2 3.76Å; I286-L331 HydrophobicContact CD1-CG 4.11Å; I286-L331 HydrophobicContact CG1-CD2 4.12Å; I286-L331 HydrophobicContact CG1-CG 4.33Å; I286-A332 HydrophobicContact CB-CB 3.86Å; I286-A332 HydrophobicContact CG2-CB 3.54Å; I286-A332 WeakPolarHBondContact O-CB 3.21Å; I286-I337 HydrophobicContact CG2-CD1 3.47Å; I286-I337 VanDerWaalsContact CG2-CD1 3.47Å
287	N	97.8	Very high	95.3	Very high	43 Å²	43	53 Å²	53	23%	0.23	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	52.8	-178.9	-173.1	31.7	0	0	0	112.6	Q268 N270 E271 K289 A332 H335	Q268-N287 PolarHBondContact NE2-OD1 3.35Å; N270-N287 WeakPolarHBondContact O-CA 3.36Å; N270-N287 PolarHBondContact O-N 3.15Å; E271-N287 PolarHBondContact O-N 3.13Å; E271-N287 VanDerWaalsContact O-N 3.16Å; N287-K289 PolarHBondContact O-N 3.04Å; N287-A332 HydrophobicContact CB-CB 4.43Å; N287-H335 PolarHBondContact ND2-CE1 3.21Å; N287-H335 PolarHBondContact ND2-ND1 2.76Å; N287-H335 VanDerWaalsContact ND2-ND1 3.13Å
288	D	97.1	Very high	94.8	Very high	81 Å²	81	51.9 Å²	51.9	43%	0.433	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	4.6	-174.6	-71.9	-50.5	0	0	0	116.2	Q268 N270 I286	Q268-D288 PolarHBondContact NE2-OD2 3.24Å; Q268-D288 PolarHBondContact OE1-OD2 3.38Å; N270-D288 WeakPolarHBondContact CB-OD1 3.4Å; N270-D288 PolarHBondContact ND2-OD1 2.88Å; N270-D288 PolarHBondContact O-N 3.43Å; I286-D288 VanDerWaalsContact C-N 3.34Å; I286-D288 PolarHBondContact O-N 2.81Å
289	K	98.3	Very high	94.8	Very high	118 Å²	118	54.2 Å²	54.2	51%	0.513	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.9	174.3	-55.9	-52.9	-179.9	-168.5	0	109.5	L285 I286 N287 L331 A332	L285-K289 CarbonylContact C-O 2.99Å; L285-K289 WeakPolarHBondContact CA-O 3.17Å; I286-K289 PolarHBondContact N-O 3.13Å; I286-K289 VanDerWaalsContact O-CB 3.32Å; I286-K289 WeakPolarHBondContact O-CB 3.38Å; I286-K289 PolarHBondContact O-N 3.19Å; N287-K289 PolarHBondContact O-N 3.04Å; K289-L331 HydrophobicContact CB-CD1 3.97Å; K289-L331 WeakPolarHBondContact O-CD1 3.45Å; K289-A332 HydrophobicContact CB-CB 4.31Å; K289-A332 HydrophobicContact CG-CB 4.19Å
290	V	98	Very high	95	Very high	74 Å²	74	48.1 Å²	48.1	45%	0.448	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134	-172	-179.4	0	0	0	0	111	E283 L285	E283-V290 HydrophobicContact CB-CG1 4.01Å; E283-V290 HydrophobicContact CG-CG1 3.72Å; L285-V290 HydrophobicContact CD2-CG2 4.23Å; L285-V290 HydrophobicContact CG-CG2 4.09Å
291	A	98.2	Very high	95.1	Very high	6 Å²	6	50.9 Å²	50.9	5%	0.05	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.4	161.2	0	0	0	0	0	109.9	E283 F284 W316 L331	E283-A291 CarbonylContact C-O 3.6Å; E283-A291 WeakPolarHBondContact CA-O 3.16Å; F284-A291 PolarHBondContact N-O 3.06Å; F284-A291 PolarHBondContact O-N 3.4Å; A291-W316 HydrophobicContact CB-CD2 4.21Å; A291-W316 HydrophobicContact CB-CG 4.47Å; A291-W316 HydrophobicContact CB-CZ2 3.99Å; A291-L331 HydrophobicContact CB-CD1 3.94Å; A291-L331 HydrophobicContact CB-CD2 3.79Å; A291-L331 HydrophobicContact CB-CG 4.33Å
292	K	97.9	Very high	95.1	Very high	125 Å²	125	49.5 Å²	49.5	54%	0.543	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	125.8	176.1	-65.8	-178.2	177.1	-172.9	0	109.7	P281 E283 W316	P281-K292 HydrophobicContact CG-CB 4.12Å; P281-K292 HydrophobicContact CG-CD 3.95Å; P281-K292 HydrophobicContact CG-CG 4.1Å; E283-K292 HydrophobicContact CG-CG 4.18Å; K292-W316 WeakPolarHBondContact O-CH2 3.31Å
293	L	97.4	Very high	95.1	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	27%	0.265	C	S	.	.			trans	-99.8	132.9	-176.4	-56.7	-173	0	0	0	110.7	L274 M282 F284 F295 I307 W316 A318	L274-L293 HydrophobicContact CD1-CD1 3.77Å; M282-L293 HydrophobicContact CB-CB 4.42Å; M282-L293 HydrophobicContact CG-CD1 4.34Å; M282-L293 WeakPolarHBondContact O-CB 3.5Å; M282-L293 PolarHBondContact O-N 2.88Å; F284-L293 HydrophobicContact CB-CD1 3.81Å; F284-L293 HydrophobicContact CB-CD2 4.14Å; F284-L293 HydrophobicContact CB-CG 3.99Å; L293-F295 HydrophobicContact CB-CD2 3.83Å; L293-F295 HydrophobicContact CB-CE2 4.02Å; L293-F295 HydrophobicContact CB-CG 4.35Å; L293-F295 HydrophobicContact CD1-CD2 3.93Å; L293-F295 HydrophobicContact CD1-CE2 3.45Å; L293-F295 VanDerWaalsContact CD1-CE2 3.45Å; L293-F295 HydrophobicContact CD1-CZ 4.24Å; L293-F295 HydrophobicContact CG-CE2 4.36Å; L293-F295 PolarHBondContact O-N 3.3Å; L293-I307 HydrophobicContact CD1-CD1 3.42Å; L293-I307 VanDerWaalsContact CD1-CD1 3.42Å; L293-I307 HydrophobicContact CD1-CG1 3.89Å; L293-W316 HydrophobicContact CD2-CE3 3.86Å; L293-W316 HydrophobicContact CD2-CH2 4.17Å; L293-W316 HydrophobicContact CD2-CZ3 3.61Å; L293-A318 HydrophobicContact CD2-CB 4.06Å
294	P	95.7	Very high	95	Very high	65 Å²	65	48.5 Å²	48.5	42%	0.422	26%	0.257	S	S	.	.			trans	-85.7	55.2	-179.1	36	-36.2	0	0	0	111.4	Q325	P294-Q325 HydrophobicContact CG-CB 4.02Å; P294-Q325 WeakPolarHBondContact CG-O 3.45Å
295	F	94.9	Very high	95	Very high	16 Å²	16	48.5 Å²	48.5	7%	0.07	26%	0.257	C	S	.	.			trans	-92.9	149.1	177.4	-64.7	-36.1	0	0	0	112	M282 L293 I297 L305 I307 A318 F319 Q320 Q325	M282-F295 HydrophobicContact CG-CD2 4.38Å; M282-F295 HydrophobicContact SD-CD2 3.63Å; M282-F295 HydrophobicContact SD-CE2 4.26Å; L293-F295 HydrophobicContact CB-CD2 3.83Å; L293-F295 HydrophobicContact CB-CE2 4.02Å; L293-F295 HydrophobicContact CB-CG 4.35Å; L293-F295 HydrophobicContact CD1-CD2 3.93Å; L293-F295 HydrophobicContact CD1-CE2 3.45Å; L293-F295 VanDerWaalsContact CD1-CE2 3.45Å; L293-F295 HydrophobicContact CD1-CZ 4.24Å; L293-F295 HydrophobicContact CG-CE2 4.36Å; L293-F295 PolarHBondContact O-N 3.3Å; F295-I297 HydrophobicContact CB-CG2 4.38Å; F295-L305 HydrophobicContact CD1-CD2 3.94Å; F295-L305 HydrophobicContact CD2-CD1 3.74Å; F295-L305 HydrophobicContact CD2-CD2 4.01Å; F295-L305 HydrophobicContact CD2-CG 4.45Å; F295-L305 HydrophobicContact CE1-CD2 4.01Å; F295-L305 HydrophobicContact CE2-CB 4.36Å; F295-L305 HydrophobicContact CE2-CD1 3.8Å; F295-L305 HydrophobicContact CE2-CD2 4.04Å; F295-L305 HydrophobicContact CE2-CG 4.31Å; F295-L305 HydrophobicContact CG-CD1 4.4Å; F295-L305 HydrophobicContact CG-CD2 3.94Å; F295-L305 HydrophobicContact CZ-CB 4.44Å; F295-L305 HydrophobicContact CZ-CD2 4.05Å; F295-I307 HydrophobicContact CE2-CD1 4.34Å; F295-I307 HydrophobicContact CE2-CG1 4.23Å; F295-I307 HydrophobicContact CZ-CG1 4.19Å; F295-A318 HydrophobicContact CE1-CB 3.79Å; F295-A318 HydrophobicContact CZ-CB 3.7Å; F295-F319 WeakPolarHBondContact CE1-O 3.49Å; F295-Q320 HydrophobicContact CD1-CB 3.94Å; F295-Q320 HydrophobicContact CE1-CB 4.1Å; F295-Q325 HydrophobicContact CD1-CG 4.45Å
296	S	90.4	Very high	95	Very high	86 Å²	86	47.6 Å²	47.6	60%	0.601	25%	0.252	S	S	*	.			trans	-133.8	100	175.8	-66	0	0	0	0	108.8	Q320	S296-Q320 PolarHBondContact O-NE2 3.5Å
297	I	90.3	Very high	95	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.015	25%	0.252	C	S	.	.			trans	-142	5.7	-162.1	54.7	176.7	0	0	0	114.1	I249 L257 M282 F295 D299 H303 L305	I249-I297 HydrophobicContact CD1-CD1 3.47Å; I249-I297 VanDerWaalsContact CD1-CD1 3.47Å; L257-I297 HydrophobicContact CD2-CD1 3.32Å; L257-I297 HydrophobicContact CD2-CG1 3.86Å; M282-I297 HydrophobicContact CE-CD1 3.44Å; M282-I297 VanDerWaalsContact CE-CD1 3.44Å; M282-I297 HydrophobicContact SD-CD1 4.13Å; F295-I297 HydrophobicContact CB-CG2 4.38Å; I297-D299 PolarHBondContact O-N 2.93Å; I297-H303 HydrophobicContact CG2-CB 3.77Å; I297-L305 HydrophobicContact CD1-CD1 4.13Å; I297-L305 HydrophobicContact CG2-CD2 4.04Å
298	N	83.8	Confident	95	Very high	100 Å²	100	45.6 Å²	45.6	54%	0.535	24%	0.241	S	C	.	.			trans	-91	27.1	-178	65.7	-13.9	0	0	0	112.8
299	D	89.6	Confident	95.1	Very high	76 Å²	76	41.7 Å²	41.7	41%	0.406	22%	0.221	S	C	.	.	S	Bend	trans	-95.8	4.3	-176.7	75	-12.5	0	0	0	113.2	I297 K301 H303	I297-D299 PolarHBondContact O-N 2.93Å; D299-K301 VanDerWaalsContact C-N 3.29Å; D299-K301 PolarHBondContact O-N 3.19Å; D299-K301 VanDerWaalsContact OD1-CB 3.29Å; D299-K301 WeakPolarHBondContact OD1-CB 3.44Å; D299-K301 PolarHBondContact OD1-N 3.49Å; D299-K301 VanDerWaalsContact OD2-CD 3.32Å; D299-K301 WeakPolarHBondContact OD2-CD 3.31Å; D299-K301 IonicContact OD2-NZ 3.71Å; D299-H303 IonicContact OD1-CD2 2.8Å; D299-H303 IonicContact OD1-NE2 3.35Å; D299-H303 PolarHBondContact OD1-NE2 2.74Å; D299-H303 IonicContact OD2-NE2 2.81Å
300	G	91.2	Very high	95.1	Very high	23 Å²	23	37.4 Å²	37.4	24%	0.237	20%	0.204	C	C	.	.	S	Bend	trans	75.3	12.3	-177.8	0	0	0	0	0	114.6	K250 S251	K250-G300 WeakPolarHBondContact CE-O 3.29Å; K250-G300 WeakPolarHBondContact CG-O 3.39Å; S251-G300 WeakPolarHBondContact O-CA 3.34Å; S251-G300 PolarHBondContact O-N 3.15Å; S251-G300 VanDerWaalsContact O-N 3.09Å
301	K	93.3	Very high	95.1	Very high	132 Å²	132	35.4 Å²	35.4	57%	0.574	19%	0.191	S	C	*	.	S	Bend	trans	-106.2	165.6	177.4	-57.4	-178	-166.5	157.2	0	112.1	K250 D299 H303	K250-K301 WeakPolarHBondContact CA-O 3.42Å; K250-K301 WeakPolarHBondContact CB-O 3.21Å; D299-K301 VanDerWaalsContact C-N 3.29Å; D299-K301 PolarHBondContact O-N 3.19Å; D299-K301 VanDerWaalsContact OD1-CB 3.29Å; D299-K301 WeakPolarHBondContact OD1-CB 3.44Å; D299-K301 PolarHBondContact OD1-N 3.49Å; D299-K301 VanDerWaalsContact OD2-CD 3.32Å; D299-K301 WeakPolarHBondContact OD2-CD 3.31Å; D299-K301 IonicContact OD2-NZ 3.71Å; K301-H303 PolarHBondContact O-CD2 3.16Å
302	W	94.3	Very high	95.1	Very high	28 Å²	28	43.8 Å²	43.8	11%	0.106	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	127.7	173.2	-80.2	108	0	0	0	110.5	Q219 W248 I249 K250 E365 A367 F415	Q219-W302 HydrophobicContact CB-CH2 4.17Å; Q219-W302 HydrophobicContact CB-CZ2 4.46Å; W248-W302 HydrophobicContact CB-CE3 3.86Å; W248-W302 HydrophobicContact CB-CZ3 3.82Å; W248-W302 HydrophobicContact CE3-CB 4.09Å; W248-W302 HydrophobicContact CE3-CE3 4.39Å; W248-W302 HydrophobicContact CZ3-CB 4.25Å; I249-W302 VanDerWaalsContact C-CE3 3.46Å; I249-W302 WeakPolarHBondContact O-CA 3.34Å; K250-W302 HydrophobicContact CB-CD2 3.67Å; K250-W302 HydrophobicContact CB-CE3 3.84Å; K250-W302 HydrophobicContact CB-CG 4.07Å; K250-W302 HydrophobicContact CB-CH2 4.49Å; K250-W302 HydrophobicContact CB-CZ2 4.32Å; K250-W302 HydrophobicContact CB-CZ3 4.26Å; K250-W302 HydrophobicContact CD-CD2 4.2Å; K250-W302 HydrophobicContact CD-CG 4.09Å; W302-E365 HydrophobicContact CH2-CB 3.61Å; W302-E365 HydrophobicContact CZ2-CB 3.71Å; W302-E365 WeakPolarHBondContact CZ2-OE2 3.49Å; W302-E365 HydrophobicContact CZ3-CB 4.48Å; W302-A367 HydrophobicContact CH2-CB 4.15Å; W302-A367 HydrophobicContact CZ3-CB 4.26Å; W302-F415 AromaticContact CD2-CE2 3.73Å; W302-F415 HydrophobicContact CD2-CE2 3.73Å; W302-F415 AromaticContact CD2-CZ 3.82Å; W302-F415 HydrophobicContact CD2-CZ 3.82Å; W302-F415 AromaticContact CE2-CD2 3.99Å; W302-F415 AromaticContact CE2-CE2 3.32Å; W302-F415 AromaticContact CE2-CZ 3.87Å; W302-F415 HydrophobicContact CE3-CE2 4.24Å; W302-F415 AromaticContact CE3-CZ 3.93Å; W302-F415 HydrophobicContact CE3-CZ 3.93Å; W302-F415 HydrophobicContact CG-CE2 4.23Å; W302-F415 HydrophobicContact CG-CZ 4.39Å; W302-F415 HydrophobicContact CH2-CD2 4.26Å; W302-F415 HydrophobicContact CH2-CE2 4.01Å; W302-F415 HydrophobicContact CH2-CZ 4.14Å; W302-F415 AromaticContact CZ2-CD2 3.73Å; W302-F415 HydrophobicContact CZ2-CD2 3.73Å; W302-F415 AromaticContact CZ2-CE2 3.49Å; W302-F415 HydrophobicContact CZ2-CE2 3.49Å; W302-F415 VanDerWaalsContact CZ2-CE2 3.49Å; W302-F415 HydrophobicContact CZ2-CZ 4.05Å; W302-F415 HydrophobicContact CZ3-CE2 4.36Å; W302-F415 HydrophobicContact CZ3-CZ 4.08Å; W302-F415 AromaticContact NE1-CE2 3.58Å
303	H	95.5	Very high	95	Very high	16 Å²	16	40.8 Å²	40.8	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.1	172.7	-67.3	-74.1	0	0	0	110.7	W248 I249 I297 D299 K301 Q320 D321	W248-H303 WeakPolarHBondContact CA-O 3.29Å; I249-H303 PolarHBondContact N-O 3.44Å; I249-H303 PolarHBondContact O-N 3.03Å; I297-H303 HydrophobicContact CG2-CB 3.77Å; D299-H303 IonicContact OD1-CD2 2.8Å; D299-H303 IonicContact OD1-NE2 3.35Å; D299-H303 PolarHBondContact OD1-NE2 2.74Å; D299-H303 IonicContact OD2-NE2 2.81Å; K301-H303 PolarHBondContact O-CD2 3.16Å; H303-Q320 PolarHBondContact ND1-NE2 2.88Å; H303-D321 VanDerWaalsContact CA-OD1 3.27Å; H303-D321 WeakPolarHBondContact CA-OD1 3.4Å; H303-D321 IonicContact CE1-OD2 3.04Å; H303-D321 IonicContact CG-OD2 3.79Å; H303-D321 IonicContact ND1-OD1 2.84Å; H303-D321 IonicContact ND1-OD2 3.58Å; H303-D321 PolarHBondContact ND1-OD2 2.85Å
304	H	96.3	Very high	95	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.019	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	114.8	171.2	177.4	-105.8	0	0	0	109.6	W248 C306 Q320 D321 A385	W248-H304 AromaticContact CD1-CD2 3.71Å; W248-H304 HydrophobicContact CD2-CB 3.98Å; W248-H304 AromaticContact CE2-CD2 3.79Å; W248-H304 HydrophobicContact CE3-CB 4.11Å; W248-H304 HydrophobicContact CH2-CB 3.88Å; W248-H304 HydrophobicContact CZ2-CB 3.76Å; W248-H304 HydrophobicContact CZ3-CB 4.06Å; W248-H304 AromaticContact NE1-CD2 3.39Å; W248-H304 PolarHBondContact NE1-CD2 3.13Å; H304-C306 PolarHBondContact CE1-SG 3.26Å; H304-Q320 CarbonylContact O-C 3.29Å; H304-Q320 WeakPolarHBondContact O-CA 3.34Å; H304-D321 PolarHBondContact N-OD1 2.96Å; H304-D321 PolarHBondContact O-N 2.73Å; H304-A385 HydrophobicContact CB-CB 4.28Å; H304-A385 WeakPolarHBondContact ND1-CB 3.47Å
305	L	97.8	Very high	95.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.1	176.4	-60.6	-169.9	0	0	0	110.3	C246 L247 I249 M282 F295 I297 F319 Q320	C246-L305 CarbonylContact C-O 3.45Å; C246-L305 WeakPolarHBondContact CA-O 3.46Å; L247-L305 HydrophobicContact CD2-CB 4.32Å; L247-L305 PolarHBondContact N-O 2.96Å; L247-L305 PolarHBondContact O-N 3.34Å; I249-L305 HydrophobicContact CD1-CD1 3.41Å; I249-L305 VanDerWaalsContact CD1-CD1 3.41Å; I249-L305 HydrophobicContact CD1-CG 4.05Å; I249-L305 HydrophobicContact CG1-CD1 4.16Å; I249-L305 HydrophobicContact CG1-CG 4.27Å; M282-L305 HydrophobicContact SD-CD1 4Å; F295-L305 HydrophobicContact CD1-CD2 3.94Å; F295-L305 HydrophobicContact CD2-CD1 3.74Å; F295-L305 HydrophobicContact CD2-CD2 4.01Å; F295-L305 HydrophobicContact CD2-CG 4.45Å; F295-L305 HydrophobicContact CE1-CD2 4.01Å; F295-L305 HydrophobicContact CE2-CB 4.36Å; F295-L305 HydrophobicContact CE2-CD1 3.8Å; F295-L305 HydrophobicContact CE2-CD2 4.04Å; F295-L305 HydrophobicContact CE2-CG 4.31Å; F295-L305 HydrophobicContact CG-CD1 4.4Å; F295-L305 HydrophobicContact CG-CD2 3.94Å; F295-L305 HydrophobicContact CZ-CB 4.44Å; F295-L305 HydrophobicContact CZ-CD2 4.05Å; I297-L305 HydrophobicContact CD1-CD1 4.13Å; I297-L305 HydrophobicContact CG2-CD2 4.04Å; L305-F319 WeakPolarHBondContact CA-O 3.1Å; L305-Q320 HydrophobicContact CD2-CB 4.1Å; L305-Q320 HydrophobicContact CD2-CG 3.97Å
306	C	98.2	Very high	95.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137	166	-71.8	0	0	0	0	110.7	V245 C246 H304 F319 I381	V245-C306 CarbonylContact O-C 3.57Å; V245-C306 VanDerWaalsContact O-CA 3.27Å; V245-C306 WeakPolarHBondContact O-CA 3.33Å; C246-C306 HydrophobicContact CB-CB 4.16Å; C246-C306 WeakPolarHBondContact CB-SG 3.5Å; C246-C306 WeakPolarHBondContact SG-CB 3.28Å; C246-C306 CovalentContact SG-SG 2.03Å; C246-C306 PolarHBondContact SG-SG 3.48Å; H304-C306 PolarHBondContact CE1-SG 3.26Å; C306-F319 HydrophobicContact CB-CB 4.16Å; C306-F319 PolarHBondContact N-O 3.08Å; C306-F319 PolarHBondContact O-N 2.65Å; C306-I381 HydrophobicContact CB-CD1 4.27Å; C306-I381 HydrophobicContact CB-CG1 4.31Å; C306-I381 HydrophobicContact CB-CG2 3.88Å
307	I	98.6	Very high	95.7	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.4	171.7	-57.7	153	0	0	0	107.5	S244 V245 L274 F284 L293 F295 E317	S244-I307 CarbonylContact C-O 3.39Å; S244-I307 VanDerWaalsContact CA-O 3.31Å; S244-I307 WeakPolarHBondContact CA-O 3.35Å; V245-I307 HydrophobicContact CG1-CB 4.03Å; V245-I307 PolarHBondContact N-O 3.25Å; V245-I307 PolarHBondContact O-N 3.09Å; L274-I307 HydrophobicContact CD1-CD1 3.73Å; L274-I307 HydrophobicContact CD2-CD1 4.49Å; F284-I307 HydrophobicContact CD1-CG2 3.83Å; F284-I307 HydrophobicContact CD2-CD1 3.81Å; F284-I307 HydrophobicContact CE1-CG2 3.54Å; F284-I307 HydrophobicContact CE2-CD1 3.98Å; F284-I307 HydrophobicContact CE2-CG2 4.48Å; F284-I307 HydrophobicContact CG-CD1 4.15Å; F284-I307 HydrophobicContact CG-CG2 4.39Å; F284-I307 HydrophobicContact CZ-CB 4.41Å; F284-I307 HydrophobicContact CZ-CD1 4.44Å; F284-I307 HydrophobicContact CZ-CG2 3.86Å; L293-I307 HydrophobicContact CD1-CD1 3.42Å; L293-I307 VanDerWaalsContact CD1-CD1 3.42Å; L293-I307 HydrophobicContact CD1-CG1 3.89Å; F295-I307 HydrophobicContact CE2-CD1 4.34Å; F295-I307 HydrophobicContact CE2-CG1 4.23Å; F295-I307 HydrophobicContact CZ-CG1 4.19Å; I307-E317 WeakPolarHBondContact CA-O 2.98Å
308	T	98.6	Very high	96.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	144.7	171.3	75.9	0	0	0	0	109.5	F243 S244 W316 E317 F319 K375 I381	F243-T308 WeakPolarHBondContact O-CA 3.06Å; S244-T308 WeakPolarHBondContact OG-CG2 3.27Å; T308-W316 CarbonylContact O-C 3.52Å; T308-W316 WeakPolarHBondContact O-CA 3.37Å; T308-W316 WeakPolarHBondContact O-CB 3.08Å; T308-E317 PolarHBondContact N-O 3.36Å; T308-E317 PolarHBondContact O-N 3.43Å; T308-F319 HydrophobicContact CG2-CE2 4.29Å; T308-K375 HydrophobicContact CG2-CG 4.38Å; T308-K375 WeakPolarHBondContact OG1-CE 3.44Å; T308-I381 HydrophobicContact CG2-CD1 3.87Å
309	W	98.7	Very high	96.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	148.5	178.7	173.9	90	0	0	0	111.6	S242 F243 I286 I311 I315 W316 L331 H335 I337	S242-W309 CarbonylContact C-O 3.55Å; S242-W309 VanDerWaalsContact CA-O 3.27Å; S242-W309 WeakPolarHBondContact CA-O 3.39Å; S242-W309 WeakPolarHBondContact CB-O 3.13Å; F243-W309 HydrophobicContact CD1-CB 4.42Å; F243-W309 HydrophobicContact CD1-CD2 4.42Å; F243-W309 AromaticContact CD1-CE3 3.56Å; F243-W309 HydrophobicContact CD1-CE3 3.56Å; F243-W309 HydrophobicContact CD1-CZ3 4.22Å; F243-W309 HydrophobicContact CE1-CB 3.88Å; F243-W309 AromaticContact CE1-CD2 3.88Å; F243-W309 HydrophobicContact CE1-CD2 3.88Å; F243-W309 AromaticContact CE1-CE3 3.41Å; F243-W309 HydrophobicContact CE1-CE3 3.41Å; F243-W309 VanDerWaalsContact CE1-CE3 3.41Å; F243-W309 HydrophobicContact CE1-CG 4.12Å; F243-W309 HydrophobicContact CE1-CZ3 4.19Å; F243-W309 HydrophobicContact CZ-CB 3.99Å; F243-W309 PolarHBondContact N-O 2.92Å; F243-W309 PolarHBondContact O-N 3.17Å; I286-W309 HydrophobicContact CD1-CB 4.16Å; I286-W309 VanDerWaalsContact CD1-CD1 3.48Å; I286-W309 HydrophobicContact CD1-CD2 3.6Å; I286-W309 HydrophobicContact CD1-CE3 4.37Å; I286-W309 HydrophobicContact CD1-CG 3.47Å; I286-W309 VanDerWaalsContact CD1-CG 3.47Å; I286-W309 HydrophobicContact CD1-CZ2 4.41Å; W309-I311 HydrophobicContact CH2-CB 3.64Å; W309-I311 HydrophobicContact CH2-CG1 4.03Å; W309-I311 HydrophobicContact CZ2-CB 4.33Å; W309-I311 HydrophobicContact CZ3-CB 4.12Å; W309-I315 CarbonylContact C-O 3.6Å; W309-I315 VanDerWaalsContact CA-O 3.3Å; W309-I315 WeakPolarHBondContact CA-O 3.26Å; W309-W316 HydrophobicContact CB-CB 4.5Å; W309-L331 PolarHBondContact NE1-O 3.18Å; W309-H335 WeakPolarHBondContact CH2-O 3.45Å; W309-I337 HydrophobicContact CZ3-CG1 4.24Å
310	T	98.4	Very high	97.2	Very high	28 Å²	28	31 Å²	31	17%	0.172	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	141	175.3	99.2	0	0	0	0	111.3	R312 G314 I315 K375	T310-R312 PolarHBondContact O-N 3.13Å; T310-R312 PolarHBondContact OG1-N 2.98Å; T310-R312 PolarHBondContact OG1-O 2.75Å; T310-R312 VanDerWaalsContact OG1-O 3.09Å; T310-G314 VanDerWaalsContact O-CA 3.31Å; T310-G314 WeakPolarHBondContact O-CA 3.39Å; T310-G314 PolarHBondContact O-N 2.83Å; T310-I315 PolarHBondContact N-O 2.89Å; T310-I315 PolarHBondContact O-N 3.01Å; T310-K375 HydrophobicContact CG2-CD 3.95Å
311	I	98	Very high	97.4	Very high	32 Å²	32	33 Å²	33	16%	0.164	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-31.1	177.7	-166.1	173.7	0	0	0	113.1	Y241 W309 D313 Y334 P336	Y241-I311 HydrophobicContact CD1-CD1 3.76Å; Y241-I311 HydrophobicContact CD1-CG2 4.34Å; Y241-I311 HydrophobicContact CE1-CD1 4.37Å; Y241-I311 WeakPolarHBondContact O-CB 3.27Å; Y241-I311 WeakPolarHBondContact O-CG2 3.41Å; Y241-I311 PolarHBondContact O-N 3.26Å; W309-I311 HydrophobicContact CH2-CB 3.64Å; W309-I311 HydrophobicContact CH2-CG1 4.03Å; W309-I311 HydrophobicContact CZ2-CB 4.33Å; W309-I311 HydrophobicContact CZ3-CB 4.12Å; I311-D313 PolarHBondContact O-N 3.29Å; I311-Y334 VanDerWaalsContact CG1-CA 3.48Å; I311-Y334 PolarHBondContact O-N 2.95Å; I311-P336 HydrophobicContact CD1-CB 4.06Å
312	R	97.3	Very high	97.5	Very high	182 Å²	182	27.4 Å²	27.4	69%	0.687	13%	0.129	S	C	*	.	G	3₁₀ helix	trans	-70.9	114.9	177.9	-172.7	-178.7	-62	174.2	1.9	108	T310 G314	T310-R312 PolarHBondContact O-N 3.13Å; T310-R312 PolarHBondContact OG1-N 2.98Å; T310-R312 PolarHBondContact OG1-O 2.75Å; T310-R312 VanDerWaalsContact OG1-O 3.09Å; R312-G314 PolarHBondContact O-N 2.91Å
313	D	97	Very high	97.7	Very high	61 Å²	61	30.3 Å²	30.3	33%	0.326	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	58.6	12.1	178.4	-45.3	-36.1	0	0	0	114.1	I311 I315 N330 Y334	I311-D313 PolarHBondContact O-N 3.29Å; D313-I315 VanDerWaalsContact C-N 3.26Å; D313-I315 HydrophobicContact CB-CD1 4.42Å; D313-I315 HydrophobicContact CB-CG1 4.19Å; D313-I315 PolarHBondContact O-N 2.94Å; D313-N330 WeakPolarHBondContact O-CA 3.26Å; D313-N330 PolarHBondContact O-N 2.9Å; D313-Y334 PolarHBondContact OD1-OH 3.34Å
314	G	97.9	Very high	97.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	60.4	33.8	178	0	0	0	0	0	113.6	T310 R312 W316 E329 L331	T310-G314 VanDerWaalsContact O-CA 3.31Å; T310-G314 WeakPolarHBondContact O-CA 3.39Å; T310-G314 PolarHBondContact O-N 2.83Å; R312-G314 PolarHBondContact O-N 2.91Å; G314-W316 PolarHBondContact O-N 3.2Å; G314-E329 CarbonylContact O-C 3.51Å; G314-E329 WeakPolarHBondContact O-CA 3.48Å; G314-L331 WeakPolarHBondContact CA-O 3.5Å; G314-L331 WeakPolarHBondContact O-CB 3.28Å; G314-L331 PolarHBondContact O-N 2.83Å; G314-L331 VanDerWaalsContact O-N 3.14Å
315	I	98.5	Very high	97.9	Very high	60 Å²	60	37.6 Å²	37.6	31%	0.308	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	127.7	-176.5	-60.6	170.8	0	0	0	109.7	W309 T310 D313 G328 E329	W309-I315 CarbonylContact C-O 3.6Å; W309-I315 VanDerWaalsContact CA-O 3.3Å; W309-I315 WeakPolarHBondContact CA-O 3.26Å; T310-I315 PolarHBondContact N-O 2.89Å; T310-I315 PolarHBondContact O-N 3.01Å; D313-I315 VanDerWaalsContact C-N 3.26Å; D313-I315 HydrophobicContact CB-CD1 4.42Å; D313-I315 HydrophobicContact CB-CG1 4.19Å; D313-I315 PolarHBondContact O-N 2.94Å; I315-G328 WeakPolarHBondContact CA-O 3.46Å; I315-E329 HydrophobicContact CG1-CB 4.35Å
316	W	98.6	Very high	97.9	Very high	23 Å²	23	38.2 Å²	38.2	9%	0.087	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.3	175	60.4	-89.5	0	0	0	112.2	A291 K292 L293 T308 W309 G314 A318 N327 G328 L331	A291-W316 HydrophobicContact CB-CD2 4.21Å; A291-W316 HydrophobicContact CB-CG 4.47Å; A291-W316 HydrophobicContact CB-CZ2 3.99Å; K292-W316 WeakPolarHBondContact O-CH2 3.31Å; L293-W316 HydrophobicContact CD2-CE3 3.86Å; L293-W316 HydrophobicContact CD2-CH2 4.17Å; L293-W316 HydrophobicContact CD2-CZ3 3.61Å; T308-W316 CarbonylContact O-C 3.52Å; T308-W316 WeakPolarHBondContact O-CA 3.37Å; T308-W316 WeakPolarHBondContact O-CB 3.08Å; W309-W316 HydrophobicContact CB-CB 4.5Å; G314-W316 PolarHBondContact O-N 3.2Å; W316-A318 HydrophobicContact CE3-CB 4.32Å; W316-A318 HydrophobicContact CZ3-CB 3.99Å; W316-N327 CarbonylContact O-C 3.53Å; W316-N327 WeakPolarHBondContact O-CA 3.26Å; W316-N327 VanDerWaalsContact O-CB 3.24Å; W316-N327 WeakPolarHBondContact O-CB 3.32Å; W316-G328 VanDerWaalsContact CE2-CA 3.44Å; W316-G328 PolarHBondContact N-O 3.5Å; W316-G328 PolarHBondContact O-N 3.32Å; W316-L331 HydrophobicContact CB-CD2 4.31Å; W316-L331 HydrophobicContact CG-CD2 4.18Å
317	E	98.6	Very high	97.9	Very high	35 Å²	35	42.8 Å²	42.8	16%	0.164	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.9	174.3	-58.4	-175.4	110.1	0	0	110	I307 T308 F319 K324 N327 K375	I307-E317 WeakPolarHBondContact CA-O 2.98Å; T308-E317 PolarHBondContact N-O 3.36Å; T308-E317 PolarHBondContact O-N 3.43Å; E317-F319 HydrophobicContact CB-CD2 4.44Å; E317-F319 HydrophobicContact CB-CE2 3.62Å; E317-F319 HydrophobicContact CB-CZ 4.24Å; E317-K324 WeakPolarHBondContact OE1-CE 3.4Å; E317-K324 IonicContact OE1-NZ 3.77Å; E317-K324 PolarHBondContact OE1-NZ 3.03Å; E317-N327 HydrophobicContact CB-CB 4.44Å; E317-N327 HydrophobicContact CG-CB 3.92Å; E317-K375 WeakPolarHBondContact OE2-CE 3.42Å; E317-K375 IonicContact OE2-NZ 3.72Å; E317-K375 PolarHBondContact OE2-NZ 2.65Å
318	A	98.6	Very high	97.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.5	-175.8	0	0	0	0	0	110.1	L293 F295 W316 Q325 G326	L293-A318 HydrophobicContact CD2-CB 4.06Å; F295-A318 HydrophobicContact CE1-CB 3.79Å; F295-A318 HydrophobicContact CZ-CB 3.7Å; W316-A318 HydrophobicContact CE3-CB 4.32Å; W316-A318 HydrophobicContact CZ3-CB 3.99Å; A318-Q325 PolarHBondContact O-N 3.18Å; A318-G326 PolarHBondContact N-O 2.75Å; A318-G326 PolarHBondContact O-N 3.2Å
319	F	98.5	Very high	97.8	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.026	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.9	-178.6	-59.6	-106.4	0	0	0	109.6	F295 L305 C306 T308 E317 V323 K324 A378 I381	F295-F319 WeakPolarHBondContact CE1-O 3.49Å; L305-F319 WeakPolarHBondContact CA-O 3.1Å; C306-F319 HydrophobicContact CB-CB 4.16Å; C306-F319 PolarHBondContact N-O 3.08Å; C306-F319 PolarHBondContact O-N 2.65Å; T308-F319 HydrophobicContact CG2-CE2 4.29Å; E317-F319 HydrophobicContact CB-CD2 4.44Å; E317-F319 HydrophobicContact CB-CE2 3.62Å; E317-F319 HydrophobicContact CB-CZ 4.24Å; F319-V323 CarbonylContact C-O 3.53Å; F319-V323 WeakPolarHBondContact CA-O 3.13Å; F319-K324 HydrophobicContact CD1-CB 3.77Å; F319-K324 HydrophobicContact CD1-CG 4.45Å; F319-K324 HydrophobicContact CE1-CB 3.6Å; F319-K324 HydrophobicContact CE1-CG 4.14Å; F319-K324 HydrophobicContact CZ-CB 4.25Å; F319-K324 HydrophobicContact CZ-CD 4.41Å; F319-K324 HydrophobicContact CZ-CG 4.29Å; F319-A378 HydrophobicContact CE1-CB 4.01Å; F319-I381 HydrophobicContact CB-CG2 3.83Å; F319-I381 HydrophobicContact CD1-CD1 4.19Å; F319-I381 HydrophobicContact CD1-CG2 4.03Å; F319-I381 HydrophobicContact CD2-CD1 3.61Å; F319-I381 HydrophobicContact CE1-CD1 4.15Å; F319-I381 HydrophobicContact CE2-CD1 3.54Å; F319-I381 HydrophobicContact CG-CD1 3.96Å; F319-I381 HydrophobicContact CG-CG2 3.92Å; F319-I381 HydrophobicContact CZ-CD1 3.84Å
320	Q	97.7	Very high	97.8	Very high	21 Å²	21	54.9 Å²	54.9	10%	0.098	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.2	173.4	-179.8	175.5	-29.7	0	0	107.7	F295 S296 H303 H304 L305 G322 V323 Q325	F295-Q320 HydrophobicContact CD1-CB 3.94Å; F295-Q320 HydrophobicContact CE1-CB 4.1Å; S296-Q320 PolarHBondContact O-NE2 3.5Å; H303-Q320 PolarHBondContact ND1-NE2 2.88Å; H304-Q320 CarbonylContact O-C 3.29Å; H304-Q320 WeakPolarHBondContact O-CA 3.34Å; L305-Q320 HydrophobicContact CD2-CB 4.1Å; L305-Q320 HydrophobicContact CD2-CG 3.97Å; Q320-G322 PolarHBondContact O-N 3.18Å; Q320-G322 VanDerWaalsContact O-N 3.16Å; Q320-V323 PolarHBondContact N-O 2.8Å; Q320-V323 PolarHBondContact O-N 3.09Å; Q320-V323 VanDerWaalsContact O-O 3.12Å; Q320-Q325 HydrophobicContact CB-CG 3.48Å; Q320-Q325 VanDerWaalsContact CB-CG 3.48Å
321	D	96.1	Very high	97.8	Very high	65 Å²	65	53.7 Å²	53.7	35%	0.348	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	37.9	177.8	-54.4	-37.7	0	0	0	112.5	H303 H304 V323	H303-D321 VanDerWaalsContact CA-OD1 3.27Å; H303-D321 WeakPolarHBondContact CA-OD1 3.4Å; H303-D321 IonicContact CE1-OD2 3.04Å; H303-D321 IonicContact CG-OD2 3.79Å; H303-D321 IonicContact ND1-OD1 2.84Å; H303-D321 IonicContact ND1-OD2 3.58Å; H303-D321 PolarHBondContact ND1-OD2 2.85Å; H304-D321 PolarHBondContact N-OD1 2.96Å; H304-D321 PolarHBondContact O-N 2.73Å; D321-V323 VanDerWaalsContact C-N 3.27Å; D321-V323 PolarHBondContact O-N 2.85Å
322	G	95.3	Very high	97.8	Very high	13 Å²	13	52.4 Å²	52.4	13%	0.134	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	-5	179.3	0	0	0	0	0	114.9	Q320 A385	Q320-G322 PolarHBondContact O-N 3.18Å; Q320-G322 VanDerWaalsContact O-N 3.16Å; G322-A385 VanDerWaalsContact CA-CB 3.49Å
323	V	97.3	Very high	97.8	Very high	89 Å²	89	45.9 Å²	45.9	54%	0.539	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.4	-177.3	-177.2	0	0	0	0	110.5	F319 Q320 D321 Q325	F319-V323 CarbonylContact C-O 3.53Å; F319-V323 WeakPolarHBondContact CA-O 3.13Å; Q320-V323 PolarHBondContact N-O 2.8Å; Q320-V323 PolarHBondContact O-N 3.09Å; Q320-V323 VanDerWaalsContact O-O 3.12Å; D321-V323 VanDerWaalsContact C-N 3.27Å; D321-V323 PolarHBondContact O-N 2.85Å; V323-Q325 PolarHBondContact O-N 2.86Å; V323-Q325 PolarHBondContact O-NE2 2.81Å
324	K	98.1	Very high	97.9	Very high	86 Å²	86	50.7 Å²	50.7	37%	0.374	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	121.6	176.2	-174	176.3	171	178.1	0	110.1	E317 F319 N327	E317-K324 WeakPolarHBondContact OE1-CE 3.4Å; E317-K324 IonicContact OE1-NZ 3.77Å; E317-K324 PolarHBondContact OE1-NZ 3.03Å; F319-K324 HydrophobicContact CD1-CB 3.77Å; F319-K324 HydrophobicContact CD1-CG 4.45Å; F319-K324 HydrophobicContact CE1-CB 3.6Å; F319-K324 HydrophobicContact CE1-CG 4.14Å; F319-K324 HydrophobicContact CZ-CB 4.25Å; F319-K324 HydrophobicContact CZ-CD 4.41Å; F319-K324 HydrophobicContact CZ-CG 4.29Å; K324-N327 VanDerWaalsContact CE-OD1 3.24Å; K324-N327 WeakPolarHBondContact CE-OD1 3.14Å; K324-N327 PolarHBondContact NZ-OD1 2.81Å
325	Q	98	Very high	97.9	Very high	88 Å²	88	52 Å²	52	41%	0.411	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-28.4	178.2	-58.9	-55.9	-30.6	0	0	112.6	P294 F295 A318 Q320 V323	P294-Q325 HydrophobicContact CG-CB 4.02Å; P294-Q325 WeakPolarHBondContact CG-O 3.45Å; F295-Q325 HydrophobicContact CD1-CG 4.45Å; A318-Q325 PolarHBondContact O-N 3.18Å; Q320-Q325 HydrophobicContact CB-CG 3.48Å; Q320-Q325 VanDerWaalsContact CB-CG 3.48Å; V323-Q325 PolarHBondContact O-N 2.86Å; V323-Q325 PolarHBondContact O-NE2 2.81Å
326	G	97.3	Very high	97.8	Very high	13 Å²	13	50.6 Å²	50.6	13%	0.134	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	169.2	-177.8	0	0	0	0	0	113.9	A318	A318-G326 PolarHBondContact N-O 2.75Å; A318-G326 PolarHBondContact O-N 3.2Å
327	N	98.2	Very high	97.8	Very high	95 Å²	95	49.5 Å²	49.5	51%	0.508	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	166.5	169.7	63.2	-104.3	0	0	0	110.4	W316 E317 K324	W316-N327 CarbonylContact O-C 3.53Å; W316-N327 WeakPolarHBondContact O-CA 3.26Å; W316-N327 VanDerWaalsContact O-CB 3.24Å; W316-N327 WeakPolarHBondContact O-CB 3.32Å; E317-N327 HydrophobicContact CB-CB 4.44Å; E317-N327 HydrophobicContact CG-CB 3.92Å; K324-N327 VanDerWaalsContact CE-OD1 3.24Å; K324-N327 WeakPolarHBondContact CE-OD1 3.14Å; K324-N327 PolarHBondContact NZ-OD1 2.81Å
328	G	98.2	Very high	97.8	Very high	17 Å²	17	52 Å²	52	18%	0.175	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	-173.6	171.7	0	0	0	0	0	111.4	I315 W316	I315-G328 WeakPolarHBondContact CA-O 3.46Å; W316-G328 VanDerWaalsContact CE2-CA 3.44Å; W316-G328 PolarHBondContact N-O 3.5Å; W316-G328 PolarHBondContact O-N 3.32Å
329	E	98.1	Very high	97.8	Very high	130 Å²	130	53.6 Å²	53.6	61%	0.607	28%	0.281	S	S	*	.	S	Bend	trans	-140.5	177.9	-178.4	58.6	179	-157.9	0	0	109.6	G314 I315 L331	G314-E329 CarbonylContact O-C 3.51Å; G314-E329 WeakPolarHBondContact O-CA 3.48Å; I315-E329 HydrophobicContact CG1-CB 4.35Å; E329-L331 PolarHBondContact O-N 2.81Å
330	N	98	Very high	97.7	Very high	108 Å²	108	59.3 Å²	59.3	58%	0.578	31%	0.312	S	S	*	.			trans	60.9	20.6	-179.2	-62.2	-54.2	0	0	0	115	D313 A332	D313-N330 WeakPolarHBondContact O-CA 3.26Å; D313-N330 PolarHBondContact O-N 2.9Å; N330-A332 PolarHBondContact O-N 3.08Å
331	L	98.3	Very high	97.7	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.021	31%	0.31	C	S	.	.	S	Bend	trans	-82	102.6	168.5	-177.8	63.3	0	0	0	109.5	F284 I286 K289 A291 W309 G314 W316 E329	F284-L331 HydrophobicContact CD1-CD2 3.71Å; F284-L331 HydrophobicContact CE1-CD2 4.19Å; I286-L331 HydrophobicContact CB-CG 4.32Å; I286-L331 HydrophobicContact CD1-CD2 3.76Å; I286-L331 HydrophobicContact CD1-CG 4.11Å; I286-L331 HydrophobicContact CG1-CD2 4.12Å; I286-L331 HydrophobicContact CG1-CG 4.33Å; K289-L331 HydrophobicContact CB-CD1 3.97Å; K289-L331 WeakPolarHBondContact O-CD1 3.45Å; A291-L331 HydrophobicContact CB-CD1 3.94Å; A291-L331 HydrophobicContact CB-CD2 3.79Å; A291-L331 HydrophobicContact CB-CG 4.33Å; W309-L331 PolarHBondContact NE1-O 3.18Å; G314-L331 WeakPolarHBondContact CA-O 3.5Å; G314-L331 WeakPolarHBondContact O-CB 3.28Å; G314-L331 PolarHBondContact O-N 2.83Å; G314-L331 VanDerWaalsContact O-N 3.14Å; W316-L331 HydrophobicContact CB-CD2 4.31Å; W316-L331 HydrophobicContact CG-CD2 4.18Å; E329-L331 PolarHBondContact O-N 2.81Å
332	A	98.2	Very high	97.8	Very high	4 Å²	4	56.7 Å²	56.7	3%	0.033	30%	0.301	C	S	.	.	S	Bend	trans	46.9	51.8	179.3	0	0	0	0	0	114.4	I286 N287 K289 N330 Y334 H335	I286-A332 HydrophobicContact CB-CB 3.86Å; I286-A332 HydrophobicContact CG2-CB 3.54Å; I286-A332 WeakPolarHBondContact O-CB 3.21Å; N287-A332 HydrophobicContact CB-CB 4.43Å; K289-A332 HydrophobicContact CB-CB 4.31Å; K289-A332 HydrophobicContact CG-CB 4.19Å; N330-A332 PolarHBondContact O-N 3.08Å; A332-Y334 PolarHBondContact O-N 3.46Å; A332-H335 HydrophobicContact CB-CB 4.21Å; A332-H335 WeakPolarHBondContact O-CB 3.11Å; A332-H335 PolarHBondContact O-N 3.1Å
333	P	98	Very high	97.9	Very high	46 Å²	46	56.1 Å²	56.1	30%	0.299	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	142.2	-178.8	28.7	-35.7	0	0	0	110.8	H335	P333-H335 PolarHBondContact O-N 3.28Å; P333-H335 VanDerWaalsContact O-N 3.13Å
334	Y	97.9	Very high	98	Very high	162 Å²	162	51.9 Å²	51.9	64%	0.635	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	11.2	178.6	-42.7	-62	0	0	0	115.7	I311 D313 A332	I311-Y334 VanDerWaalsContact CG1-CA 3.48Å; I311-Y334 PolarHBondContact O-N 2.95Å; D313-Y334 PolarHBondContact OD1-OH 3.34Å; A332-Y334 PolarHBondContact O-N 3.46Å
335	H	98	Very high	98	Very high	26 Å²	26	47.9 Å²	47.9	12%	0.12	25%	0.252	C	S	.	.			trans	-99.8	108	172.5	177.3	83.2	0	0	0	110.4	E271 N287 W309 A332 P333	E271-H335 IonicContact OE1-CD2 2.65Å; E271-H335 IonicContact OE1-CE1 3.23Å; E271-H335 IonicContact OE1-NE2 3.17Å; E271-H335 PolarHBondContact OE1-NE2 2.8Å; E271-H335 IonicContact OE2-CE1 2.67Å; E271-H335 IonicContact OE2-NE2 2.88Å; E271-H335 PolarHBondContact OE2-NE2 2.99Å; N287-H335 PolarHBondContact ND2-CE1 3.21Å; N287-H335 PolarHBondContact ND2-ND1 2.76Å; N287-H335 VanDerWaalsContact ND2-ND1 3.13Å; W309-H335 WeakPolarHBondContact CH2-O 3.45Å; A332-H335 HydrophobicContact CB-CB 4.21Å; A332-H335 WeakPolarHBondContact O-CB 3.11Å; A332-H335 PolarHBondContact O-N 3.1Å; P333-H335 PolarHBondContact O-N 3.28Å; P333-H335 VanDerWaalsContact O-N 3.13Å
336	P	97.9	Very high	98	Very high	31 Å²	31	43.7 Å²	43.7	20%	0.201	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-68.7	141.4	172	29.8	-32.6	0	0	0	109.8	E239 Y241 I311 K338	E239-P336 HydrophobicContact CG-CB 4.01Å; Y241-P336 HydrophobicContact CD1-CB 4.28Å; Y241-P336 HydrophobicContact CE1-CB 4.08Å; I311-P336 HydrophobicContact CD1-CB 4.06Å; P336-K338 PolarHBondContact O-N 2.92Å; P336-K338 VanDerWaalsContact O-N 3.16Å
337	I	98.4	Very high	98.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-63.5	120.3	170.6	-56.2	-57.4	0	0	0	107.5	E239 M240 F243 Y263 E271 I286 W309	E239-I337 VanDerWaalsContact CA-O 3.24Å; E239-I337 WeakPolarHBondContact CA-O 3.12Å; M240-I337 HydrophobicContact CB-CB 4.2Å; M240-I337 HydrophobicContact CE-CB 4.2Å; M240-I337 HydrophobicContact CE-CG1 4.49Å; M240-I337 HydrophobicContact CE-CG2 3.93Å; M240-I337 PolarHBondContact N-O 2.72Å; M240-I337 PolarHBondContact O-N 3.35Å; F243-I337 HydrophobicContact CD1-CG1 3.89Å; F243-I337 HydrophobicContact CE1-CD1 3.98Å; F243-I337 HydrophobicContact CE1-CG1 3.76Å; Y263-I337 HydrophobicContact CD1-CG2 4.43Å; Y263-I337 HydrophobicContact CE1-CG2 4.07Å; E271-I337 HydrophobicContact CG-CG2 4.28Å; E271-I337 WeakPolarHBondContact OE1-CA 3.19Å; I286-I337 HydrophobicContact CG2-CD1 3.47Å; I286-I337 VanDerWaalsContact CG2-CD1 3.47Å; W309-I337 HydrophobicContact CZ3-CG1 4.24Å
338	K	98.2	Very high	98.1	Very high	87 Å²	87	39 Å²	39	38%	0.378	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-70.2	143.3	-175.1	-72.3	169.2	176.6	170.4	0	111.7	Y263 V265 E271 P336	Y263-K338 WeakPolarHBondContact CE1-O 3.41Å; Y263-K338 PolarHBondContact OH-O 3.46Å; V265-K338 HydrophobicContact CB-CB 4.32Å; V265-K338 HydrophobicContact CG1-CB 3.91Å; V265-K338 HydrophobicContact CG2-CB 4.07Å; V265-K338 HydrophobicContact CG2-CD 3.74Å; E271-K338 PolarHBondContact OE1-N 3.06Å; P336-K338 PolarHBondContact O-N 2.92Å; P336-K338 VanDerWaalsContact O-N 3.16Å
339	A	97.8	Very high	98.1	Very high	34 Å²	34	38.2 Å²	38.2	28%	0.281	20%	0.195	S	C	.	.	S	Bend	trans	-74.8	170.8	176.4	0	0	0	0	0	112.7	L237 E239 G341	L237-A339 VanDerWaalsContact O-CA 3.31Å; L237-A339 WeakPolarHBondContact O-CA 3.45Å; E239-A339 HydrophobicContact CB-CB 4.29Å; A339-G341 VanDerWaalsContact C-N 3.28Å; A339-G341 PolarHBondContact O-N 2.8Å
340	D	96.4	Very high	98	Very high	126 Å²	126	37.2 Å²	37.2	67%	0.674	19%	0.194	S	C	*	.	S	Bend	trans	63.8	26.3	163.6	-57.8	-41.3	0	0	0	115.5	T236 L237	T236-D340 WeakPolarHBondContact CG2-OD1 3.27Å; T236-D340 WeakPolarHBondContact OG1-CA 3.44Å; T236-D340 PolarHBondContact OG1-N 3.19Å; L237-D340 PolarHBondContact O-N 2.78Å; L237-D340 VanDerWaalsContact O-N 3.1Å
341	G	97.7	Very high	98	Very high	6 Å²	6	34.8 Å²	34.8	6%	0.062	19%	0.186	C	C	.	.			trans	-87.6	-166.8	171.9	0	0	0	0	0	115	T236 Y263 A264 A339	T236-G341 WeakPolarHBondContact CB-O 3.48Å; T236-G341 PolarHBondContact OG1-N 3.32Å; T236-G341 PolarHBondContact OG1-O 2.96Å; Y263-G341 VanDerWaalsContact CE2-CA 3.43Å; Y263-G341 WeakPolarHBondContact OH-CA 3.3Å; Y263-G341 PolarHBondContact OH-N 3.31Å; A264-G341 CarbonylContact O-C 3.53Å; A264-G341 WeakPolarHBondContact O-CA 3.36Å; A339-G341 VanDerWaalsContact C-N 3.28Å; A339-G341 PolarHBondContact O-N 2.8Å
342	V	98.5	Very high	97.9	Very high	25 Å²	25	38.9 Å²	38.9	15%	0.152	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	116.9	-179.6	-179.5	0	0	0	0	110	K232 Y263 A264 V344 Q349 L352	K232-V342 HydrophobicContact CD-CG1 4.28Å; K232-V342 HydrophobicContact CG-CG1 4.25Å; Y263-V342 WeakPolarHBondContact CA-O 3.49Å; A264-V342 PolarHBondContact N-O 3.14Å; A264-V342 VanDerWaalsContact N-O 3.13Å; A264-V342 PolarHBondContact O-N 3.22Å; V342-V344 HydrophobicContact CG1-CG2 3.97Å; V342-Q349 PolarHBondContact O-NE2 2.97Å; V342-Q349 VanDerWaalsContact O-NE2 3.1Å; V342-Q349 PolarHBondContact O-OE1 2.97Å; V342-L352 HydrophobicContact CB-CD1 4.22Å; V342-L352 HydrophobicContact CG2-CD1 3.82Å; V342-L352 HydrophobicContact CG2-CG 4.03Å
343	L	98.6	Very high	97.8	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.3	174.2	173.4	65.5	0	0	0	109.6	A233 L237 F261 S262 Y263 L369 I371 F397	A233-L343 HydrophobicContact CB-CB 3.85Å; A233-L343 HydrophobicContact CB-CD2 3.93Å; A233-L343 HydrophobicContact CB-CG 4.07Å; A233-L343 PolarHBondContact N-O 2.81Å; L237-L343 HydrophobicContact CD2-CD2 4.36Å; F261-L343 HydrophobicContact CB-CD1 4.36Å; F261-L343 HydrophobicContact CD2-CD1 4.06Å; S262-L343 WeakPolarHBondContact O-CA 3.36Å; S262-L343 WeakPolarHBondContact O-CD1 3.41Å; Y263-L343 HydrophobicContact CD2-CB 4Å; L343-L369 HydrophobicContact CD2-CD2 4.44Å; L343-I371 HydrophobicContact CD2-CD1 3.98Å; L343-F397 HydrophobicContact CD2-CD2 4.11Å; L343-F397 HydrophobicContact CD2-CE2 4.35Å; L343-F397 HydrophobicContact CD2-CG 4.26Å
344	V	98.5	Very high	97.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.7	179	176.1	0	0	0	0	109.5	Y230 A231 F261 S262 V342 Q347 Q349 F356	Y230-V344 HydrophobicContact CD2-CG1 3.85Å; Y230-V344 HydrophobicContact CG-CG1 4.21Å; A231-V344 CarbonylContact O-C 3.53Å; A231-V344 WeakPolarHBondContact O-CA 3.33Å; F261-V344 CarbonylContact C-O 3.41Å; F261-V344 VanDerWaalsContact CA-O 3.23Å; F261-V344 WeakPolarHBondContact CA-O 3.26Å; S262-V344 PolarHBondContact N-O 2.74Å; S262-V344 PolarHBondContact O-N 3.37Å; V342-V344 HydrophobicContact CG1-CG2 3.97Å; V344-Q347 HydrophobicContact CG1-CB 3.95Å; V344-Q349 HydrophobicContact CB-CG 4.44Å; V344-Q349 HydrophobicContact CG2-CG 4.21Å; V344-F356 HydrophobicContact CG1-CE1 4.23Å; V344-F356 HydrophobicContact CG1-CZ 4.09Å; V344-F356 HydrophobicContact CG2-CZ 4.38Å
345	L	98.6	Very high	97.7	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.8	173.5	-47.4	-178.1	0	0	0	109.4	L220 F222 Y230 A231 P260 F261 L366 L369 W399 I404	L220-L345 HydrophobicContact CD1-CD1 4.14Å; F222-L345 HydrophobicContact CZ-CB 4.46Å; Y230-L345 WeakPolarHBondContact CA-O 3.23Å; Y230-L345 WeakPolarHBondContact CB-O 3.47Å; A231-L345 HydrophobicContact CB-CB 4.15Å; A231-L345 HydrophobicContact CB-CD1 4.27Å; A231-L345 HydrophobicContact CB-CG 4.43Å; A231-L345 PolarHBondContact N-O 3.09Å; A231-L345 PolarHBondContact O-N 2.81Å; P260-L345 WeakPolarHBondContact O-CA 3.47Å; F261-L345 HydrophobicContact CB-CD2 3.69Å; L345-L366 HydrophobicContact CD1-CD2 4.29Å; L345-L369 HydrophobicContact CD1-CD2 4.49Å; L345-L369 HydrophobicContact CD2-CD2 3.36Å; L345-W399 HydrophobicContact CD1-CH2 4.08Å; L345-W399 HydrophobicContact CD1-CZ3 3.69Å; L345-I404 HydrophobicContact CD1-CD1 4.32Å
346	G	98.1	Very high	97.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	87	-1.1	174.5	0	0	0	0	0	116	T259 P260 Y362	T259-G346 CarbonylContact O-C 3.55Å; T259-G346 VanDerWaalsContact O-CA 3.23Å; T259-G346 WeakPolarHBondContact O-CA 3.16Å; T259-G346 PolarHBondContact O-N 3.47Å; P260-G346 PolarHBondContact O-N 2.96Å; G346-Y362 PolarHBondContact O-N 2.93Å
347	Q	98.5	Very high	97.7	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.009	20%	0.203	C	C	.	.			trans	-139.5	148.8	179.9	-61.6	-65.8	-22.6	0	0	111.8	T226 M229 T259 S262 V344 F356	T226-Q347 PolarHBondContact O-NE2 3.26Å; T226-Q347 PolarHBondContact O-OE1 2.9Å; M229-Q347 PolarHBondContact O-NE2 3.35Å; T259-Q347 PolarHBondContact O-N 3.08Å; S262-Q347 WeakPolarHBondContact CB-O 3.37Å; S262-Q347 PolarHBondContact OG-O 2.69Å; V344-Q347 HydrophobicContact CG1-CB 3.95Å; Q347-F356 HydrophobicContact CB-CB 4.38Å; Q347-F356 HydrophobicContact CB-CD1 3.61Å; Q347-F356 HydrophobicContact CB-CD2 4.33Å; Q347-F356 HydrophobicContact CB-CE1 3.81Å; Q347-F356 HydrophobicContact CB-CG 3.86Å; Q347-F356 HydrophobicContact CB-CZ 4.29Å; Q347-F356 HydrophobicContact CG-CB 4.34Å; Q347-F356 HydrophobicContact CG-CD1 4.17Å; Q347-F356 HydrophobicContact CG-CD2 3.99Å; Q347-F356 HydrophobicContact CG-CE1 4.42Å; Q347-F356 HydrophobicContact CG-CE2 4.3Å; Q347-F356 HydrophobicContact CG-CG 3.91Å; Q347-F356 HydrophobicContact CG-CZ 4.48Å
348	E	98.3	Very high	97.6	Very high	8 Å²	8	35.3 Å²	35.3	4%	0.037	22%	0.216	C	C	.	.			trans	-84.5	142.9	165.3	-152.7	-63.8	105	0	0	108.7	T259 N270 V273 I275 F356 Q360	T259-E348 HydrophobicContact CG2-CB 4.03Å; T259-E348 HydrophobicContact CG2-CG 4.3Å; N270-E348 PolarHBondContact OD1-OE1 2.67Å; N270-E348 VanDerWaalsContact OD1-OE1 3.06Å; V273-E348 HydrophobicContact CG1-CG 4.37Å; I275-E348 HydrophobicContact CD1-CG 4.04Å; E348-F356 WeakPolarHBondContact O-CD1 2.84Å; E348-Q360 HydrophobicContact CB-CB 3.92Å; E348-Q360 PolarHBondContact OE2-OE1 3.41Å
349	Q	98.5	Very high	97.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	22%	0.218	C	C	.	.			trans	-110.2	110.9	-175.2	-81.6	174.8	102	0	0	110.9	S262 A264 A269 V342 V344 S351 F356	S262-Q349 VanDerWaalsContact C-NE2 3.31Å; S262-Q349 PolarHBondContact O-NE2 2.92Å; S262-Q349 VanDerWaalsContact O-NE2 3.08Å; S262-Q349 WeakPolarHBondContact OG-CG 3.41Å; S262-Q349 PolarHBondContact OG-NE2 2.93Å; A264-Q349 HydrophobicContact CB-CB 4.02Å; A264-Q349 HydrophobicContact CB-CG 4.39Å; A269-Q349 WeakPolarHBondContact CB-O 3.13Å; V342-Q349 PolarHBondContact O-NE2 2.97Å; V342-Q349 VanDerWaalsContact O-NE2 3.1Å; V342-Q349 PolarHBondContact O-OE1 2.97Å; V344-Q349 HydrophobicContact CB-CG 4.44Å; V344-Q349 HydrophobicContact CG2-CG 4.21Å; Q349-S351 VanDerWaalsContact C-N 3.31Å; Q349-F356 HydrophobicContact CG-CD1 4.48Å; Q349-F356 HydrophobicContact CG-CE1 3.81Å
350	D	96.7	Very high	97.4	Very high	109 Å²	109	34.1 Å²	34.1	58%	0.583	21%	0.211	S	C	*	.	S	Bend	trans	-82.4	-11.2	166.1	-73.1	-43.1	0	0	0	113	G354 G355	D350-G354 PolarHBondContact N-O 2.03Å; D350-G355 VanDerWaalsContact CB-O 3.26Å; D350-G355 WeakPolarHBondContact CB-O 3.42Å; D350-G355 PolarHBondContact N-O 2.8Å
351	S	96.2	Very high	97.5	Very high	57 Å²	57	28.2 Å²	28.2	40%	0.399	18%	0.179	S	C	.	.	B	Isolated β-bridge	trans	-149.4	163.6	178	64.5	0	0	0	0	110.8	Q349 G353 G354 G355	Q349-S351 VanDerWaalsContact C-N 3.31Å; S351-G353 PolarHBondContact O-N 2.65Å; S351-G354 PolarHBondContact N-O 3.14Å; S351-G354 VanDerWaalsContact N-O 3.13Å; S351-G354 PolarHBondContact O-N 2.87Å; S351-G354 PolarHBondContact OG-O 2.89Å; S351-G354 VanDerWaalsContact OG-O 3.09Å; S351-G355 PolarHBondContact OG-N 2.86Å
352	L	96.6	Very high	97.5	Very high	91 Å²	91	28 Å²	28	48%	0.476	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	106	-176.9	-172.6	68.1	0	0	0	111.6	A264 P266 V342	A264-L352 HydrophobicContact CB-CD1 4.21Å; A264-L352 WeakPolarHBondContact O-CD1 3.36Å; P266-L352 HydrophobicContact CG-CD2 4.11Å; V342-L352 HydrophobicContact CB-CD1 4.22Å; V342-L352 HydrophobicContact CG2-CD1 3.82Å; V342-L352 HydrophobicContact CG2-CG 4.03Å
353	G	96	Very high	97.4	Very high	21 Å²	21	28.2 Å²	28.2	22%	0.216	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	17	-179.5	0	0	0	0	0	115.6	S351	S351-G353 PolarHBondContact O-N 2.65Å
354	G	96.6	Very high	97.3	Very high	15 Å²	15	28.7 Å²	28.7	16%	0.155	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-170.8	-159.1	-176.3	0	0	0	0	0	113.6	D350 S351	D350-G354 PolarHBondContact N-O 2.03Å; S351-G354 PolarHBondContact N-O 3.14Å; S351-G354 VanDerWaalsContact N-O 3.13Å; S351-G354 PolarHBondContact O-N 2.87Å; S351-G354 PolarHBondContact OG-O 2.89Å; S351-G354 VanDerWaalsContact OG-O 3.09Å
355	G	97.4	Very high	97.2	Very high	39 Å²	39	30.8 Å²	30.8	40%	0.402	19%	0.193	S	C	.	.			trans	69.2	45.4	-175.7	0	0	0	0	0	111.3	D350 S351	D350-G355 VanDerWaalsContact CB-O 3.26Å; D350-G355 WeakPolarHBondContact CB-O 3.42Å; D350-G355 PolarHBondContact N-O 2.8Å; S351-G355 PolarHBondContact OG-N 2.86Å
356	F	98.3	Very high	97.1	Very high	29 Å²	29	30.7 Å²	30.7	13%	0.127	19%	0.193	C	C	.	.			trans	-82.3	134.6	-173.9	-54.6	-34.8	0	0	0	111.2	N227 Y230 V344 Q347 E348 Q349	N227-F356 HydrophobicContact CB-CB 4.12Å; N227-F356 VanDerWaalsContact CB-O 3.28Å; N227-F356 WeakPolarHBondContact CB-O 3.43Å; N227-F356 WeakPolarHBondContact O-CD2 3.07Å; Y230-F356 HydrophobicContact CD1-CD2 4.31Å; Y230-F356 AromaticContact CD1-CE2 3.53Å; Y230-F356 HydrophobicContact CD1-CE2 3.53Å; Y230-F356 HydrophobicContact CD1-CZ 4.25Å; Y230-F356 HydrophobicContact CD2-CE2 4.29Å; Y230-F356 HydrophobicContact CD2-CZ 4.2Å; Y230-F356 AromaticContact CE1-CE2 3.7Å; Y230-F356 HydrophobicContact CE1-CE2 3.7Å; Y230-F356 HydrophobicContact CE1-CZ 4.43Å; Y230-F356 HydrophobicContact CE2-CE2 4.4Å; Y230-F356 HydrophobicContact CE2-CZ 4.37Å; Y230-F356 AromaticContact CG-CE2 3.85Å; Y230-F356 HydrophobicContact CG-CE2 3.85Å; Y230-F356 HydrophobicContact CG-CZ 4.14Å; V344-F356 HydrophobicContact CG1-CE1 4.23Å; V344-F356 HydrophobicContact CG1-CZ 4.09Å; V344-F356 HydrophobicContact CG2-CZ 4.38Å; Q347-F356 HydrophobicContact CB-CB 4.38Å; Q347-F356 HydrophobicContact CB-CD1 3.61Å; Q347-F356 HydrophobicContact CB-CD2 4.33Å; Q347-F356 HydrophobicContact CB-CE1 3.81Å; Q347-F356 HydrophobicContact CB-CG 3.86Å; Q347-F356 HydrophobicContact CB-CZ 4.29Å; Q347-F356 HydrophobicContact CG-CB 4.34Å; Q347-F356 HydrophobicContact CG-CD1 4.17Å; Q347-F356 HydrophobicContact CG-CD2 3.99Å; Q347-F356 HydrophobicContact CG-CE1 4.42Å; Q347-F356 HydrophobicContact CG-CE2 4.3Å; Q347-F356 HydrophobicContact CG-CG 3.91Å; Q347-F356 HydrophobicContact CG-CZ 4.48Å; E348-F356 WeakPolarHBondContact O-CD1 2.84Å; Q349-F356 HydrophobicContact CG-CD1 4.48Å; Q349-F356 HydrophobicContact CG-CE1 3.81Å
357	D	97.5	Very high	97	Very high	57 Å²	57	30.7 Å²	30.7	31%	0.305	19%	0.193	S	C	.	.			trans	-100.6	123.4	166.9	-177.1	6.2	0	0	0	111	T359 Q360 A361	D357-T359 PolarHBondContact O-N 2.86Å; D357-T359 VanDerWaalsContact O-N 3.17Å; D357-T359 WeakPolarHBondContact OD1-CG2 3.27Å; D357-T359 PolarHBondContact OD1-N 2.91Å; D357-T359 PolarHBondContact OD2-OG1 2.9Å; D357-Q360 HydrophobicContact CB-CG 4.46Å; D357-Q360 PolarHBondContact O-N 2.86Å; D357-A361 PolarHBondContact O-N 2.89Å
358	A	96.6	Very high	96.7	Very high	33 Å²	33	32.3 Å²	32.3	27%	0.273	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.6	175.7	0	0	0	0	0	112.6	R225 N227 Q360 A361	R225-A358 WeakPolarHBondContact CB-O 3.16Å; R225-A358 WeakPolarHBondContact CD-O 3.43Å; N227-A358 HydrophobicContact CB-CB 4.23Å; A358-Q360 PolarHBondContact O-N 3.48Å; A358-A361 WeakPolarHBondContact O-CB 3.48Å; A358-A361 PolarHBondContact O-N 3.41Å
359	T	95.8	Very high	96.6	Very high	66 Å²	66	31.9 Å²	31.9	41%	0.405	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.8	179.1	81.7	0	0	0	0	113	W277 D357	W277-T359 PolarHBondContact NE1-O 2.89Å; W277-T359 PolarHBondContact NE1-OG1 2.86Å; D357-T359 PolarHBondContact O-N 2.86Å; D357-T359 VanDerWaalsContact O-N 3.17Å; D357-T359 WeakPolarHBondContact OD1-CG2 3.27Å; D357-T359 PolarHBondContact OD1-N 2.91Å; D357-T359 PolarHBondContact OD2-OG1 2.9Å
360	Q	96.9	Very high	96.5	Very high	30 Å²	30	32.7 Å²	32.7	14%	0.14	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-6.3	179.6	-63.2	171.4	-32.8	0	0	112.7	G258 T259 I275 W277 E348 D357 A358	G258-Q360 CarbonylContact C-O 3.48Å; G258-Q360 VanDerWaalsContact CA-O 3.28Å; G258-Q360 WeakPolarHBondContact CA-O 3.37Å; T259-Q360 WeakPolarHBondContact CB-O 3.36Å; T259-Q360 PolarHBondContact N-O 3.14Å; T259-Q360 PolarHBondContact OG1-O 3.4Å; I275-Q360 HydrophobicContact CD1-CB 4.17Å; I275-Q360 HydrophobicContact CD1-CG 4.21Å; W277-Q360 HydrophobicContact CD2-CG 4.3Å; W277-Q360 HydrophobicContact CG-CG 4.2Å; E348-Q360 HydrophobicContact CB-CB 3.92Å; E348-Q360 PolarHBondContact OE2-OE1 3.41Å; D357-Q360 HydrophobicContact CB-CG 4.46Å; D357-Q360 PolarHBondContact O-N 2.86Å; A358-Q360 PolarHBondContact O-N 3.48Å
361	A	97.8	Very high	96.5	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-60.4	140.6	179.2	0	0	0	0	0	112.4	R225 T226 D357 A358	R225-A361 PolarHBondContact NH1-O 3.21Å; T226-A361 WeakPolarHBondContact O-CB 3.32Å; D357-A361 PolarHBondContact O-N 2.89Å; A358-A361 WeakPolarHBondContact O-CB 3.48Å; A358-A361 PolarHBondContact O-N 3.41Å
362	Y	97.8	Very high	96.6	Very high	2 Å²	2	25 Å²	25	1%	0.008	16%	0.156	C	C	.	.			trans	-68.3	140.2	177.2	-176.8	-122.4	0	0	0	111.9	F222 K250 L257 T259 P260 G346 E365 L366	F222-Y362 HydrophobicContact CB-CD1 4.14Å; F222-Y362 WeakPolarHBondContact CB-O 3.38Å; F222-Y362 AromaticContact CD2-CD1 3.56Å; F222-Y362 HydrophobicContact CD2-CD1 3.56Å; F222-Y362 AromaticContact CD2-CE1 4Å; F222-Y362 HydrophobicContact CD2-CE1 4Å; F222-Y362 HydrophobicContact CE2-CD1 4.23Å; F222-Y362 HydrophobicContact CG-CD1 4.04Å; K250-Y362 PolarHBondContact O-OH 3.08Å; L257-Y362 HydrophobicContact CB-CD2 4.36Å; L257-Y362 HydrophobicContact CB-CE2 4.12Å; L257-Y362 HydrophobicContact CD1-CD2 3.83Å; L257-Y362 HydrophobicContact CD1-CE2 3.77Å; L257-Y362 HydrophobicContact CG-CE2 4.39Å; L257-Y362 CarbonylContact O-C 3.53Å; L257-Y362 VanDerWaalsContact O-CA 3.27Å; L257-Y362 WeakPolarHBondContact O-CA 3.34Å; L257-Y362 VanDerWaalsContact O-CD2 3.3Å; L257-Y362 WeakPolarHBondContact O-CD2 3.31Å; T259-Y362 WeakPolarHBondContact O-CB 3.5Å; P260-Y362 HydrophobicContact CG-CD2 3.92Å; P260-Y362 HydrophobicContact CG-CE2 3.98Å; G346-Y362 PolarHBondContact O-N 2.93Å; Y362-E365 PolarHBondContact OH-N 3.03Å; Y362-E365 PolarHBondContact OH-O 3.21Å; Y362-E365 VanDerWaalsContact OH-O 3.05Å; Y362-L366 HydrophobicContact CE1-CB 4.1Å
363	V	96.9	Very high	96.6	Very high	29 Å²	29	24.3 Å²	24.3	18%	0.176	15%	0.154	C	C	.	.			trans	-126.1	119	167.7	-178.9	0	0	0	0	108.7	F222 R225 S251 A253 L257	F222-V363 WeakPolarHBondContact O-CA 3.45Å; R225-V363 HydrophobicContact CB-CG2 4.37Å; R225-V363 HydrophobicContact CG-CG2 3.39Å; S251-V363 WeakPolarHBondContact CB-O 3.44Å; S251-V363 PolarHBondContact OG-O 3.42Å; A253-V363 HydrophobicContact CB-CB 3.94Å; A253-V363 HydrophobicContact CB-CG1 4.22Å; L257-V363 PolarHBondContact O-N 3.17Å
364	G	96.3	Very high	96.7	Very high	12 Å²	12	27.4 Å²	27.4	12%	0.124	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.2	-165.7	-177.7	0	0	0	0	0	113.4	F222 K250	F222-G364 PolarHBondContact N-O 2.81Å; F222-G364 PolarHBondContact O-N 2.99Å; K250-G364 CarbonylContact O-C 3.58Å; K250-G364 VanDerWaalsContact O-CA 3.26Å; K250-G364 WeakPolarHBondContact O-CA 3.47Å
365	E	96.6	Very high	96.7	Very high	43 Å²	43	30.5 Å²	30.5	20%	0.201	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.7	179.6	-56.2	165.7	-131	0	0	108.6	Q219 L220 T221 I249 K250 W302 Y362	Q219-E365 PolarHBondContact NE2-OE2 3.43Å; L220-E365 CarbonylContact O-C 3.57Å; L220-E365 WeakPolarHBondContact O-CA 3.21Å; T221-E365 HydrophobicContact CG2-CG 4.33Å; I249-E365 CarbonylContact C-O 3.33Å; I249-E365 VanDerWaalsContact CA-O 3.3Å; I249-E365 WeakPolarHBondContact CA-O 3.16Å; K250-E365 HydrophobicContact CB-CB 4.27Å; K250-E365 WeakPolarHBondContact CE-OE1 3.43Å; K250-E365 PolarHBondContact N-O 3.39Å; K250-E365 IonicContact NZ-OE1 3.7Å; K250-E365 PolarHBondContact NZ-OE1 2.73Å; K250-E365 IonicContact NZ-OE2 3.91Å; K250-E365 PolarHBondContact O-N 2.96Å; W302-E365 HydrophobicContact CH2-CB 3.61Å; W302-E365 HydrophobicContact CZ2-CB 3.71Å; W302-E365 WeakPolarHBondContact CZ2-OE2 3.49Å; W302-E365 HydrophobicContact CZ3-CB 4.48Å; Y362-E365 PolarHBondContact OH-N 3.03Å; Y362-E365 PolarHBondContact OH-O 3.21Å; Y362-E365 VanDerWaalsContact OH-O 3.05Å
366	L	96.2	Very high	96.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	136	-177.8	-176.9	152.5	0	0	0	110.3	Q219 L220 L247 W248 I249 P260 L345 Y362 L369 W399	Q219-L366 CarbonylContact C-O 3.6Å; Q219-L366 WeakPolarHBondContact CA-O 3.41Å; L220-L366 PolarHBondContact N-O 3.1Å; L220-L366 PolarHBondContact O-N 3.01Å; L247-L366 HydrophobicContact CD1-CD1 3.73Å; L247-L366 HydrophobicContact CD1-CG 4.14Å; W248-L366 WeakPolarHBondContact O-CA 3.4Å; I249-L366 HydrophobicContact CG2-CD1 4.35Å; I249-L366 HydrophobicContact CG2-CG 4.29Å; P260-L366 HydrophobicContact CB-CD1 4.02Å; L345-L366 HydrophobicContact CD1-CD2 4.29Å; Y362-L366 HydrophobicContact CE1-CB 4.1Å; L366-L369 HydrophobicContact CD2-CB 4.41Å; L366-W399 HydrophobicContact CD2-CH2 3.35Å; L366-W399 HydrophobicContact CD2-CZ2 4.3Å; L366-W399 HydrophobicContact CD2-CZ3 3.55Å
367	A	94.9	Very high	96.6	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	163.6	177.4	0	0	0	0	0	112.4	Q219 W248 W302 L369 F415	Q219-A367 HydrophobicContact CB-CB 4Å; W248-A367 HydrophobicContact CB-CB 4.3Å; W248-A367 PolarHBondContact N-O 3.44Å; W248-A367 PolarHBondContact O-N 2.9Å; W302-A367 HydrophobicContact CH2-CB 4.15Å; W302-A367 HydrophobicContact CZ3-CB 4.26Å; A367-L369 PolarHBondContact O-N 3.03Å; A367-L369 VanDerWaalsContact O-N 3.09Å; A367-F415 HydrophobicContact CB-CD1 3.29Å; A367-F415 HydrophobicContact CB-CE1 3.54Å; A367-F415 HydrophobicContact CB-CG 4.04Å; A367-F415 HydrophobicContact CB-CZ 4.49Å
368	H	93	Very high	96.5	Very high	36 Å²	36	30.2 Å²	30.2	17%	0.167	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.7	35.9	170.7	-68	-80.5	0	0	0	115.5	N370 W399 F415 P417	H368-N370 PolarHBondContact O-N 3.47Å; H368-N370 PolarHBondContact O-ND2 3.12Å; H368-W399 VanDerWaalsContact CA-CG 3.42Å; H368-W399 VanDerWaalsContact N-CD2 3.32Å; H368-W399 VanDerWaalsContact N-CE2 3.34Å; H368-F415 AromaticContact CD2-CD1 3.58Å; H368-F415 AromaticContact CD2-CE1 3.68Å; H368-F415 AromaticContact NE2-CD1 3.77Å; H368-P417 WeakPolarHBondContact CD2-CG 3.36Å; H368-P417 WeakPolarHBondContact NE2-CD 3.01Å; H368-P417 WeakPolarHBondContact NE2-CG 3.37Å
369	L	95.9	Very high	96.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	120.5	169.3	179.9	74.2	0	0	0	109.6	V245 C246 L247 F261 L343 L345 L366 A367 F397 W399	V245-L369 HydrophobicContact CG2-CD1 3.57Å; C246-L369 CarbonylContact O-C 3.4Å; C246-L369 VanDerWaalsContact O-CA 3.28Å; C246-L369 WeakPolarHBondContact O-CA 3.41Å; L247-L369 HydrophobicContact CB-CB 4.25Å; L247-L369 HydrophobicContact CB-CD1 3.84Å; L247-L369 HydrophobicContact CD1-CD1 4.5Å; L247-L369 HydrophobicContact CD2-CD1 4.25Å; L247-L369 HydrophobicContact CG-CD1 4.43Å; F261-L369 HydrophobicContact CD1-CD1 4.37Å; L343-L369 HydrophobicContact CD2-CD2 4.44Å; L345-L369 HydrophobicContact CD1-CD2 4.49Å; L345-L369 HydrophobicContact CD2-CD2 3.36Å; L366-L369 HydrophobicContact CD2-CB 4.41Å; A367-L369 PolarHBondContact O-N 3.03Å; A367-L369 VanDerWaalsContact O-N 3.09Å; L369-F397 HydrophobicContact CB-CE1 4.18Å; L369-F397 HydrophobicContact CD2-CD1 4.23Å; L369-F397 HydrophobicContact CD2-CE1 3.94Å; L369-F397 HydrophobicContact CG-CD1 4.21Å; L369-F397 HydrophobicContact CG-CE1 4.11Å; L369-F397 VanDerWaalsContact O-CD1 3.3Å; L369-F397 WeakPolarHBondContact O-CD1 3.2Å; L369-F397 VanDerWaalsContact O-CE1 3.27Å; L369-F397 WeakPolarHBondContact O-CE1 3.44Å; L369-W399 HydrophobicContact CB-CE3 3.65Å; L369-W399 HydrophobicContact CB-CZ3 3.77Å; L369-W399 VanDerWaalsContact N-CE3 3.3Å; L369-W399 WeakPolarHBondContact O-CB 3.3Å; L369-W399 PolarHBondContact O-N 3.08Å
370	N	96.1	Very high	96.4	Very high	16 Å²	16	32 Å²	32	9%	0.086	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.3	176.6	-72.7	-88.4	0	0	0	110	V245 C246 H368 W372 G394 F397 S398 W399	V245-N370 WeakPolarHBondContact CA-O 3.3Å; C246-N370 PolarHBondContact N-O 3.21Å; C246-N370 PolarHBondContact O-N 3.41Å; H368-N370 PolarHBondContact O-N 3.47Å; H368-N370 PolarHBondContact O-ND2 3.12Å; N370-W372 HydrophobicContact CB-CE3 4.37Å; N370-W372 HydrophobicContact CB-CH2 3.26Å; N370-W372 HydrophobicContact CB-CZ2 3.89Å; N370-W372 HydrophobicContact CB-CZ3 3.53Å; N370-W372 WeakPolarHBondContact O-CZ3 3.31Å; N370-G394 PolarHBondContact OD1-N 3.38Å; N370-G394 VanDerWaalsContact OD1-N 3.17Å; N370-F397 WeakPolarHBondContact CA-O 3.47Å; N370-S398 WeakPolarHBondContact OD1-CA 3.2Å; N370-W399 PolarHBondContact OD1-N 3.4Å
371	I	98	Very high	96.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.1	179.2	-54.4	174.6	0	0	0	109.3	L237 M240 S244 V245 L343 G394 N395 V396 F397	L237-I371 HydrophobicContact CD1-CD1 4.35Å; L237-I371 HydrophobicContact CD2-CD1 4.01Å; M240-I371 HydrophobicContact CE-CG2 4.49Å; M240-I371 HydrophobicContact SD-CG2 4.35Å; S244-I371 WeakPolarHBondContact O-CA 3.01Å; V245-I371 HydrophobicContact CB-CG1 4.38Å; V245-I371 HydrophobicContact CG2-CG1 4.06Å; L343-I371 HydrophobicContact CD2-CD1 3.98Å; I371-G394 CarbonylContact O-C 3.5Å; I371-G394 VanDerWaalsContact O-CA 3.31Å; I371-G394 WeakPolarHBondContact O-CA 3.26Å; I371-N395 PolarHBondContact O-N 2.77Å; I371-V396 HydrophobicContact CB-CB 4.17Å; I371-V396 HydrophobicContact CB-CG1 4.29Å; I371-V396 HydrophobicContact CG2-CB 4.01Å; I371-V396 HydrophobicContact CG2-CG1 3.99Å; I371-V396 WeakPolarHBondContact O-CB 3.41Å; I371-V396 PolarHBondContact O-N 3.15Å; I371-F397 HydrophobicContact CB-CB 3.91Å; I371-F397 HydrophobicContact CD1-CB 3.98Å; I371-F397 HydrophobicContact CG1-CB 3.98Å; I371-F397 PolarHBondContact N-O 3.45Å; I371-F397 PolarHBondContact O-N 3.41Å
372	W	97.9	Very high	96.1	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.4	173.9	-62.1	-97.9	0	0	0	110.5	F243 S244 C246 N370 R374 L376 L384 F392 V393 G394 N395	F243-W372 CarbonylContact C-O 3.54Å; F243-W372 WeakPolarHBondContact CA-O 3.09Å; F243-W372 WeakPolarHBondContact CB-O 3.48Å; S244-W372 PolarHBondContact N-O 3.41Å; S244-W372 PolarHBondContact O-N 2.97Å; C246-W372 HydrophobicContact CB-CH2 4.25Å; C246-W372 HydrophobicContact CB-CZ3 3.85Å; N370-W372 HydrophobicContact CB-CE3 4.37Å; N370-W372 HydrophobicContact CB-CH2 3.26Å; N370-W372 HydrophobicContact CB-CZ2 3.89Å; N370-W372 HydrophobicContact CB-CZ3 3.53Å; N370-W372 WeakPolarHBondContact O-CZ3 3.31Å; W372-R374 HydrophobicContact CB-CG 4.29Å; W372-R374 PolarHBondContact O-N 2.93Å; W372-R374 VanDerWaalsContact O-N 3.17Å; W372-L376 HydrophobicContact CD2-CD1 3.93Å; W372-L376 HydrophobicContact CD2-CD2 4.25Å; W372-L376 HydrophobicContact CD2-CG 4.37Å; W372-L376 HydrophobicContact CE3-CD1 3.77Å; W372-L376 HydrophobicContact CE3-CG 4.47Å; W372-L376 HydrophobicContact CG-CD2 4.12Å; W372-L376 HydrophobicContact CH2-CD1 4.22Å; W372-L376 HydrophobicContact CZ2-CD1 4.39Å; W372-L376 HydrophobicContact CZ3-CD1 3.93Å; W372-L384 HydrophobicContact CH2-CD1 3.74Å; W372-L384 HydrophobicContact CH2-CD2 4.19Å; W372-L384 HydrophobicContact CZ2-CD1 4.15Å; W372-L384 HydrophobicContact CZ2-CD2 4.32Å; W372-L384 HydrophobicContact CZ3-CD1 4.44Å; W372-F392 WeakPolarHBondContact CZ2-O 3.26Å; W372-V393 PolarHBondContact NE1-O 2.83Å; W372-G394 VanDerWaalsContact CE2-CA 3.49Å; W372-N395 WeakPolarHBondContact CA-OD1 3.39Å; W372-N395 WeakPolarHBondContact CB-OD1 3.38Å; W372-N395 VanDerWaalsContact CD1-OD1 3.28Å
373	N	97.1	Very high	95.8	Very high	78 Å²	78	34.5 Å²	34.5	42%	0.417	19%	0.194	S	C	.	.	S	Bend	trans	-84.4	26.7	175.1	66.3	-14.2	0	0	0	113.2	M240 S242 N395 V396	M240-N373 HydrophobicContact CG-CB 4.08Å; M240-N373 HydrophobicContact SD-CB 4.16Å; S242-N373 CarbonylContact O-C 3.51Å; S242-N373 WeakPolarHBondContact O-CA 3.28Å; S242-N373 VanDerWaalsContact O-O 3.04Å; N373-N395 PolarHBondContact N-OD1 3.06Å; N373-N395 PolarHBondContact OD1-ND2 2.01Å; N373-V396 HydrophobicContact CB-CG2 3.58Å
374	R	96.9	Very high	95.6	Very high	86 Å²	86	34.3 Å²	34.3	33%	0.325	19%	0.192	S	C	.	.	S	Bend	trans	-144.9	161.8	177.9	66.4	174.8	178.7	94.9	-2.6	110.4	S242 F243 S244 W372 L376 E380	S242-R374 PolarHBondContact O-N 3.49Å; F243-R374 CarbonylContact C-O 3.59Å; S244-R374 PolarHBondContact N-O 3.49Å; S244-R374 PolarHBondContact OG-O 3.09Å; W372-R374 HydrophobicContact CB-CG 4.29Å; W372-R374 PolarHBondContact O-N 2.93Å; W372-R374 VanDerWaalsContact O-N 3.17Å; R374-L376 VanDerWaalsContact CZ-CD2 3.49Å; R374-L376 PolarHBondContact O-N 2.84Å; R374-E380 IonicContact CZ-OE1 2.71Å; R374-E380 VanDerWaalsContact CZ-OE1 3.23Å; R374-E380 IonicContact NH1-OE1 3.61Å; R374-E380 PolarHBondContact NH1-OE1 2.74Å; R374-E380 IonicContact NH1-OE2 2.69Å; R374-E380 PolarHBondContact NH1-OE2 3.16Å; R374-E380 IonicContact NH2-OE1 2.78Å; R374-E380 PolarHBondContact NH2-OE1 2.85Å
375	K	97.3	Very high	95.4	Very high	80 Å²	80	34 Å²	34	35%	0.348	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-72.9	122.8	167.5	-169.6	173.3	-174.1	-179.5	0	110.1	S244 T308 T310 E317	S244-K375 WeakPolarHBondContact OG-CA 3.39Å; T308-K375 HydrophobicContact CG2-CG 4.38Å; T308-K375 WeakPolarHBondContact OG1-CE 3.44Å; T310-K375 HydrophobicContact CG2-CD 3.95Å; E317-K375 WeakPolarHBondContact OE2-CE 3.42Å; E317-K375 IonicContact OE2-NZ 3.72Å; E317-K375 PolarHBondContact OE2-NZ 2.65Å
376	L	97.1	Very high	95	Very high	6 Å²	6	37.6 Å²	37.6	3%	0.031	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-78.2	147	170.3	-65.3	-177.6	0	0	0	110.1	S244 W372 R374 E380 I381 L384	S244-L376 WeakPolarHBondContact OG-CG 3.36Å; S244-L376 PolarHBondContact OG-N 2.91Å; W372-L376 HydrophobicContact CD2-CD1 3.93Å; W372-L376 HydrophobicContact CD2-CD2 4.25Å; W372-L376 HydrophobicContact CD2-CG 4.37Å; W372-L376 HydrophobicContact CE3-CD1 3.77Å; W372-L376 HydrophobicContact CE3-CG 4.47Å; W372-L376 HydrophobicContact CG-CD2 4.12Å; W372-L376 HydrophobicContact CH2-CD1 4.22Å; W372-L376 HydrophobicContact CZ2-CD1 4.39Å; W372-L376 HydrophobicContact CZ3-CD1 3.93Å; R374-L376 VanDerWaalsContact CZ-CD2 3.49Å; R374-L376 PolarHBondContact O-N 2.84Å; L376-E380 HydrophobicContact CB-CB 4.39Å; L376-I381 HydrophobicContact CB-CD1 4.12Å; L376-I381 HydrophobicContact CB-CG1 3.85Å; L376-I381 HydrophobicContact CD1-CG1 4.25Å; L376-L384 HydrophobicContact CD1-CD1 3.78Å
377	S	96.3	Very high	94.3	Very high	54 Å²	54	39.7 Å²	39.7	38%	0.378	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-77.1	157.1	170.7	63.8	0	0	0	0	111.5	T379 E380 I381	S377-T379 PolarHBondContact O-N 2.77Å; S377-E380 WeakPolarHBondContact CB-OE2 3.45Å; S377-E380 PolarHBondContact N-OE2 2.81Å; S377-E380 PolarHBondContact O-N 3.35Å; S377-E380 VanDerWaalsContact O-N 3.08Å; S377-E380 VanDerWaalsContact OG-CG 3.26Å; S377-E380 WeakPolarHBondContact OG-CG 3.37Å; S377-E380 PolarHBondContact OG-N 2.91Å; S377-E380 PolarHBondContact OG-OE2 2.95Å; S377-I381 WeakPolarHBondContact O-CG1 3.41Å; S377-I381 PolarHBondContact O-N 3.2Å
378	A	96.2	Very high	93.6	Very high	58 Å²	58	42.6 Å²	42.6	48%	0.479	24%	0.239	S	C	.	.	H	α-helix	trans	-56.3	-35.4	176.3	0	0	0	0	0	112.4	F319 I381 A382	F319-A378 HydrophobicContact CE1-CB 4.01Å; A378-I381 PolarHBondContact O-N 3.34Å; A378-A382 WeakPolarHBondContact O-CB 3.48Å; A378-A382 PolarHBondContact O-N 3.06Å
379	T	94.1	Very high	92.3	Very high	99 Å²	99	46.8 Å²	46.8	61%	0.607	27%	0.272	S	S	*	.	H	α-helix	trans	-67.4	-41.3	176.5	-51.9	0	0	0	0	112.3	S377 I381 A382 N383	S377-T379 PolarHBondContact O-N 2.77Å; T379-I381 VanDerWaalsContact C-N 3.33Å; T379-A382 PolarHBondContact O-N 3.17Å; T379-N383 VanDerWaalsContact O-CG 3.28Å; T379-N383 PolarHBondContact O-N 3.29Å; T379-N383 PolarHBondContact O-ND2 2.71Å
380	E	94.4	Very high	91	Very high	37 Å²	37	54.9 Å²	54.9	17%	0.173	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-41.5	174.7	-72	167.4	114.7	0	0	111.3	R374 L376 S377 N383 L384	R374-E380 IonicContact CZ-OE1 2.71Å; R374-E380 VanDerWaalsContact CZ-OE1 3.23Å; R374-E380 IonicContact NH1-OE1 3.61Å; R374-E380 PolarHBondContact NH1-OE1 2.74Å; R374-E380 IonicContact NH1-OE2 2.69Å; R374-E380 PolarHBondContact NH1-OE2 3.16Å; R374-E380 IonicContact NH2-OE1 2.78Å; R374-E380 PolarHBondContact NH2-OE1 2.85Å; L376-E380 HydrophobicContact CB-CB 4.39Å; S377-E380 WeakPolarHBondContact CB-OE2 3.45Å; S377-E380 PolarHBondContact N-OE2 2.81Å; S377-E380 PolarHBondContact O-N 3.35Å; S377-E380 VanDerWaalsContact O-N 3.08Å; S377-E380 VanDerWaalsContact OG-CG 3.26Å; S377-E380 WeakPolarHBondContact OG-CG 3.37Å; S377-E380 PolarHBondContact OG-N 2.91Å; S377-E380 PolarHBondContact OG-OE2 2.95Å; E380-N383 WeakPolarHBondContact O-CB 3.27Å; E380-N383 PolarHBondContact O-N 2.81Å; E380-L384 WeakPolarHBondContact O-CG 3.44Å; E380-L384 PolarHBondContact O-N 2.98Å; E380-L384 VanDerWaalsContact O-N 3.08Å
381	I	95.8	Very high	89.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-65.5	-42.9	177.6	-67.2	169.4	0	0	0	111.4	C306 T308 F319 L376 S377 A378 T379 N383 L384 A385	C306-I381 HydrophobicContact CB-CD1 4.27Å; C306-I381 HydrophobicContact CB-CG1 4.31Å; C306-I381 HydrophobicContact CB-CG2 3.88Å; T308-I381 HydrophobicContact CG2-CD1 3.87Å; F319-I381 HydrophobicContact CB-CG2 3.83Å; F319-I381 HydrophobicContact CD1-CD1 4.19Å; F319-I381 HydrophobicContact CD1-CG2 4.03Å; F319-I381 HydrophobicContact CD2-CD1 3.61Å; F319-I381 HydrophobicContact CE1-CD1 4.15Å; F319-I381 HydrophobicContact CE2-CD1 3.54Å; F319-I381 HydrophobicContact CG-CD1 3.96Å; F319-I381 HydrophobicContact CG-CG2 3.92Å; F319-I381 HydrophobicContact CZ-CD1 3.84Å; L376-I381 HydrophobicContact CB-CD1 4.12Å; L376-I381 HydrophobicContact CB-CG1 3.85Å; L376-I381 HydrophobicContact CD1-CG1 4.25Å; S377-I381 WeakPolarHBondContact O-CG1 3.41Å; S377-I381 PolarHBondContact O-N 3.2Å; A378-I381 PolarHBondContact O-N 3.34Å; T379-I381 VanDerWaalsContact C-N 3.33Å; I381-N383 VanDerWaalsContact C-N 3.29Å; I381-N383 PolarHBondContact O-N 2.98Å; I381-L384 WeakPolarHBondContact O-CB 3.3Å; I381-L384 PolarHBondContact O-N 2.87Å; I381-A385 PolarHBondContact O-N 2.63Å
382	A	93.8	Very high	88.8	Confident	29 Å²	29	61.7 Å²	61.7	24%	0.24	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-36.7	175.1	0	0	0	0	0	112	A378 T379 A385 N386	A378-A382 WeakPolarHBondContact O-CB 3.48Å; A378-A382 PolarHBondContact O-N 3.06Å; T379-A382 PolarHBondContact O-N 3.17Å; A382-A385 PolarHBondContact O-N 3.05Å; A382-N386 WeakPolarHBondContact O-CB 3.26Å; A382-N386 PolarHBondContact O-N 3.37Å; A382-N386 PolarHBondContact O-ND2 3.49Å; A382-N386 VanDerWaalsContact O-ND2 3.12Å
383	N	92.2	Very high	88.3	Confident	58 Å²	58	66.1 Å²	66.1	31%	0.31	37%	0.369	S	S	.	.	H	α-helix	trans	-65.9	-36.9	175	-74.4	-32.9	0	0	0	112.6	T379 E380 I381 C387 N388	T379-N383 VanDerWaalsContact O-CG 3.28Å; T379-N383 PolarHBondContact O-N 3.29Å; T379-N383 PolarHBondContact O-ND2 2.71Å; E380-N383 WeakPolarHBondContact O-CB 3.27Å; E380-N383 PolarHBondContact O-N 2.81Å; I381-N383 VanDerWaalsContact C-N 3.29Å; I381-N383 PolarHBondContact O-N 2.98Å; N383-C387 PolarHBondContact O-N 2.86Å; N383-N388 HydrophobicContact CB-CB 4.15Å; N383-N388 WeakPolarHBondContact O-CB 3.45Å; N383-N388 PolarHBondContact O-N 2.99Å; N383-N388 PolarHBondContact OD1-ND2 2.83Å
384	L	92	Very high	88	Confident	24 Å²	24	62.8 Å²	62.8	13%	0.126	35%	0.353	C	S	.	.	H	α-helix	trans	-65.4	-45.2	174	-72.8	162.9	0	0	0	111.4	W372 L376 E380 I381 N386 C387 A391	W372-L384 HydrophobicContact CH2-CD1 3.74Å; W372-L384 HydrophobicContact CH2-CD2 4.19Å; W372-L384 HydrophobicContact CZ2-CD1 4.15Å; W372-L384 HydrophobicContact CZ2-CD2 4.32Å; W372-L384 HydrophobicContact CZ3-CD1 4.44Å; L376-L384 HydrophobicContact CD1-CD1 3.78Å; E380-L384 WeakPolarHBondContact O-CG 3.44Å; E380-L384 PolarHBondContact O-N 2.98Å; E380-L384 VanDerWaalsContact O-N 3.08Å; I381-L384 WeakPolarHBondContact O-CB 3.3Å; I381-L384 PolarHBondContact O-N 2.87Å; L384-N386 VanDerWaalsContact C-N 3.3Å; L384-N386 PolarHBondContact O-N 2.82Å; L384-C387 PolarHBondContact O-N 2.85Å; L384-A391 HydrophobicContact CD2-CB 3.78Å; L384-A391 HydrophobicContact CG-CB 4.28Å
385	A	91.8	Very high	87.9	Confident	7 Å²	7	63.1 Å²	63.1	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-63.8	-34.4	178.9	0	0	0	0	0	113	W248 H304 G322 I381 A382 C387 C418	W248-A385 WeakPolarHBondContact CZ2-O 3.24Å; H304-A385 HydrophobicContact CB-CB 4.28Å; H304-A385 WeakPolarHBondContact ND1-CB 3.47Å; G322-A385 VanDerWaalsContact CA-CB 3.49Å; I381-A385 PolarHBondContact O-N 2.63Å; A382-A385 PolarHBondContact O-N 3.05Å; A385-C387 VanDerWaalsContact C-N 3.29Å; A385-C387 PolarHBondContact O-N 2.93Å; A385-C418 PolarHBondContact O-SG 3.27Å; A385-C418 VanDerWaalsContact O-SG 3.41Å
386	N	88.6	Confident	87.8	Confident	117 Å²	117	60.2 Å²	60.2	63%	0.626	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	11.7	179.2	-67.4	-35.2	0	0	0	113.6	A382 L384 N388	A382-N386 WeakPolarHBondContact O-CB 3.26Å; A382-N386 PolarHBondContact O-N 3.37Å; A382-N386 PolarHBondContact O-ND2 3.49Å; A382-N386 VanDerWaalsContact O-ND2 3.12Å; L384-N386 VanDerWaalsContact C-N 3.3Å; L384-N386 PolarHBondContact O-N 2.82Å; N386-N388 PolarHBondContact O-N 2.89Å; N386-N388 VanDerWaalsContact O-N 3.1Å
387	C	80.6	Confident	87.7	Confident	45 Å²	45	60.2 Å²	60.2	30%	0.304	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	37.4	177.6	-51.3	0	0	0	0	113.8	N383 L384 A385 S389 P417 C418	N383-C387 PolarHBondContact O-N 2.86Å; L384-C387 PolarHBondContact O-N 2.85Å; A385-C387 VanDerWaalsContact C-N 3.29Å; A385-C387 PolarHBondContact O-N 2.93Å; C387-S389 PolarHBondContact O-N 2.78Å; C387-P417 HydrophobicContact CB-CB 4.33Å; C387-P417 WeakPolarHBondContact SG-CB 3.32Å; C387-C418 HydrophobicContact CB-CB 3.58Å; C387-C418 WeakPolarHBondContact CB-SG 3.33Å; C387-C418 WeakPolarHBondContact SG-CB 3.17Å; C387-C418 PolarHBondContact SG-N 3.39Å; C387-C418 CovalentContact SG-SG 2.01Å; C387-C418 PolarHBondContact SG-SG 3.37Å
388	N	79.7	Confident	87.6	Confident	60 Å²	60	58.8 Å²	58.8	32%	0.321	34%	0.34	S	S	.	.			trans	-62.5	130	178.3	-170.6	-32	0	0	0	109	N383 N386 K390 A391	N383-N388 HydrophobicContact CB-CB 4.15Å; N383-N388 WeakPolarHBondContact O-CB 3.45Å; N383-N388 PolarHBondContact O-N 2.99Å; N383-N388 PolarHBondContact OD1-ND2 2.83Å; N386-N388 PolarHBondContact O-N 2.89Å; N386-N388 VanDerWaalsContact O-N 3.1Å; N388-K390 PolarHBondContact O-N 3.5Å; N388-K390 PolarHBondContact OD1-N 2.93Å; N388-A391 WeakPolarHBondContact O-CB 3.4Å; N388-A391 PolarHBondContact O-N 3.39Å
389	S	67.6	Low	87.5	Confident	124 Å²	124	56.5 Å²	56.5	87%	0.867	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.5	-179.9	55.7	0	0	0	0	113.7	C387	C387-S389 PolarHBondContact O-N 2.78Å
390	K	68.4	Low	87.4	Confident	171 Å²	171	52.7 Å²	52.7	74%	0.743	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	1.2	173.6	-59.4	-178	-178.6	178.5	0	113.7	N388 F392	N388-K390 PolarHBondContact O-N 3.5Å; N388-K390 PolarHBondContact OD1-N 2.93Å; K390-F392 PolarHBondContact O-N 3.16Å
391	A	72.1	Confident	87.1	Confident	29 Å²	29	54.4 Å²	54.4	24%	0.24	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-63.5	133.4	-179.2	0	0	0	0	0	110.1	L384 N388	L384-A391 HydrophobicContact CD2-CB 3.78Å; L384-A391 HydrophobicContact CG-CB 4.28Å; N388-A391 WeakPolarHBondContact O-CB 3.4Å; N388-A391 PolarHBondContact O-N 3.39Å
392	F	76.1	Confident	86.8	Confident	129 Å²	129	58 Å²	58	57%	0.566	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-68.8	147.1	-175.5	-62.9	-76.2	0	0	0	111.2	W372 K390	W372-F392 WeakPolarHBondContact CZ2-O 3.26Å; K390-F392 PolarHBondContact O-N 3.16Å
393	V	86.4	Confident	86.8	Confident	98 Å²	98	57.7 Å²	57.7	59%	0.594	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-84.7	148.3	169.7	-178.1	0	0	0	0	109.1	W372 N395	W372-V393 PolarHBondContact NE1-O 2.83Å; V393-N395 PolarHBondContact O-N 3.31Å
394	G	91.8	Very high	86.9	Confident	8 Å²	8	55.6 Å²	55.6	8%	0.082	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-57.7	125.5	175.3	0	0	0	0	0	112.3	N370 I371 W372 F397	N370-G394 PolarHBondContact OD1-N 3.38Å; N370-G394 VanDerWaalsContact OD1-N 3.17Å; I371-G394 CarbonylContact O-C 3.5Å; I371-G394 VanDerWaalsContact O-CA 3.31Å; I371-G394 WeakPolarHBondContact O-CA 3.26Å; W372-G394 VanDerWaalsContact CE2-CA 3.49Å; G394-F397 WeakPolarHBondContact CA-O 3.45Å
395	N	93.4	Very high	87.1	Confident	92 Å²	92	58.2 Å²	58.2	49%	0.492	32%	0.323	S	S	.	.	S	Bend	trans	-83.8	-16.5	179.9	71.2	-62.2	0	0	0	113.3	I371 W372 N373 V393	I371-N395 PolarHBondContact O-N 2.77Å; W372-N395 WeakPolarHBondContact CA-OD1 3.39Å; W372-N395 WeakPolarHBondContact CB-OD1 3.38Å; W372-N395 VanDerWaalsContact CD1-OD1 3.28Å; N373-N395 PolarHBondContact N-OD1 3.06Å; N373-N395 PolarHBondContact OD1-ND2 2.01Å; V393-N395 PolarHBondContact O-N 3.31Å
396	V	95.4	Very high	87.4	Confident	19 Å²	19	61.1 Å²	61.1	12%	0.115	34%	0.337	C	S	.	.	S	Bend	trans	-95	-53.1	174.3	171.6	0	0	0	0	110.4	L237 P238 M240 I371 N373	L237-V396 HydrophobicContact CD2-CG1 3.61Å; P238-V396 HydrophobicContact CG-CG1 4.21Å; P238-V396 HydrophobicContact CG-CG2 4.24Å; M240-V396 HydrophobicContact SD-CG1 4.16Å; M240-V396 HydrophobicContact SD-CG2 3.97Å; I371-V396 HydrophobicContact CB-CB 4.17Å; I371-V396 HydrophobicContact CB-CG1 4.29Å; I371-V396 HydrophobicContact CG2-CB 4.01Å; I371-V396 HydrophobicContact CG2-CG1 3.99Å; I371-V396 WeakPolarHBondContact O-CB 3.41Å; I371-V396 PolarHBondContact O-N 3.15Å; N373-V396 HydrophobicContact CB-CG2 3.58Å
397	F	96	Very high	87.8	Confident	6 Å²	6	59 Å²	59	3%	0.026	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-133.6	129.1	175	179.7	-93.3	0	0	0	109	A233 L343 L369 N370 I371 G394 W399 N403 I404	A233-F397 HydrophobicContact CB-CD2 4.09Å; A233-F397 HydrophobicContact CB-CE2 3.58Å; A233-F397 HydrophobicContact CB-CZ 4.48Å; L343-F397 HydrophobicContact CD2-CD2 4.11Å; L343-F397 HydrophobicContact CD2-CE2 4.35Å; L343-F397 HydrophobicContact CD2-CG 4.26Å; L369-F397 HydrophobicContact CB-CE1 4.18Å; L369-F397 HydrophobicContact CD2-CD1 4.23Å; L369-F397 HydrophobicContact CD2-CE1 3.94Å; L369-F397 HydrophobicContact CG-CD1 4.21Å; L369-F397 HydrophobicContact CG-CE1 4.11Å; L369-F397 VanDerWaalsContact O-CD1 3.3Å; L369-F397 WeakPolarHBondContact O-CD1 3.2Å; L369-F397 VanDerWaalsContact O-CE1 3.27Å; L369-F397 WeakPolarHBondContact O-CE1 3.44Å; N370-F397 WeakPolarHBondContact CA-O 3.47Å; I371-F397 HydrophobicContact CB-CB 3.91Å; I371-F397 HydrophobicContact CD1-CB 3.98Å; I371-F397 HydrophobicContact CG1-CB 3.98Å; I371-F397 PolarHBondContact N-O 3.45Å; I371-F397 PolarHBondContact O-N 3.41Å; G394-F397 WeakPolarHBondContact CA-O 3.45Å; F397-W399 HydrophobicContact CE1-CE3 4.25Å; F397-N403 HydrophobicContact CE2-CB 4.22Å; F397-I404 HydrophobicContact CZ-CD1 4.09Å; F397-I404 HydrophobicContact CZ-CG1 3.95Å
398	S	94	Very high	88.5	Confident	25 Å²	25	58.9 Å²	58.9	18%	0.175	33%	0.329	C	S	.	.			trans	-117.2	137.3	177.2	64.4	0	0	0	0	110.7	N370 T400 N403	N370-S398 WeakPolarHBondContact OD1-CA 3.2Å; S398-T400 PolarHBondContact O-N 3.41Å; S398-N403 PolarHBondContact O-ND2 2.98Å; S398-N403 PolarHBondContact OG-ND2 3.02Å
399	W	93.4	Very high	89.1	Confident	9 Å²	9	58.7 Å²	58.7	3%	0.034	34%	0.341	C	S	.	.			trans	-69.8	93.8	176.2	-167.7	-104.9	0	0	0	111.6	F218 L220 L345 L366 H368 L369 N370 F397 I404	F218-W399 AromaticContact CD1-NE1 3.74Å; F218-W399 AromaticContact CD2-CZ2 3.9Å; F218-W399 HydrophobicContact CD2-CZ2 3.9Å; F218-W399 AromaticContact CD2-NE1 3.93Å; F218-W399 AromaticContact CE1-CD1 3.81Å; F218-W399 AromaticContact CE1-NE1 3.48Å; F218-W399 AromaticContact CE2-CE2 3.59Å; F218-W399 HydrophobicContact CE2-CH2 4.21Å; F218-W399 AromaticContact CE2-CZ2 3.36Å; F218-W399 HydrophobicContact CE2-CZ2 3.36Å; F218-W399 AromaticContact CE2-NE1 3.73Å; F218-W399 AromaticContact CG-NE1 3.95Å; F218-W399 HydrophobicContact CZ-CD2 4.17Å; F218-W399 AromaticContact CZ-CE2 3.53Å; F218-W399 AromaticContact CZ-CZ2 3.78Å; F218-W399 HydrophobicContact CZ-CZ2 3.78Å; F218-W399 AromaticContact CZ-NE1 3.5Å; F218-W399 PolarHBondContact O-NE1 2.77Å; L220-W399 HydrophobicContact CD1-CH2 3.79Å; L220-W399 HydrophobicContact CD1-CZ2 4.4Å; L220-W399 HydrophobicContact CG-CH2 3.94Å; L220-W399 HydrophobicContact CG-CZ2 4.08Å; L345-W399 HydrophobicContact CD1-CH2 4.08Å; L345-W399 HydrophobicContact CD1-CZ3 3.69Å; L366-W399 HydrophobicContact CD2-CH2 3.35Å; L366-W399 HydrophobicContact CD2-CZ2 4.3Å; L366-W399 HydrophobicContact CD2-CZ3 3.55Å; H368-W399 VanDerWaalsContact CA-CG 3.42Å; H368-W399 VanDerWaalsContact N-CD2 3.32Å; H368-W399 VanDerWaalsContact N-CE2 3.34Å; L369-W399 HydrophobicContact CB-CE3 3.65Å; L369-W399 HydrophobicContact CB-CZ3 3.77Å; L369-W399 VanDerWaalsContact N-CE3 3.3Å; L369-W399 WeakPolarHBondContact O-CB 3.3Å; L369-W399 PolarHBondContact O-N 3.08Å; N370-W399 PolarHBondContact OD1-N 3.4Å; F397-W399 HydrophobicContact CE1-CE3 4.25Å; W399-I404 HydrophobicContact CD2-CD1 4.11Å; W399-I404 HydrophobicContact CE3-CD1 3.59Å; W399-I404 HydrophobicContact CH2-CD1 3.8Å; W399-I404 HydrophobicContact CZ2-CD1 4.29Å; W399-I404 HydrophobicContact CZ3-CD1 3.43Å; W399-I404 VanDerWaalsContact CZ3-CD1 3.43Å
400	T	91.7	Very high	90.3	Very high	19 Å²	19	53.3 Å²	53.3	12%	0.117	30%	0.304	C	S	.	.			trans	-140.9	148.9	175.5	67.6	0	0	0	0	109.8	D216 S398 S402 N403	D216-T400 WeakPolarHBondContact OD1-CA 3.44Å; D216-T400 WeakPolarHBondContact OD1-CB 3.37Å; D216-T400 WeakPolarHBondContact OD1-CG2 3.48Å; S398-T400 PolarHBondContact O-N 3.41Å; T400-S402 PolarHBondContact O-N 3.25Å; T400-S402 PolarHBondContact OG1-OG 2.9Å; T400-N403 PolarHBondContact O-N 3.47Å; T400-N403 PolarHBondContact OG1-ND2 3.11Å; T400-N403 VanDerWaalsContact OG1-ND2 3.15Å
401	E	88.1	Confident	91.4	Very high	73 Å²	73	47.8 Å²	47.8	34%	0.341	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-58.8	-32.5	177.8	-80.5	-179	-175	0	0	112.3	A215 F218 N403 I404 K412	A215-E401 VanDerWaalsContact O-CD 3.26Å; A215-E401 WeakPolarHBondContact O-CG 3.27Å; F218-E401 HydrophobicContact CD1-CG 3.78Å; F218-E401 HydrophobicContact CE1-CB 4.41Å; F218-E401 HydrophobicContact CE1-CG 3.64Å; F218-E401 HydrophobicContact CG-CG 4.45Å; F218-E401 HydrophobicContact CZ-CG 4.17Å; E401-N403 PolarHBondContact O-N 3.45Å; E401-I404 PolarHBondContact O-N 3.32Å; E401-K412 HydrophobicContact CG-CD 4.34Å; E401-K412 IonicContact OE1-NZ 2.63Å; E401-K412 PolarHBondContact OE1-NZ 3.04Å; E401-K412 IonicContact OE2-NZ 3.78Å; E401-K412 PolarHBondContact OE2-NZ 3.49Å; E401-K412 VanDerWaalsContact OE2-NZ 3.14Å
402	S	90.3	Very high	92.4	Very high	75 Å²	75	50.7 Å²	50.7	52%	0.524	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-63.2	-26.6	178.6	63.4	0	0	0	0	112.9	K234 T400	K234-S402 VanDerWaalsContact CD-O 3.23Å; K234-S402 WeakPolarHBondContact CD-O 3.49Å; K234-S402 WeakPolarHBondContact CE-O 3.47Å; K234-S402 PolarHBondContact NZ-O 2.9Å; T400-S402 PolarHBondContact O-N 3.25Å; T400-S402 PolarHBondContact OG1-OG 2.9Å
403	N	92.8	Very high	93	Very high	24 Å²	24	52.1 Å²	52.1	13%	0.128	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-93.5	-5.6	-172.6	-71	-7.9	0	0	0	113.7	A233 K234 F397 S398 T400 E401	A233-N403 CarbonylContact C-O 3.58Å; A233-N403 WeakPolarHBondContact CA-O 3.43Å; K234-N403 PolarHBondContact N-O 2.66Å; F397-N403 HydrophobicContact CE2-CB 4.22Å; S398-N403 PolarHBondContact O-ND2 2.98Å; S398-N403 PolarHBondContact OG-ND2 3.02Å; T400-N403 PolarHBondContact O-N 3.47Å; T400-N403 PolarHBondContact OG1-ND2 3.11Å; T400-N403 VanDerWaalsContact OG1-ND2 3.15Å; E401-N403 PolarHBondContact O-N 3.45Å
404	I	95.4	Very high	93	Very high	13 Å²	13	53.5 Å²	53.5	7%	0.067	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137	-171.4	-57.1	-179.6	0	0	0	110.5	F218 L220 A231 K232 L345 F397 W399 E401 I406	F218-I404 HydrophobicContact CE2-CD1 4.34Å; F218-I404 HydrophobicContact CZ-CD1 3.92Å; L220-I404 HydrophobicContact CD1-CG2 4.36Å; A231-I404 HydrophobicContact CB-CG2 3.66Å; K232-I404 WeakPolarHBondContact O-CA 3.27Å; L345-I404 HydrophobicContact CD1-CD1 4.32Å; F397-I404 HydrophobicContact CZ-CD1 4.09Å; F397-I404 HydrophobicContact CZ-CG1 3.95Å; W399-I404 HydrophobicContact CD2-CD1 4.11Å; W399-I404 HydrophobicContact CE3-CD1 3.59Å; W399-I404 HydrophobicContact CH2-CD1 3.8Å; W399-I404 HydrophobicContact CZ2-CD1 4.29Å; W399-I404 HydrophobicContact CZ3-CD1 3.43Å; W399-I404 VanDerWaalsContact CZ3-CD1 3.43Å; E401-I404 PolarHBondContact O-N 3.32Å; I404-I406 HydrophobicContact CG2-CG1 4.4Å
405	E	96.2	Very high	92.5	Very high	79 Å²	79	53.4 Å²	53.4	37%	0.369	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132	169.9	-67.6	176.9	178.9	0	0	109.1	A231 K232 K234 F407	A231-E405 CarbonylContact C-O 3.19Å; A231-E405 WeakPolarHBondContact CA-O 3.36Å; K232-E405 PolarHBondContact N-O 2.78Å; K232-E405 PolarHBondContact O-N 2.83Å; K234-E405 HydrophobicContact CD-CG 3.98Å; K234-E405 WeakPolarHBondContact CD-OE1 3.46Å; K234-E405 VanDerWaalsContact CE-OE1 3.24Å; K234-E405 WeakPolarHBondContact CE-OE1 3.47Å; K234-E405 HydrophobicContact CG-CG 3.68Å; K234-E405 WeakPolarHBondContact CG-OE1 3.46Å; E405-F407 HydrophobicContact CB-CD2 4.42Å; E405-F407 HydrophobicContact CB-CE2 3.49Å; E405-F407 VanDerWaalsContact CB-CE2 3.49Å; E405-F407 HydrophobicContact CB-CZ 3.89Å
406	I	96.6	Very high	91.7	Very high	69 Å²	69	53.5 Å²	53.5	35%	0.354	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.5	-175.1	-55.3	173	0	0	0	109.3	L220 A231 I404 A410 K412	L220-I406 HydrophobicContact CD2-CD1 3.52Å; L220-I406 HydrophobicContact CD2-CG1 4.09Å; A231-I406 HydrophobicContact CB-CG1 4.48Å; I404-I406 HydrophobicContact CG2-CG1 4.4Å; I406-A410 HydrophobicContact CG2-CB 3.83Å; I406-A410 WeakPolarHBondContact CG2-O 3.37Å; I406-K412 HydrophobicContact CD1-CB 4.16Å
407	F	97.4	Very high	90.4	Very high	72 Å²	72	54.1 Å²	54.1	32%	0.316	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	157	-177.9	-62	-87.4	0	0	0	111.5	Y230 K232 E405 G409	Y230-F407 HydrophobicContact CD1-CB 3.77Å; Y230-F407 HydrophobicContact CD2-CD2 4.04Å; Y230-F407 HydrophobicContact CE1-CB 3.43Å; Y230-F407 VanDerWaalsContact CE1-CB 3.43Å; Y230-F407 HydrophobicContact CE1-CD2 4.22Å; Y230-F407 AromaticContact CE1-CG 3.89Å; Y230-F407 HydrophobicContact CE1-CG 3.89Å; Y230-F407 HydrophobicContact CE2-CB 4.24Å; Y230-F407 AromaticContact CE2-CD2 3.48Å; Y230-F407 HydrophobicContact CE2-CD2 3.48Å; Y230-F407 VanDerWaalsContact CE2-CD2 3.48Å; Y230-F407 HydrophobicContact CE2-CE2 4.07Å; Y230-F407 HydrophobicContact CE2-CG 4.01Å; Y230-F407 HydrophobicContact CG-CB 4.29Å; Y230-F407 AromaticContact CZ-CD2 3.58Å; Y230-F407 AromaticContact CZ-CG 3.6Å; Y230-F407 PolarHBondContact N-O 2.86Å; Y230-F407 PolarHBondContact O-N 2.88Å; K232-F407 HydrophobicContact CB-CD2 4.39Å; K232-F407 HydrophobicContact CB-CE2 3.91Å; E405-F407 HydrophobicContact CB-CD2 4.42Å; E405-F407 HydrophobicContact CB-CE2 3.49Å; E405-F407 VanDerWaalsContact CB-CE2 3.49Å; E405-F407 HydrophobicContact CB-CZ 3.89Å; F407-G409 PolarHBondContact O-N 3.46Å; F407-G409 VanDerWaalsContact O-N 3.13Å
408	G	94.9	Very high	89.3	Confident	42 Å²	42	55.7 Å²	55.7	43%	0.433	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	3.2	171.3	0	0	0	0	0	116.4	Y228 M229	Y228-G408 WeakPolarHBondContact CE2-O 3.39Å; Y228-G408 WeakPolarHBondContact O-CA 3.5Å; M229-G408 WeakPolarHBondContact CG-O 3.25Å
409	G	92.4	Very high	87.8	Confident	56 Å²	56	57.7 Å²	57.7	58%	0.577	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	17.6	178	0	0	0	0	0	115	F407 T411	F407-G409 PolarHBondContact O-N 3.46Å; F407-G409 VanDerWaalsContact O-N 3.13Å; G409-T411 PolarHBondContact O-N 3.09Å
410	A	93.6	Very high	85.7	Confident	11 Å²	11	60 Å²	60	9%	0.091	34%	0.344	C	S	.	.			trans	-57.2	139.6	164	0	0	0	0	0	109.7	F222 I406	F222-A410 HydrophobicContact CD1-CB 3.96Å; F222-A410 HydrophobicContact CE1-CB 3.78Å; F222-A410 HydrophobicContact CZ-CB 4.46Å; I406-A410 HydrophobicContact CG2-CB 3.83Å; I406-A410 WeakPolarHBondContact CG2-O 3.37Å
411	T	92.2	Very high	83.8	Confident	56 Å²	56	63.3 Å²	63.3	34%	0.344	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	150.3	-172.1	56.6	0	0	0	0	111	L220 T221 G409 W413	L220-T411 WeakPolarHBondContact CA-O 3.43Å; T221-T411 WeakPolarHBondContact CB-OG1 3.34Å; T221-T411 PolarHBondContact N-O 2.84Å; T221-T411 PolarHBondContact O-N 3.36Å; G409-T411 PolarHBondContact O-N 3.09Å; T411-W413 PolarHBondContact OG1-NE1 3.48Å; T411-W413 VanDerWaalsContact OG1-NE1 3.14Å
412	K	92.7	Very high	81.2	Confident	90 Å²	90	70.2 Å²	70.2	39%	0.391	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.6	178.2	-177.1	178.5	62.9	166.3	0	109.2	F218 Q219 L220 E401 I406	F218-K412 HydrophobicContact CB-CD 4.12Å; F218-K412 HydrophobicContact CB-CG 3.92Å; F218-K412 HydrophobicContact CD2-CD 3.72Å; F218-K412 HydrophobicContact CD2-CG 3.7Å; F218-K412 HydrophobicContact CE2-CD 4.32Å; F218-K412 HydrophobicContact CG-CD 3.94Å; F218-K412 HydrophobicContact CG-CG 4.07Å; Q219-K412 WeakPolarHBondContact O-CA 3.19Å; L220-K412 HydrophobicContact CD2-CB 4.3Å; L220-K412 HydrophobicContact CD2-CG 4.45Å; E401-K412 HydrophobicContact CG-CD 4.34Å; E401-K412 IonicContact OE1-NZ 2.63Å; E401-K412 PolarHBondContact OE1-NZ 3.04Å; E401-K412 IonicContact OE2-NZ 3.78Å; E401-K412 PolarHBondContact OE2-NZ 3.49Å; E401-K412 VanDerWaalsContact OE2-NZ 3.14Å; I406-K412 HydrophobicContact CD1-CB 4.16Å
413	W	88.3	Confident	80.8	Confident	158 Å²	158	70 Å²	70	60%	0.598	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	156.4	177.1	-60.7	93.9	0	0	0	110.4	F218 Q219 T411	F218-W413 CarbonylContact C-O 3.43Å; F218-W413 WeakPolarHBondContact CA-O 3.24Å; F218-W413 VanDerWaalsContact CB-O 3.31Å; F218-W413 WeakPolarHBondContact CB-O 3.46Å; Q219-W413 HydrophobicContact CG-CB 3.78Å; Q219-W413 PolarHBondContact N-O 2.89Å; Q219-W413 PolarHBondContact O-N 3.05Å; T411-W413 PolarHBondContact OG1-NE1 3.48Å; T411-W413 VanDerWaalsContact OG1-NE1 3.14Å
414	T	86.3	Confident	80.1	Confident	128 Å²	128	72.4 Å²	72.4	79%	0.785	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	134.7	172	50.1	0	0	0	0	109.9	R217	R217-T414 WeakPolarHBondContact O-CA 3.37Å
415	F	81.7	Confident	79.3	Confident	5 Å²	5	75.7 Å²	75.7	2%	0.022	43%	0.427	C	S	.	.			trans	-135.5	127.2	177.9	177.6	-113	0	0	0	110.2	R217 Q219 W248 W302 A367 H368 P417 S420	R217-F415 CarbonylContact C-O 3.57Å; R217-F415 VanDerWaalsContact C-O 3.26Å; R217-F415 WeakPolarHBondContact CA-O 3.38Å; R217-F415 WeakPolarHBondContact CB-O 3.29Å; R217-F415 PolarHBondContact O-N 3.41Å; Q219-F415 HydrophobicContact CB-CB 3.71Å; Q219-F415 HydrophobicContact CB-CG 4.14Å; Q219-F415 HydrophobicContact CG-CB 3.92Å; W248-F415 HydrophobicContact CB-CE1 4.23Å; W248-F415 HydrophobicContact CB-CZ 4.45Å; W248-F415 HydrophobicContact CG-CE1 4.3Å; W302-F415 AromaticContact CD2-CE2 3.73Å; W302-F415 HydrophobicContact CD2-CE2 3.73Å; W302-F415 AromaticContact CD2-CZ 3.82Å; W302-F415 HydrophobicContact CD2-CZ 3.82Å; W302-F415 AromaticContact CE2-CD2 3.99Å; W302-F415 AromaticContact CE2-CE2 3.32Å; W302-F415 AromaticContact CE2-CZ 3.87Å; W302-F415 HydrophobicContact CE3-CE2 4.24Å; W302-F415 AromaticContact CE3-CZ 3.93Å; W302-F415 HydrophobicContact CE3-CZ 3.93Å; W302-F415 HydrophobicContact CG-CE2 4.23Å; W302-F415 HydrophobicContact CG-CZ 4.39Å; W302-F415 HydrophobicContact CH2-CD2 4.26Å; W302-F415 HydrophobicContact CH2-CE2 4.01Å; W302-F415 HydrophobicContact CH2-CZ 4.14Å; W302-F415 AromaticContact CZ2-CD2 3.73Å; W302-F415 HydrophobicContact CZ2-CD2 3.73Å; W302-F415 AromaticContact CZ2-CE2 3.49Å; W302-F415 HydrophobicContact CZ2-CE2 3.49Å; W302-F415 VanDerWaalsContact CZ2-CE2 3.49Å; W302-F415 HydrophobicContact CZ2-CZ 4.05Å; W302-F415 HydrophobicContact CZ3-CE2 4.36Å; W302-F415 HydrophobicContact CZ3-CZ 4.08Å; W302-F415 AromaticContact NE1-CE2 3.58Å; A367-F415 HydrophobicContact CB-CD1 3.29Å; A367-F415 HydrophobicContact CB-CE1 3.54Å; A367-F415 HydrophobicContact CB-CG 4.04Å; A367-F415 HydrophobicContact CB-CZ 4.49Å; H368-F415 AromaticContact CD2-CD1 3.58Å; H368-F415 AromaticContact CD2-CE1 3.68Å; H368-F415 AromaticContact NE2-CD1 3.77Å; F415-P417 HydrophobicContact CD1-CG 3.99Å; F415-P417 HydrophobicContact CE1-CB 4.13Å; F415-P417 HydrophobicContact CE1-CG 3.61Å; F415-P417 HydrophobicContact CZ-CB 4.49Å; F415-P417 HydrophobicContact CZ-CG 4.4Å; F415-S420 WeakPolarHBondContact CE2-OG 2.94Å
416	E	76.8	Confident	78.3	Confident	95 Å²	95	75.5 Å²	75.5	44%	0.444	43%	0.43	S	S	.	.			trans	-112.5	111.4	169.4	-71.4	-163.3	155.2	0	0	108.6	R217 S419 S420	R217-E416 IonicContact CZ-OE1 3.14Å; R217-E416 IonicContact NH1-OE1 3.61Å; R217-E416 PolarHBondContact NH1-OE1 3.06Å; E416-S419 WeakPolarHBondContact CB-OG 3.41Å; E416-S419 PolarHBondContact O-OG 3.41Å; E416-S420 PolarHBondContact O-OG 3.18Å; E416-S420 VanDerWaalsContact O-OG 3.09Å
417	P	68.7	Low	77.1	Confident	31 Å²	31	75.9 Å²	75.9	20%	0.201	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	144.1	170.7	-25.2	33.8	0	0	0	111.1	W248 H368 C387 F415 S419	W248-P417 HydrophobicContact CZ2-CB 4.47Å; H368-P417 WeakPolarHBondContact CD2-CG 3.36Å; H368-P417 WeakPolarHBondContact NE2-CD 3.01Å; H368-P417 WeakPolarHBondContact NE2-CG 3.37Å; C387-P417 HydrophobicContact CB-CB 4.33Å; C387-P417 WeakPolarHBondContact SG-CB 3.32Å; F415-P417 HydrophobicContact CD1-CG 3.99Å; F415-P417 HydrophobicContact CE1-CB 4.13Å; F415-P417 HydrophobicContact CE1-CG 3.61Å; F415-P417 HydrophobicContact CZ-CB 4.49Å; F415-P417 HydrophobicContact CZ-CG 4.4Å; P417-S419 PolarHBondContact O-N 3.32Å
418	C	70.9	Confident	75.8	Confident	39 Å²	39	76.1 Å²	76.1	26%	0.264	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	-12.3	175	-57.5	0	0	0	0	118.3	A385 C387 I421	A385-C418 PolarHBondContact O-SG 3.27Å; A385-C418 VanDerWaalsContact O-SG 3.41Å; C387-C418 HydrophobicContact CB-CB 3.58Å; C387-C418 WeakPolarHBondContact CB-SG 3.33Å; C387-C418 WeakPolarHBondContact SG-CB 3.17Å; C387-C418 PolarHBondContact SG-N 3.39Å; C387-C418 CovalentContact SG-SG 2.01Å; C387-C418 PolarHBondContact SG-SG 3.37Å; C418-I421 HydrophobicContact CB-CD1 4.29Å
419	S	62.8	Low	74.4	Confident	68 Å²	68	78.6 Å²	78.6	48%	0.476	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-23.3	165.1	61.4	0	0	0	0	112.1	E416 P417	E416-S419 WeakPolarHBondContact CB-OG 3.41Å; E416-S419 PolarHBondContact O-OG 3.41Å; P417-S419 PolarHBondContact O-N 3.32Å
420	S	50.3	Low	73.1	Confident	56 Å²	56	80.3 Å²	80.3	39%	0.392	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	2.9	179.6	48.9	0	0	0	0	114.7	F415 E416	F415-S420 WeakPolarHBondContact CE2-OG 2.94Å; E416-S420 PolarHBondContact O-OG 3.18Å; E416-S420 VanDerWaalsContact O-OG 3.09Å
421	I	52	Low	71.3	Confident	90 Å²	90	86.1 Å²	86.1	46%	0.462	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-9.6	179.5	-58	176.2	0	0	0	111.7	W248 C418	W248-I421 HydrophobicContact CH2-CD1 3.41Å; W248-I421 VanDerWaalsContact CH2-CD1 3.41Å; W248-I421 HydrophobicContact CZ3-CD1 3.55Å; W248-I421 HydrophobicContact CZ3-CG1 4.42Å; C418-I421 HydrophobicContact CB-CD1 4.29Å
422	N	33.5	Very low	69.4	Low	217 Å²	217	88.8 Å²	88.8	100%	1.16	47%	0.472	S	S	*	.			trans	-91	0	178.1	-89.1	-12.6	0	0	0	113.5

Retrieved 422 of 422 residues in 300.7 ms (Link to these results)

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