A0A087WZQ2_HUMAN Loading...

Zinc finger protein 343

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087WZQ2, Species HUMAN (Homo sapiens, Human), Gene ZNF343, Length 640 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.5	Very low	29.7	Very low	242 Å²	242	143.5 Å²	143.5	100%	1.192	81%	0.811	S	S	*	*				0	134.9	0	-70.8	168	173.6	0	0	107.4
2	M	22.1	Very low	30.4	Very low	194 Å²	194	147.4 Å²	147.4	96%	0.956	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72	144.7	177	-73.6	-173.4	168.3	0	0	110.5
3	L	24.9	Very low	30.7	Very low	166 Å²	166	149.4 Å²	149.4	87%	0.869	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-93.9	138.9	169.5	-67.8	170.7	0	0	0	109
4	P	27.7	Very low	30.9	Very low	118 Å²	118	148.8 Å²	148.8	77%	0.766	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.8	155.3	177.2	31	-34.5	0	0	0	112.1
5	Y	24.1	Very low	31.2	Very low	207 Å²	207	149.5 Å²	149.5	81%	0.812	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-69.6	127.7	179.9	-140.9	-103	0	0	0	110.8	S7	Y5-S7 VanDerWaalsContact C-N 3.26Å; Y5-S7 PolarHBondContact O-N 3Å
6	P	30.3	Very low	31.6	Very low	126 Å²	126	151.2 Å²	151.2	82%	0.818	79%	0.788	S	S	*	*	S	Bend	trans	-80.3	71.7	179.7	32.9	-35.2	0	0	0	111.4
7	S	31.1	Very low	31.9	Very low	104 Å²	104	148.5 Å²	148.5	73%	0.727	77%	0.773	S	S	*	*			trans	-115.5	22.4	169.6	54.2	0	0	0	0	112.2	Y5	Y5-S7 VanDerWaalsContact C-N 3.26Å; Y5-S7 PolarHBondContact O-N 3Å
8	A	34	Very low	32	Very low	92 Å²	92	145.7 Å²	145.7	76%	0.76	76%	0.758	S	S	*	*			trans	-130.2	38.8	-171.1	0	0	0	0	0	113.4
9	L	33.5	Very low	31.9	Very low	154 Å²	154	143.9 Å²	143.9	81%	0.806	75%	0.749	S	S	*	*			trans	-122.7	105.1	165	-71.8	173	0	0	0	107.8
10	G	32.7	Very low	31.9	Very low	57 Å²	57	143.1 Å²	143.1	59%	0.588	75%	0.753	S	S	*	*			trans	-70.4	155.4	-176.2	0	0	0	0	0	113.3	Q12 Y13	G10-Q12 PolarHBondContact O-N 2.69Å; G10-Y13 PolarHBondContact O-N 2.93Å
11	D	38	Very low	32	Very low	118 Å²	118	145.4 Å²	145.4	63%	0.631	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-62.6	-8.6	-170.9	-81.5	-64.5	0	0	0	115.8	Y13 K88	D11-Y13 VanDerWaalsContact C-N 3.34Å; D11-Y13 PolarHBondContact O-N 3.46Å; D11-K88 IonicContact OD1-NZ 3.45Å; D11-K88 PolarHBondContact OD1-NZ 3.13Å
12	Q	37.5	Very low	32.2	Very low	191 Å²	191	140.9 Å²	140.9	89%	0.893	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-77.6	-8.9	-179.9	-74.6	-178.2	-33.4	0	0	115.2	G10	G10-Q12 PolarHBondContact O-N 2.69Å
13	Y	34.9	Very low	33.1	Very low	173 Å²	173	135 Å²	135	68%	0.678	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-89.5	-3.8	-179.5	-155.3	-102.7	0	0	0	114.5	G10 D11 I17	G10-Y13 PolarHBondContact O-N 2.93Å; D11-Y13 VanDerWaalsContact C-N 3.34Å; D11-Y13 PolarHBondContact O-N 3.46Å; Y13-I17 HydrophobicContact CD1-CD1 4.42Å; Y13-I17 HydrophobicContact CE1-CD1 4.29Å
14	W	33.8	Very low	33.5	Very low	141 Å²	141	135 Å²	135	53%	0.534	72%	0.723	S	S	.	*	S	Bend	trans	-97.9	-15.9	-174.2	-79	104.1	0	0	0	115.3
15	E	35.4	Very low	33.9	Very low	159 Å²	159	135.6 Å²	135.6	74%	0.743	72%	0.719	S	S	*	*	S	Bend	trans	-80.7	-24	-176.3	-65.5	-165.1	145.6	0	0	114
16	E	36.3	Very low	34.5	Very low	177 Å²	177	130.4 Å²	130.4	83%	0.827	71%	0.709	S	S	*	*	S	Bend	trans	-82.2	-18.2	178.9	-73.3	-160.5	125.4	0	0	114.8
17	I	37.9	Very low	34.5	Very low	106 Å²	106	129.7 Å²	129.7	54%	0.544	70%	0.695	S	S	.	*	S	Bend	trans	-83	-15.2	-173.9	-63.6	177.3	0	0	0	112.5	Y13	Y13-I17 HydrophobicContact CD1-CD1 4.42Å; Y13-I17 HydrophobicContact CE1-CD1 4.29Å
18	L	32.7	Very low	34.6	Very low	97 Å²	97	129.1 Å²	129.1	51%	0.508	69%	0.687	S	S	.	*	S	Bend	trans	-119.3	8.2	-164.9	-68.3	174.8	0	0	0	116.4
19	L	29.8	Very low	34.5	Very low	112 Å²	112	131.9 Å²	131.9	59%	0.586	69%	0.686	S	S	*	*			trans	-116.2	119.1	174.5	-74.4	172.3	0	0	0	112.1	K21	L19-K21 PolarHBondContact O-N 3.38Å
20	P	32.9	Very low	34.5	Very low	128 Å²	128	130.5 Å²	130.5	83%	0.831	67%	0.673	S	S	*	*			trans	-77.4	115.2	178.4	30.2	-32.2	0	0	0	111.3
21	K	33.3	Very low	34.5	Very low	191 Å²	191	136.2 Å²	136.2	83%	0.83	68%	0.682	S	S	*	*			trans	-84.7	118.3	166.1	-73.8	-178.7	178.9	170.7	0	110.6	L19	L19-K21 PolarHBondContact O-N 3.38Å
22	N	33.9	Very low	34.1	Very low	148 Å²	148	138 Å²	138	79%	0.791	69%	0.691	S	S	*	*			trans	69.8	133.8	163.9	-57.8	-0.7	0	0	0	118.4	E24	N22-E24 PolarHBondContact O-N 3.19Å
23	G	40.8	Very low	33.8	Very low	71 Å²	71	135 Å²	135	73%	0.732	69%	0.685	S	S	*	*	S	Bend	trans	-94.4	30.6	-164.4	0	0	0	0	0	117.1
24	E	33.5	Very low	33.6	Very low	166 Å²	166	135.2 Å²	135.2	78%	0.776	69%	0.693	S	S	*	*			trans	-93.5	-11.7	-171	-65.9	-173.4	129.1	0	0	115.2	N22 V26	N22-E24 PolarHBondContact O-N 3.19Å; E24-V26 PolarHBondContact O-N 2.99Å
25	N	36	Very low	33.2	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	70%	0.704	S	S	*	*	H	α-helix	trans	-86.4	5	-176.9	-94	-46.1	0	0	0	115.8
26	V	35.2	Very low	32.9	Very low	98 Å²	98	136.3 Å²	136.3	59%	0.594	71%	0.708	S	S	*	*	H	α-helix	trans	-83.1	-28.7	178.8	-179.6	0	0	0	0	112	E24	E24-V26 PolarHBondContact O-N 2.99Å
27	E	32.1	Very low	32.5	Very low	112 Å²	112	137.5 Å²	137.5	52%	0.523	71%	0.71	S	S	.	*	H	α-helix	trans	-86.2	-28.4	-173.6	-154.5	57	-151.7	0	0	112.9	M29 K30	E27-M29 VanDerWaalsContact C-N 3.31Å; E27-M29 PolarHBondContact O-N 3.29Å; E27-K30 IonicContact OE1-NZ 3.49Å; E27-K30 IonicContact OE2-NZ 3.81Å; E27-K30 PolarHBondContact OE2-NZ 3.17Å
28	T	33	Very low	32.1	Very low	91 Å²	91	136.3 Å²	136.3	56%	0.558	72%	0.717	S	S	*	*	H	α-helix	trans	-64.9	-33	174.8	1.1	0	0	0	0	112.5
29	M	30.8	Very low	31.9	Very low	150 Å²	150	141.8 Å²	141.8	74%	0.739	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-82.1	-17.6	-175.6	-135	175.3	-69.2	0	0	113.8	E27 K31	E27-M29 VanDerWaalsContact C-N 3.31Å; E27-M29 PolarHBondContact O-N 3.29Å; M29-K31 VanDerWaalsContact C-N 3.33Å; M29-K31 PolarHBondContact O-N 3.2Å
30	K	33.9	Very low	31.6	Very low	125 Å²	125	140 Å²	140	54%	0.543	75%	0.745	S	S	.	*	G	3₁₀ helix	trans	-75	-17.1	176.2	-72.2	178.9	-170.5	156.1	0	114.2	E27 L32	E27-K30 IonicContact OE1-NZ 3.49Å; E27-K30 IonicContact OE2-NZ 3.81Å; E27-K30 PolarHBondContact OE2-NZ 3.17Å; K30-L32 VanDerWaalsContact C-N 3.35Å; K30-L32 PolarHBondContact O-N 3.13Å
31	K	33.1	Very low	31.2	Very low	178 Å²	178	142.2 Å²	142.2	77%	0.774	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-83	0.2	-172.7	-74.1	-175.2	176	177.3	0	115.5	M29	M29-K31 VanDerWaalsContact C-N 3.33Å; M29-K31 PolarHBondContact O-N 3.2Å
32	L	30.2	Very low	31.3	Very low	155 Å²	155	138 Å²	138	81%	0.812	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-101.6	2.9	-174.8	-80.3	167.3	0	0	0	115.7	K30	K30-L32 VanDerWaalsContact C-N 3.35Å; K30-L32 PolarHBondContact O-N 3.13Å
33	T	30	Very low	30.9	Very low	127 Å²	127	135.4 Å²	135.4	78%	0.779	74%	0.735	S	S	*	*			trans	-131.2	51.2	-175.8	52.4	0	0	0	0	114.7
34	Q	30.3	Very low	30.1	Very low	178 Å²	178	138.9 Å²	138.9	83%	0.832	74%	0.737	S	S	*	*			trans	-132.5	114.6	161.5	-79	-173.4	-17	0	0	111
35	N	26.8	Very low	29.7	Very low	144 Å²	144	137.4 Å²	137.4	77%	0.77	73%	0.734	S	S	*	*			trans	167.5	105.9	133.7	-88.1	-26.4	0	0	0	113
36	H	29.1	Very low	29.2	Very low	180 Å²	180	137.6 Å²	137.6	83%	0.833	74%	0.74	S	S	*	*				161.9	137.2	115.9	-92.3	-69.3	0	0	0	115.9
37	K	26.5	Very low	28.8	Very low	201 Å²	201	140.7 Å²	140.7	87%	0.874	75%	0.753	S	S	*	*			trans	-134.9	160.8	169.4	-93.7	-178.8	171.1	177.4	0	106.7
38	A	30.1	Very low	28.5	Very low	82 Å²	82	140.4 Å²	140.4	68%	0.678	76%	0.763	S	S	*	*			cis	-163	175	-14.4	0	0	0	0	0	106.9
39	K	28.6	Very low	28.7	Very low	212 Å²	212	141.3 Å²	141.3	92%	0.922	77%	0.77	S	S	*	*				163.1	157.1	99	-86.1	175.1	175.5	178.5	0	110.2
40	G	23.7	Very low	28.7	Very low	75 Å²	75	143.7 Å²	143.7	77%	0.773	78%	0.779	S	S	*	*			trans	135	128.1	155.8	0	0	0	0	0	117.2
41	L	24.9	Very low	28.5	Very low	174 Å²	174	146.4 Å²	146.4	91%	0.911	79%	0.791	S	S	*	*			trans	-135.8	177	175.4	-115	91.7	0	0	0	108.5
42	P	34.1	Very low	28.5	Very low	101 Å²	101	148.1 Å²	148.1	66%	0.656	80%	0.798	S	S	*	*			cis	-137	177.9	3.9	41.7	-23	0	0	0	117.3
43	S	26	Very low	28.5	Very low	95 Å²	95	148.8 Å²	148.8	66%	0.664	80%	0.797	S	S	*	*			trans	21.3	140.3	148.6	59.2	0	0	0	0	122.4
44	N	23.5	Very low	28.8	Very low	144 Å²	144	146.7 Å²	146.7	77%	0.77	80%	0.801	S	S	*	*			cis	-162.9	153	46	-114.6	-5.2	0	0	0	114.8
45	D	25.4	Very low	28.8	Very low	134 Å²	134	147.9 Å²	147.9	72%	0.717	80%	0.804	S	S	*	*			trans	47.8	137.1	149.7	-69.4	-37.9	0	0	0	128.5
46	T	26.9	Very low	29	Very low	134 Å²	134	145.6 Å²	145.6	82%	0.822	80%	0.804	S	S	*	*			trans	73.6	100.5	149.2	43	0	0	0	0	124
47	D	26.3	Very low	29.2	Very low	163 Å²	163	145.3 Å²	145.3	87%	0.872	80%	0.803	S	S	*	*			trans	94.6	146.5	131.4	-149.2	12.8	0	0	0	120.9
48	C	25.7	Very low	29.4	Very low	106 Å²	106	143.1 Å²	143.1	72%	0.716	80%	0.8	S	S	*	*			trans	77.5	175.6	173.4	-131.9	0	0	0	0	116.6
49	P	37.4	Very low	29.8	Very low	109 Å²	109	144.5 Å²	144.5	71%	0.708	80%	0.799	S	S	*	*				-123.2	142.5	-98.6	39.2	-25.6	0	0	0	114.1
50	Q	30.2	Very low	30.3	Very low	201 Å²	201	139.9 Å²	139.9	94%	0.939	79%	0.789	S	S	*	*			trans	-100.9	118	-175.8	-68.6	-159.1	-32.7	0	0	116.6
51	K	29.1	Very low	31.8	Very low	181 Å²	181	140.9 Å²	140.9	79%	0.787	78%	0.782	S	S	*	*			trans	-53.2	161.5	166.7	-69.3	163.5	173.4	169.5	0	112.5
52	K	33	Very low	33.1	Very low	214 Å²	214	137 Å²	137	93%	0.93	77%	0.765	S	S	*	*			trans	-84.2	110.9	159.9	-67.7	-178.7	176.7	-174.9	0	109.4
53	E	30.7	Very low	34.5	Very low	169 Å²	169	135.4 Å²	135.4	79%	0.79	75%	0.753	S	S	*	*			trans	-96.4	142.9	161.5	-68.5	-177.3	164.4	0	0	109.6	K55	E53-K55 PolarHBondContact O-N 3.38Å
54	G	36.6	Very low	36	Very low	83 Å²	83	134.6 Å²	134.6	86%	0.856	74%	0.738	S	S	*	*			trans	-76.9	109.1	-179.6	0	0	0	0	0	110.5	A56	G54-A56 PolarHBondContact O-N 2.92Å
55	K	29.3	Very low	37.8	Very low	204 Å²	204	137.3 Å²	137.3	89%	0.887	74%	0.737	S	S	*	*			trans	-68.5	119.8	161.9	-73.7	-171.1	174.4	-173.7	0	108.3	E53 Q57	E53-K55 PolarHBondContact O-N 3.38Å; K55-Q57 PolarHBondContact O-N 3Å
56	A	31.4	Very low	39.8	Very low	95 Å²	95	136.1 Å²	136.1	79%	0.785	73%	0.731	S	S	*	*			trans	-57.7	123.7	163.5	0	0	0	0	0	108.1	G54 I58	G54-A56 PolarHBondContact O-N 2.92Å; A56-I58 PolarHBondContact O-N 3.1Å
57	Q	33.6	Very low	41.4	Very low	174 Å²	174	132.2 Å²	132.2	81%	0.813	71%	0.707	S	S	*	*			trans	-81.7	104	-178.4	-170.3	166.3	2	0	0	108.1	K55 V59	K55-Q57 PolarHBondContact O-N 3Å; Q57-V59 VanDerWaalsContact C-N 3.32Å; Q57-V59 HydrophobicContact CG-CG2 4.19Å; Q57-V59 PolarHBondContact O-N 2.83Å
58	I	31.4	Very low	43.3	Very low	156 Å²	156	125.8 Å²	125.8	80%	0.8	67%	0.673	S	S	*	*			trans	-66.6	99	165.5	-59.8	175.4	0	0	0	106.1	A56 V60	A56-I58 PolarHBondContact O-N 3.1Å; I58-V60 HydrophobicContact CG2-CG2 4.48Å; I58-V60 PolarHBondContact O-N 3.33Å
59	V	37.7	Very low	45.4	Very low	110 Å²	110	124.8 Å²	124.8	67%	0.667	66%	0.664	S	S	*	*			trans	-78.9	108.1	169.7	179.9	0	0	0	0	106.5	Q57 P61	Q57-V59 VanDerWaalsContact C-N 3.32Å; Q57-V59 HydrophobicContact CG-CG2 4.19Å; Q57-V59 PolarHBondContact O-N 2.83Å; V59-P61 WeakPolarHBondContact O-CD 3.25Å
60	V	39.3	Very low	46.8	Very low	116 Å²	116	124.6 Å²	124.6	70%	0.703	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-75.5	118.5	164.7	-176.7	0	0	0	0	106.2	I58 V62	I58-V60 HydrophobicContact CG2-CG2 4.48Å; I58-V60 PolarHBondContact O-N 3.33Å; V60-V62 PolarHBondContact O-N 2.81Å
61	P	54.4	Low	48.6	Very low	96 Å²	96	118.4 Å²	118.4	62%	0.623	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-67.3	131.3	179.8	27.4	-33.3	0	0	0	109.8	V59 T63	V59-P61 WeakPolarHBondContact O-CD 3.25Å; P61-T63 PolarHBondContact O-N 3.39Å
62	V	52.7	Low	50.6	Low	92 Å²	92	113.7 Å²	113.7	56%	0.558	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-77.2	121.1	174.1	180	0	0	0	0	108.1	V60 D66 V67 L98	V60-V62 PolarHBondContact O-N 2.81Å; V62-D66 HydrophobicContact CG1-CB 4.17Å; V62-V67 HydrophobicContact CG1-CG1 4.12Å; V62-L98 HydrophobicContact CB-CD2 4.46Å; V62-L98 HydrophobicContact CG1-CD2 4.16Å
63	T	63.4	Low	51.6	Low	67 Å²	67	108.5 Å²	108.5	41%	0.411	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-93.8	162.8	179.9	75.3	0	0	0	0	111.1	P61 R65 D66	P61-T63 PolarHBondContact O-N 3.39Å; T63-R65 PolarHBondContact O-N 3.25Å; T63-R65 PolarHBondContact OG1-N 2.89Å; T63-D66 WeakPolarHBondContact CA-OD2 3.34Å; T63-D66 WeakPolarHBondContact CB-OD2 3.4Å; T63-D66 PolarHBondContact N-OD2 2.96Å; T63-D66 WeakPolarHBondContact O-CB 3.46Å; T63-D66 PolarHBondContact O-N 3.05Å; T63-D66 PolarHBondContact OG1-OD2 3.07Å
64	F	58.4	Low	52.9	Low	78 Å²	78	103.7 Å²	103.7	34%	0.342	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-58.3	-30.4	173.5	-173.7	-115.1	0	0	0	112.5	D66 V67 T68 M91 N94 Y95 L98	F64-D66 VanDerWaalsContact C-N 3.25Å; F64-D66 PolarHBondContact O-N 3.08Å; F64-V67 HydrophobicContact CD2-CG2 4.14Å; F64-V67 WeakPolarHBondContact O-CG2 3.5Å; F64-V67 PolarHBondContact O-N 2.78Å; F64-T68 WeakPolarHBondContact CD1-OG1 3.21Å; F64-T68 WeakPolarHBondContact CE1-OG1 3.29Å; F64-T68 WeakPolarHBondContact CZ-OG1 3.19Å; F64-T68 WeakPolarHBondContact O-CB 2.93Å; F64-T68 PolarHBondContact O-N 3.2Å; F64-T68 VanDerWaalsContact O-N 3.08Å; F64-T68 PolarHBondContact O-OG1 2.8Å; F64-M91 WeakPolarHBondContact CE2-O 3.49Å; F64-M91 HydrophobicContact CZ-CB 4.44Å; F64-N94 HydrophobicContact CE2-CB 4.41Å; F64-Y95 AromaticContact CD2-CD2 3.9Å; F64-Y95 HydrophobicContact CD2-CD2 3.9Å; F64-Y95 HydrophobicContact CE2-CD2 4.14Å; F64-Y95 HydrophobicContact CE2-CG 4.36Å; F64-Y95 HydrophobicContact CG-CD2 4.23Å; F64-L98 HydrophobicContact CB-CD1 4.14Å; F64-L98 HydrophobicContact CD2-CD1 3.9Å
65	R	61.5	Low	54.1	Low	201 Å²	201	104.2 Å²	104.2	76%	0.758	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-66.7	-26.1	178.1	-161.5	173.6	-173	166.9	2.6	112.8	T63 V67	T63-R65 PolarHBondContact O-N 3.25Å; T63-R65 PolarHBondContact OG1-N 2.89Å; R65-V67 VanDerWaalsContact C-N 3.3Å; R65-V67 PolarHBondContact O-N 3.05Å
66	D	65.6	Low	55.9	Low	110 Å²	110	98 Å²	98	59%	0.588	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-78.8	-12.8	178.5	-54.2	-55.3	0	0	0	113.1	V62 T63 F64	V62-D66 HydrophobicContact CG1-CB 4.17Å; T63-D66 WeakPolarHBondContact CA-OD2 3.34Å; T63-D66 WeakPolarHBondContact CB-OD2 3.4Å; T63-D66 PolarHBondContact N-OD2 2.96Å; T63-D66 WeakPolarHBondContact O-CB 3.46Å; T63-D66 PolarHBondContact O-N 3.05Å; T63-D66 PolarHBondContact OG1-OD2 3.07Å; F64-D66 VanDerWaalsContact C-N 3.25Å; F64-D66 PolarHBondContact O-N 3.08Å
67	V	62.3	Low	57.4	Low	52 Å²	52	99.8 Å²	99.8	32%	0.315	52%	0.522	S	S	.	.	S	Bend	trans	-122.6	6	179.1	-54.5	0	0	0	0	113.7	V62 F64 R65 N94 L98	V62-V67 HydrophobicContact CG1-CG1 4.12Å; F64-V67 HydrophobicContact CD2-CG2 4.14Å; F64-V67 WeakPolarHBondContact O-CG2 3.5Å; F64-V67 PolarHBondContact O-N 2.78Å; R65-V67 VanDerWaalsContact C-N 3.3Å; R65-V67 PolarHBondContact O-N 3.05Å; V67-N94 HydrophobicContact CG2-CB 4.29Å; V67-N94 PolarHBondContact O-ND2 3.29Å; V67-N94 VanDerWaalsContact O-ND2 3.13Å; V67-L98 HydrophobicContact CG2-CD1 3.38Å; V67-L98 HydrophobicContact CG2-CG 4.35Å
68	T	64.4	Low	59.1	Low	27 Å²	27	101.9 Å²	101.9	17%	0.166	52%	0.522	C	S	.	.			trans	-94.4	129.6	176.5	-61.2	0	0	0	0	110	F64 I70 M91	F64-T68 WeakPolarHBondContact CD1-OG1 3.21Å; F64-T68 WeakPolarHBondContact CE1-OG1 3.29Å; F64-T68 WeakPolarHBondContact CZ-OG1 3.19Å; F64-T68 WeakPolarHBondContact O-CB 2.93Å; F64-T68 PolarHBondContact O-N 3.2Å; F64-T68 VanDerWaalsContact O-N 3.08Å; F64-T68 PolarHBondContact O-OG1 2.8Å; T68-I70 HydrophobicContact CG2-CG1 4.11Å; T68-M91 HydrophobicContact CG2-SD 3.89Å
69	V	71.1	Confident	61	Low	85 Å²	85	96 Å²	96	52%	0.515	49%	0.493	S	S	.	.			trans	-90.9	107	173	177.8	0	0	0	0	108.4	Y87	V69-Y87 HydrophobicContact CB-CE2 4.36Å; V69-Y87 WeakPolarHBondContact O-CE2 3.33Å; V69-Y87 PolarHBondContact O-OH 3.16Å
70	I	65.5	Low	62.9	Low	105 Å²	105	92.8 Å²	92.8	54%	0.538	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-88.1	126.2	-177.8	-55.8	175.5	0	0	0	109.7	T68	T68-I70 HydrophobicContact CG2-CG1 4.11Å
71	F	69.8	Low	64.5	Low	72 Å²	72	91.4 Å²	91.4	32%	0.316	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-93.8	144.8	168.9	-69.3	-69.5	0	0	0	111	E75 W76 L79 Y87	F71-E75 HydrophobicContact CB-CB 4.33Å; F71-E75 HydrophobicContact CD1-CB 4.1Å; F71-W76 HydrophobicContact CB-CB 4.44Å; F71-W76 HydrophobicContact CB-CE3 4.28Å; F71-W76 AromaticContact CD2-CE3 3.81Å; F71-W76 HydrophobicContact CD2-CE3 3.81Å; F71-W76 HydrophobicContact CD2-CZ3 4.01Å; F71-W76 HydrophobicContact CG-CE3 4.36Å; F71-L79 HydrophobicContact CD2-CD1 4.04Å; F71-L79 HydrophobicContact CE2-CD1 3.84Å; F71-L79 HydrophobicContact CG-CD1 4.45Å; F71-L79 HydrophobicContact CZ-CD1 4.12Å; F71-Y87 HydrophobicContact CD2-CD2 4.14Å; F71-Y87 AromaticContact CD2-CE2 3.98Å; F71-Y87 HydrophobicContact CD2-CE2 3.98Å; F71-Y87 AromaticContact CE2-CD2 3.54Å; F71-Y87 HydrophobicContact CE2-CD2 3.54Å; F71-Y87 AromaticContact CE2-CE2 3.75Å; F71-Y87 HydrophobicContact CE2-CE2 3.75Å; F71-Y87 HydrophobicContact CE2-CG 4.13Å
72	T	70.7	Confident	65	Low	81 Å²	81	93.1 Å²	93.1	50%	0.497	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-71.7	158.7	164.8	64.1	0	0	0	0	110.8	A74 E75 W76	T72-A74 PolarHBondContact O-N 2.86Å; T72-E75 WeakPolarHBondContact CB-OE2 3.1Å; T72-E75 WeakPolarHBondContact CG2-OE2 3.47Å; T72-E75 PolarHBondContact N-OE2 3.1Å; T72-E75 PolarHBondContact O-N 3.1Å; T72-E75 VanDerWaalsContact OG1-CG 3.28Å; T72-E75 WeakPolarHBondContact OG1-CG 3.39Å; T72-E75 PolarHBondContact OG1-N 2.61Å; T72-E75 PolarHBondContact OG1-OE2 2.84Å; T72-W76 WeakPolarHBondContact O-CB 3.15Å; T72-W76 PolarHBondContact O-N 3.39Å
73	E	52.9	Low	65.4	Low	105 Å²	105	93.5 Å²	93.5	49%	0.491	46%	0.464	S	S	.	.	H	α-helix	trans	-58	-34.9	179.9	-162.2	-167.4	148.3	0	0	112.6	K77	E73-K77 WeakPolarHBondContact O-CB 3.21Å; E73-K77 WeakPolarHBondContact O-CG 3.35Å; E73-K77 PolarHBondContact O-N 3.22Å; E73-K77 VanDerWaalsContact O-N 3.1Å; E73-K77 VanDerWaalsContact OE1-CE 3.25Å; E73-K77 WeakPolarHBondContact OE1-CE 3.44Å; E73-K77 IonicContact OE1-NZ 3.19Å; E73-K77 PolarHBondContact OE1-NZ 3.12Å
74	A	59.3	Low	65.7	Low	69 Å²	69	93.9 Å²	93.9	57%	0.57	46%	0.458	S	S	*	.	H	α-helix	trans	-70.3	-33.4	176.3	0	0	0	0	0	113.1	T72 R78	T72-A74 PolarHBondContact O-N 2.86Å; A74-R78 WeakPolarHBondContact O-CD 3.35Å; A74-R78 VanDerWaalsContact O-CG 3.29Å; A74-R78 WeakPolarHBondContact O-CG 3.31Å
75	E	61	Low	66.1	Low	94 Å²	94	94.6 Å²	94.6	44%	0.439	47%	0.465	S	S	.	.	H	α-helix	trans	-76.2	-42.4	174.4	-69.2	163.2	137.1	0	0	111.1	F71 T72 K77 R78 L79	F71-E75 HydrophobicContact CB-CB 4.33Å; F71-E75 HydrophobicContact CD1-CB 4.1Å; T72-E75 WeakPolarHBondContact CB-OE2 3.1Å; T72-E75 WeakPolarHBondContact CG2-OE2 3.47Å; T72-E75 PolarHBondContact N-OE2 3.1Å; T72-E75 PolarHBondContact O-N 3.1Å; T72-E75 VanDerWaalsContact OG1-CG 3.28Å; T72-E75 WeakPolarHBondContact OG1-CG 3.39Å; T72-E75 PolarHBondContact OG1-N 2.61Å; T72-E75 PolarHBondContact OG1-OE2 2.84Å; E75-K77 VanDerWaalsContact C-N 3.34Å; E75-K77 PolarHBondContact O-N 2.93Å; E75-R78 WeakPolarHBondContact O-CB 3.48Å; E75-R78 PolarHBondContact O-N 2.61Å; E75-L79 PolarHBondContact O-N 3.49Å
76	W	68.2	Low	66.4	Low	73 Å²	73	90 Å²	90	28%	0.277	46%	0.455	S	S	.	.	H	α-helix	trans	-58	-44.9	177.7	-172.3	-109.2	0	0	0	112	F71 T72 R78 L79 R84 Y87	F71-W76 HydrophobicContact CB-CB 4.44Å; F71-W76 HydrophobicContact CB-CE3 4.28Å; F71-W76 AromaticContact CD2-CE3 3.81Å; F71-W76 HydrophobicContact CD2-CE3 3.81Å; F71-W76 HydrophobicContact CD2-CZ3 4.01Å; F71-W76 HydrophobicContact CG-CE3 4.36Å; T72-W76 WeakPolarHBondContact O-CB 3.15Å; T72-W76 PolarHBondContact O-N 3.39Å; W76-R78 PolarHBondContact O-N 3.49Å; W76-L79 HydrophobicContact CD2-CD1 4.5Å; W76-L79 HydrophobicContact CE3-CD1 3.69Å; W76-L79 HydrophobicContact CZ3-CD1 3.95Å; W76-L79 WeakPolarHBondContact O-CB 3.36Å; W76-L79 PolarHBondContact O-N 3.44Å; W76-L79 VanDerWaalsContact O-N 3.12Å; W76-R84 HydrophobicContact CD2-CG 4.43Å; W76-R84 HydrophobicContact CH2-CB 3.93Å; W76-R84 HydrophobicContact CH2-CG 3.99Å; W76-R84 HydrophobicContact CZ2-CB 3.96Å; W76-R84 HydrophobicContact CZ2-CG 3.86Å; W76-R84 HydrophobicContact CZ3-CG 4.35Å; W76-R84 PolarHBondContact O-NE 2.81Å; W76-R84 VanDerWaalsContact O-NE 3.1Å; W76-R84 PolarHBondContact O-NH2 3.26Å; W76-Y87 AromaticContact CH2-CD1 3.51Å; W76-Y87 HydrophobicContact CH2-CD1 3.51Å; W76-Y87 AromaticContact CH2-CE1 3.95Å; W76-Y87 HydrophobicContact CH2-CE1 3.95Å; W76-Y87 HydrophobicContact CH2-CG 4.34Å; W76-Y87 AromaticContact CZ3-CD1 3.39Å; W76-Y87 HydrophobicContact CZ3-CD1 3.39Å; W76-Y87 AromaticContact CZ3-CE1 3.71Å; W76-Y87 HydrophobicContact CZ3-CE1 3.71Å; W76-Y87 AromaticContact CZ3-CG 3.94Å; W76-Y87 HydrophobicContact CZ3-CG 3.94Å
77	K	62.9	Low	66.9	Low	132 Å²	132	86.7 Å²	86.7	57%	0.574	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22	175.8	-75.4	174.9	-174.8	173	0	113.5	E73 E75 R84	E73-K77 WeakPolarHBondContact O-CB 3.21Å; E73-K77 WeakPolarHBondContact O-CG 3.35Å; E73-K77 PolarHBondContact O-N 3.22Å; E73-K77 VanDerWaalsContact O-N 3.1Å; E73-K77 VanDerWaalsContact OE1-CE 3.25Å; E73-K77 WeakPolarHBondContact OE1-CE 3.44Å; E73-K77 IonicContact OE1-NZ 3.19Å; E73-K77 PolarHBondContact OE1-NZ 3.12Å; E75-K77 VanDerWaalsContact C-N 3.34Å; E75-K77 PolarHBondContact O-N 2.93Å; K77-R84 PolarHBondContact O-NH2 3.37Å; K77-R84 VanDerWaalsContact O-NH2 3.13Å
78	R	67.8	Low	67	Low	218 Å²	218	88.2 Å²	88.2	82%	0.823	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-9.4	178.1	-65.4	173.1	73.3	174.3	5.4	114.1	A74 E75 W76	A74-R78 WeakPolarHBondContact O-CD 3.35Å; A74-R78 VanDerWaalsContact O-CG 3.29Å; A74-R78 WeakPolarHBondContact O-CG 3.31Å; E75-R78 WeakPolarHBondContact O-CB 3.48Å; E75-R78 PolarHBondContact O-N 2.61Å; W76-R78 PolarHBondContact O-N 3.49Å
79	L	71.5	Confident	67.1	Low	33 Å²	33	93.3 Å²	93.3	17%	0.173	46%	0.459	C	S	.	.	S	Bend	trans	-77.5	140.1	173	-62.4	177.5	0	0	0	111	F71 E75 W76 Q83 R84	F71-L79 HydrophobicContact CD2-CD1 4.04Å; F71-L79 HydrophobicContact CE2-CD1 3.84Å; F71-L79 HydrophobicContact CG-CD1 4.45Å; F71-L79 HydrophobicContact CZ-CD1 4.12Å; E75-L79 PolarHBondContact O-N 3.49Å; W76-L79 HydrophobicContact CD2-CD1 4.5Å; W76-L79 HydrophobicContact CE3-CD1 3.69Å; W76-L79 HydrophobicContact CZ3-CD1 3.95Å; W76-L79 WeakPolarHBondContact O-CB 3.36Å; W76-L79 PolarHBondContact O-N 3.44Å; W76-L79 VanDerWaalsContact O-N 3.12Å; L79-Q83 HydrophobicContact CB-CB 4.16Å; L79-Q83 HydrophobicContact CD2-CB 4.29Å; L79-R84 HydrophobicContact CB-CG 3.72Å; L79-R84 HydrophobicContact CD1-CG 4.29Å; L79-R84 PolarHBondContact O-NE 3.04Å; L79-R84 PolarHBondContact O-NH2 3.05Å
80	S	79	Confident	67.1	Low	42 Å²	42	92.4 Å²	92.4	29%	0.294	45%	0.454	S	S	.	.			trans	-69	160.7	170.5	85	0	0	0	0	111.6	E82 Q83 R84	S80-E82 VanDerWaalsContact CB-OE2 3.29Å; S80-E82 WeakPolarHBondContact CB-OE2 3.5Å; S80-E82 PolarHBondContact O-N 2.89Å; S80-E82 PolarHBondContact OG-OE2 2.98Å; S80-Q83 PolarHBondContact O-N 3.02Å; S80-Q83 VanDerWaalsContact O-N 3.12Å; S80-Q83 PolarHBondContact OG-N 2.99Å; S80-R84 WeakPolarHBondContact O-CG 3.29Å; S80-R84 PolarHBondContact O-N 2.99Å
81	P	71	Confident	67.7	Low	88 Å²	88	88.3 Å²	88.3	57%	0.571	43%	0.432	S	S	*	.	H	α-helix	trans	-53.4	-40.2	177.3	-26.5	35.9	0	0	0	113.3	R84 N85	P81-R84 PolarHBondContact O-N 3.28Å; P81-N85 PolarHBondContact O-N 3.45Å
82	E	66.4	Low	67.5	Low	132 Å²	132	88.9 Å²	88.9	62%	0.617	44%	0.438	S	S	*	.	H	α-helix	trans	-67	-39	179.7	-54.5	69.6	-148.9	0	0	111.4	S80 N85 L86	S80-E82 VanDerWaalsContact CB-OE2 3.29Å; S80-E82 WeakPolarHBondContact CB-OE2 3.5Å; S80-E82 PolarHBondContact O-N 2.89Å; S80-E82 PolarHBondContact OG-OE2 2.98Å; E82-N85 PolarHBondContact O-N 2.9Å; E82-L86 WeakPolarHBondContact O-CB 3.34Å; E82-L86 PolarHBondContact O-N 3.07Å
83	Q	59.6	Low	67.3	Low	99 Å²	99	89 Å²	89	46%	0.463	43%	0.433	S	S	.	.	H	α-helix	trans	-69.1	-37.3	176.2	-69.8	172.8	-34.1	0	0	112	L79 S80 L86 Y87	L79-Q83 HydrophobicContact CB-CB 4.16Å; L79-Q83 HydrophobicContact CD2-CB 4.29Å; S80-Q83 PolarHBondContact O-N 3.02Å; S80-Q83 VanDerWaalsContact O-N 3.12Å; S80-Q83 PolarHBondContact OG-N 2.99Å; Q83-L86 PolarHBondContact O-N 2.9Å; Q83-Y87 WeakPolarHBondContact O-CB 3.41Å; Q83-Y87 PolarHBondContact O-N 3.13Å
84	R	70.8	Confident	67.6	Low	76 Å²	76	86.4 Å²	86.4	29%	0.287	42%	0.423	S	S	.	.	H	α-helix	trans	-66.7	-39.5	174.3	-64.9	-179.1	-160.3	174.3	10.3	111.4	W76 K77 L79 S80 P81 Y87 K88	W76-R84 HydrophobicContact CD2-CG 4.43Å; W76-R84 HydrophobicContact CH2-CB 3.93Å; W76-R84 HydrophobicContact CH2-CG 3.99Å; W76-R84 HydrophobicContact CZ2-CB 3.96Å; W76-R84 HydrophobicContact CZ2-CG 3.86Å; W76-R84 HydrophobicContact CZ3-CG 4.35Å; W76-R84 PolarHBondContact O-NE 2.81Å; W76-R84 VanDerWaalsContact O-NE 3.1Å; W76-R84 PolarHBondContact O-NH2 3.26Å; K77-R84 PolarHBondContact O-NH2 3.37Å; K77-R84 VanDerWaalsContact O-NH2 3.13Å; L79-R84 HydrophobicContact CB-CG 3.72Å; L79-R84 HydrophobicContact CD1-CG 4.29Å; L79-R84 PolarHBondContact O-NE 3.04Å; L79-R84 PolarHBondContact O-NH2 3.05Å; S80-R84 WeakPolarHBondContact O-CG 3.29Å; S80-R84 PolarHBondContact O-N 2.99Å; P81-R84 PolarHBondContact O-N 3.28Å; R84-Y87 PolarHBondContact O-N 3.48Å; R84-K88 WeakPolarHBondContact O-CG 3.46Å; R84-K88 PolarHBondContact O-N 2.92Å
85	N	67.3	Low	67.7	Low	93 Å²	93	88.8 Å²	88.8	50%	0.497	42%	0.418	S	S	.	.	H	α-helix	trans	-65.9	-45.9	173.5	-83.8	-3.4	0	0	0	112.3	P81 E82 Y87 K88 E89	P81-N85 PolarHBondContact O-N 3.45Å; E82-N85 PolarHBondContact O-N 2.9Å; N85-Y87 VanDerWaalsContact C-N 3.27Å; N85-Y87 PolarHBondContact O-N 3.29Å; N85-K88 WeakPolarHBondContact O-CB 3.48Å; N85-K88 PolarHBondContact O-N 3.46Å; N85-K88 VanDerWaalsContact O-N 3.1Å; N85-E89 PolarHBondContact O-N 3.29Å
86	L	66.3	Low	67.9	Low	105 Å²	105	90.7 Å²	90.7	55%	0.55	42%	0.421	S	S	.	.	H	α-helix	trans	-58.8	-39.8	175.5	-179.7	62.5	0	0	0	111.7	E82 Q83 E89 V90	E82-L86 WeakPolarHBondContact O-CB 3.34Å; E82-L86 PolarHBondContact O-N 3.07Å; Q83-L86 PolarHBondContact O-N 2.9Å; L86-E89 PolarHBondContact O-N 3.48Å; L86-V90 HydrophobicContact CD1-CG2 4.22Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.09Å; L86-V90 PolarHBondContact O-N 3.4Å
87	Y	76.2	Confident	67.7	Low	40 Å²	40	91.2 Å²	91.2	16%	0.157	43%	0.429	C	S	.	.	H	α-helix	trans	-62.9	-46.3	173	171.7	-93.3	0	0	0	112.4	V69 F71 W76 Q83 R84 N85 E89 V90 M91	V69-Y87 HydrophobicContact CB-CE2 4.36Å; V69-Y87 WeakPolarHBondContact O-CE2 3.33Å; V69-Y87 PolarHBondContact O-OH 3.16Å; F71-Y87 HydrophobicContact CD2-CD2 4.14Å; F71-Y87 AromaticContact CD2-CE2 3.98Å; F71-Y87 HydrophobicContact CD2-CE2 3.98Å; F71-Y87 AromaticContact CE2-CD2 3.54Å; F71-Y87 HydrophobicContact CE2-CD2 3.54Å; F71-Y87 AromaticContact CE2-CE2 3.75Å; F71-Y87 HydrophobicContact CE2-CE2 3.75Å; F71-Y87 HydrophobicContact CE2-CG 4.13Å; W76-Y87 AromaticContact CH2-CD1 3.51Å; W76-Y87 HydrophobicContact CH2-CD1 3.51Å; W76-Y87 AromaticContact CH2-CE1 3.95Å; W76-Y87 HydrophobicContact CH2-CE1 3.95Å; W76-Y87 HydrophobicContact CH2-CG 4.34Å; W76-Y87 AromaticContact CZ3-CD1 3.39Å; W76-Y87 HydrophobicContact CZ3-CD1 3.39Å; W76-Y87 AromaticContact CZ3-CE1 3.71Å; W76-Y87 HydrophobicContact CZ3-CE1 3.71Å; W76-Y87 AromaticContact CZ3-CG 3.94Å; W76-Y87 HydrophobicContact CZ3-CG 3.94Å; Q83-Y87 WeakPolarHBondContact O-CB 3.41Å; Q83-Y87 PolarHBondContact O-N 3.13Å; R84-Y87 PolarHBondContact O-N 3.48Å; N85-Y87 VanDerWaalsContact C-N 3.27Å; N85-Y87 PolarHBondContact O-N 3.29Å; Y87-E89 VanDerWaalsContact C-N 3.31Å; Y87-E89 PolarHBondContact O-N 3.35Å; Y87-V90 PolarHBondContact O-N 3.16Å; Y87-M91 HydrophobicContact CD1-CG 4.23Å; Y87-M91 HydrophobicContact CD2-CG 3.94Å; Y87-M91 HydrophobicContact CE1-CG 3.84Å; Y87-M91 HydrophobicContact CE2-CE 4.29Å; Y87-M91 HydrophobicContact CE2-CG 3.49Å; Y87-M91 VanDerWaalsContact CE2-CG 3.49Å; Y87-M91 HydrophobicContact CE2-SD 3.83Å; Y87-M91 HydrophobicContact CG-CG 4.31Å; Y87-M91 VanDerWaalsContact CZ-CG 3.45Å; Y87-M91 WeakPolarHBondContact O-CB 3.39Å; Y87-M91 WeakPolarHBondContact O-CG 3.49Å; Y87-M91 PolarHBondContact O-N 3.47Å
88	K	65.9	Low	67.8	Low	83 Å²	83	86.7 Å²	86.7	36%	0.361	41%	0.411	S	S	.	.	H	α-helix	trans	-55.1	-46.6	174.8	-76.1	177.9	174	-175.3	0	110.7	D11 R84 N85 L92	D11-K88 IonicContact OD1-NZ 3.45Å; D11-K88 PolarHBondContact OD1-NZ 3.13Å; R84-K88 WeakPolarHBondContact O-CG 3.46Å; R84-K88 PolarHBondContact O-N 2.92Å; N85-K88 WeakPolarHBondContact O-CB 3.48Å; N85-K88 PolarHBondContact O-N 3.46Å; N85-K88 VanDerWaalsContact O-N 3.1Å; K88-L92 VanDerWaalsContact O-CB 3.22Å; K88-L92 WeakPolarHBondContact O-CB 3.38Å; K88-L92 PolarHBondContact O-N 3.49Å
89	E	66.7	Low	67.2	Low	134 Å²	134	80.9 Å²	80.9	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-62.5	-48.5	178.1	-71.5	-176.6	171.1	0	0	112.7	N85 L86 Y87 L92 E93	N85-E89 PolarHBondContact O-N 3.29Å; L86-E89 PolarHBondContact O-N 3.48Å; Y87-E89 VanDerWaalsContact C-N 3.31Å; Y87-E89 PolarHBondContact O-N 3.35Å; E89-L92 PolarHBondContact O-N 3.24Å; E89-E93 WeakPolarHBondContact O-CB 3.43Å; E89-E93 PolarHBondContact O-N 3Å
90	V	69.6	Low	66.8	Low	67 Å²	67	84 Å²	84	41%	0.406	42%	0.42	S	S	.	.	H	α-helix	trans	-66.2	-39.8	-178.3	174.2	0	0	0	0	111.9	L86 Y87 E93 N94	L86-V90 HydrophobicContact CD1-CG2 4.22Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.09Å; L86-V90 PolarHBondContact O-N 3.4Å; Y87-V90 PolarHBondContact O-N 3.16Å; V90-E93 PolarHBondContact O-N 3.06Å; V90-N94 WeakPolarHBondContact O-CB 3.39Å; V90-N94 VanDerWaalsContact O-CG 3.31Å; V90-N94 PolarHBondContact O-N 3.33Å; V90-N94 PolarHBondContact O-OD1 3.32Å
91	M	78.8	Confident	65.9	Low	18 Å²	18	88.5 Å²	88.5	9%	0.089	44%	0.44	C	S	.	.	H	α-helix	trans	-67.7	-38	176.1	-67.1	-60.2	97	0	0	112.1	F64 T68 Y87 E93 N94 Y95	F64-M91 WeakPolarHBondContact CE2-O 3.49Å; F64-M91 HydrophobicContact CZ-CB 4.44Å; T68-M91 HydrophobicContact CG2-SD 3.89Å; Y87-M91 HydrophobicContact CD1-CG 4.23Å; Y87-M91 HydrophobicContact CD2-CG 3.94Å; Y87-M91 HydrophobicContact CE1-CG 3.84Å; Y87-M91 HydrophobicContact CE2-CE 4.29Å; Y87-M91 HydrophobicContact CE2-CG 3.49Å; Y87-M91 VanDerWaalsContact CE2-CG 3.49Å; Y87-M91 HydrophobicContact CE2-SD 3.83Å; Y87-M91 HydrophobicContact CG-CG 4.31Å; Y87-M91 VanDerWaalsContact CZ-CG 3.45Å; Y87-M91 WeakPolarHBondContact O-CB 3.39Å; Y87-M91 WeakPolarHBondContact O-CG 3.49Å; Y87-M91 PolarHBondContact O-N 3.47Å; M91-E93 VanDerWaalsContact C-N 3.35Å; M91-N94 PolarHBondContact O-N 2.83Å; M91-Y95 PolarHBondContact O-N 2.85Å
92	L	65.3	Low	64.6	Low	84 Å²	84	90.3 Å²	90.3	44%	0.44	45%	0.445	S	S	.	.	H	α-helix	trans	-70.9	-32.7	178.3	-163.6	145.2	0	0	0	111.8	K88 E89 Y95 R96	K88-L92 VanDerWaalsContact O-CB 3.22Å; K88-L92 WeakPolarHBondContact O-CB 3.38Å; K88-L92 PolarHBondContact O-N 3.49Å; E89-L92 PolarHBondContact O-N 3.24Å; L92-Y95 PolarHBondContact O-N 3.28Å; L92-R96 VanDerWaalsContact CD2-NH2 3.29Å; L92-R96 WeakPolarHBondContact O-CG 3.46Å; L92-R96 PolarHBondContact O-N 3.37Å; L92-R96 VanDerWaalsContact O-N 3.08Å
93	E	66.1	Low	63.5	Low	83 Å²	83	88.2 Å²	88.2	39%	0.388	46%	0.459	S	S	.	.	H	α-helix	trans	-71.9	-39.9	171.5	-165.1	56.6	-154.1	0	0	112	E89 V90 M91 Y95 R96 N97	E89-E93 WeakPolarHBondContact O-CB 3.43Å; E89-E93 PolarHBondContact O-N 3Å; V90-E93 PolarHBondContact O-N 3.06Å; M91-E93 VanDerWaalsContact C-N 3.35Å; E93-Y95 VanDerWaalsContact C-N 3.26Å; E93-Y95 PolarHBondContact O-N 2.88Å; E93-R96 PolarHBondContact O-N 3.25Å; E93-R96 VanDerWaalsContact OE2-CD 3.32Å; E93-R96 WeakPolarHBondContact OE2-CD 3.49Å; E93-R96 IonicContact OE2-CZ 3.32Å; E93-R96 IonicContact OE2-NH1 3.81Å; E93-R96 PolarHBondContact OE2-NH1 2.99Å; E93-N97 WeakPolarHBondContact O-CB 3.44Å; E93-N97 PolarHBondContact O-N 3Å; E93-N97 PolarHBondContact O-ND2 3.09Å
94	N	60.9	Low	62.3	Low	52 Å²	52	88.2 Å²	88.2	28%	0.278	47%	0.465	S	S	.	.	H	α-helix	trans	-58.4	-39.2	170.6	-76.4	-1.3	0	0	0	111.7	F64 V67 V90 M91 N97 L98	F64-N94 HydrophobicContact CE2-CB 4.41Å; V67-N94 HydrophobicContact CG2-CB 4.29Å; V67-N94 PolarHBondContact O-ND2 3.29Å; V67-N94 VanDerWaalsContact O-ND2 3.13Å; V90-N94 WeakPolarHBondContact O-CB 3.39Å; V90-N94 VanDerWaalsContact O-CG 3.31Å; V90-N94 PolarHBondContact O-N 3.33Å; V90-N94 PolarHBondContact O-OD1 3.32Å; M91-N94 PolarHBondContact O-N 2.83Å; N94-N97 PolarHBondContact O-N 2.92Å; N94-L98 PolarHBondContact O-N 2.93Å
95	Y	61.6	Low	60.4	Low	119 Å²	119	90 Å²	90	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-64.6	-47	176.3	-177.3	-108.6	0	0	0	112.3	F64 M91 L92 E93 N97 L98 L99	F64-Y95 AromaticContact CD2-CD2 3.9Å; F64-Y95 HydrophobicContact CD2-CD2 3.9Å; F64-Y95 HydrophobicContact CE2-CD2 4.14Å; F64-Y95 HydrophobicContact CE2-CG 4.36Å; F64-Y95 HydrophobicContact CG-CD2 4.23Å; M91-Y95 PolarHBondContact O-N 2.85Å; L92-Y95 PolarHBondContact O-N 3.28Å; E93-Y95 VanDerWaalsContact C-N 3.26Å; E93-Y95 PolarHBondContact O-N 2.88Å; Y95-N97 VanDerWaalsContact C-N 3.31Å; Y95-N97 PolarHBondContact O-N 3.45Å; Y95-L98 PolarHBondContact O-N 3.31Å; Y95-L99 HydrophobicContact CD1-CD1 3.95Å; Y95-L99 HydrophobicContact CD1-CG 4.49Å; Y95-L99 HydrophobicContact CE1-CD1 3.43Å; Y95-L99 VanDerWaalsContact CE1-CD1 3.43Å; Y95-L99 HydrophobicContact CE1-CG 4.13Å; Y95-L99 PolarHBondContact O-N 3Å
96	R	64.7	Low	58.6	Low	134 Å²	134	92.4 Å²	92.4	51%	0.506	50%	0.502	S	S	.	.	H	α-helix	trans	-59.1	-41.1	174.4	-72.6	169.1	178.9	156.2	-0.4	112.5	L92 E93 L99 S100	L92-R96 VanDerWaalsContact CD2-NH2 3.29Å; L92-R96 WeakPolarHBondContact O-CG 3.46Å; L92-R96 PolarHBondContact O-N 3.37Å; L92-R96 VanDerWaalsContact O-N 3.08Å; E93-R96 PolarHBondContact O-N 3.25Å; E93-R96 VanDerWaalsContact OE2-CD 3.32Å; E93-R96 WeakPolarHBondContact OE2-CD 3.49Å; E93-R96 IonicContact OE2-CZ 3.32Å; E93-R96 IonicContact OE2-NH1 3.81Å; E93-R96 PolarHBondContact OE2-NH1 2.99Å; R96-L99 PolarHBondContact O-N 3.33Å; R96-S100 WeakPolarHBondContact O-CB 3.46Å; R96-S100 PolarHBondContact O-N 2.93Å; R96-S100 PolarHBondContact O-OG 2.85Å
97	N	64.3	Low	56.7	Low	83 Å²	83	95 Å²	95	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-39.6	177.6	-77.9	-65.2	0	0	0	111.7	E93 N94 Y95 S100 L101	E93-N97 WeakPolarHBondContact O-CB 3.44Å; E93-N97 PolarHBondContact O-N 3Å; E93-N97 PolarHBondContact O-ND2 3.09Å; N94-N97 PolarHBondContact O-N 2.92Å; Y95-N97 VanDerWaalsContact C-N 3.31Å; Y95-N97 PolarHBondContact O-N 3.45Å; N97-S100 WeakPolarHBondContact O-CB 3.37Å; N97-S100 PolarHBondContact O-N 3.39Å; N97-L101 WeakPolarHBondContact O-CG 3.46Å; N97-L101 PolarHBondContact O-N 3.36Å
98	L	63.8	Low	54.3	Low	37 Å²	37	100.2 Å²	100.2	19%	0.194	55%	0.545	C	S	.	.	H	α-helix	trans	-65.1	-42.1	172.5	-83.5	167.8	0	0	0	113.2	V62 F64 V67 N94 Y95 S100 L101	V62-L98 HydrophobicContact CB-CD2 4.46Å; V62-L98 HydrophobicContact CG1-CD2 4.16Å; F64-L98 HydrophobicContact CB-CD1 4.14Å; F64-L98 HydrophobicContact CD2-CD1 3.9Å; V67-L98 HydrophobicContact CG2-CD1 3.38Å; V67-L98 HydrophobicContact CG2-CG 4.35Å; N94-L98 PolarHBondContact O-N 2.93Å; Y95-L98 PolarHBondContact O-N 3.31Å; L98-S100 PolarHBondContact O-N 3.14Å; L98-L101 HydrophobicContact CD2-CD1 4.26Å; L98-L101 PolarHBondContact O-N 2.92Å; L98-L101 VanDerWaalsContact O-N 3.16Å
99	L	56.5	Low	52.4	Low	96 Å²	96	102.3 Å²	102.3	50%	0.503	57%	0.567	S	S	.	*	H	α-helix	trans	-62	-24.7	173	-71.2	178.9	0	0	0	113	Y95 R96 L101	Y95-L99 HydrophobicContact CD1-CD1 3.95Å; Y95-L99 HydrophobicContact CD1-CG 4.49Å; Y95-L99 HydrophobicContact CE1-CD1 3.43Å; Y95-L99 VanDerWaalsContact CE1-CD1 3.43Å; Y95-L99 HydrophobicContact CE1-CG 4.13Å; Y95-L99 PolarHBondContact O-N 3Å; R96-L99 PolarHBondContact O-N 3.33Å; L99-L101 VanDerWaalsContact C-N 3.33Å
100	S	61.7	Low	50.3	Low	98 Å²	98	105.4 Å²	105.4	69%	0.685	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-4.3	179.2	-55.6	0	0	0	0	113.8	R96 N97 L98	R96-S100 WeakPolarHBondContact O-CB 3.46Å; R96-S100 PolarHBondContact O-N 2.93Å; R96-S100 PolarHBondContact O-OG 2.85Å; N97-S100 WeakPolarHBondContact O-CB 3.37Å; N97-S100 PolarHBondContact O-N 3.39Å; L98-S100 PolarHBondContact O-N 3.14Å
101	L	61.4	Low	48.4	Very low	138 Å²	138	110.7 Å²	110.7	72%	0.723	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-8.9	-174.4	-79.8	170	0	0	0	115	N97 L98 L99	N97-L101 WeakPolarHBondContact O-CG 3.46Å; N97-L101 PolarHBondContact O-N 3.36Å; L98-L101 HydrophobicContact CD2-CD1 4.26Å; L98-L101 PolarHBondContact O-N 2.92Å; L98-L101 VanDerWaalsContact O-N 3.16Å; L99-L101 VanDerWaalsContact C-N 3.33Å
102	D	43.2	Very low	45.7	Very low	126 Å²	126	116.4 Å²	116.4	67%	0.674	62%	0.624	S	S	*	*			trans	-125.5	128.9	-175.6	-118.2	-29.2	0	0	0	115.3	V104	D102-V104 PolarHBondContact O-N 3.01Å
103	G	44.3	Very low	43.7	Very low	87 Å²	87	117.3 Å²	117.3	90%	0.897	64%	0.637	S	S	*	*			trans	-90.4	43.2	169.2	0	0	0	0	0	111.9
104	V	33.9	Very low	41.6	Very low	100 Å²	100	121.2 Å²	121.2	61%	0.606	66%	0.66	S	S	*	*	S	Bend	trans	-122.3	124.1	-179.1	-179.7	0	0	0	0	109	D102 L106	D102-V104 PolarHBondContact O-N 3.01Å; V104-L106 PolarHBondContact O-N 2.94Å; V104-L106 VanDerWaalsContact O-N 3.08Å
105	S	31.1	Very low	39.8	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	69%	0.688	S	S	*	*			trans	-60.9	112	177.4	-60.6	0	0	0	0	111.1	L107	S105-L107 PolarHBondContact O-N 3.08Å
106	L	28.6	Very low	38	Very low	145 Å²	145	128.1 Å²	128.1	76%	0.759	70%	0.7	S	S	*	*			trans	-67.7	102	155.6	-69.8	177.6	0	0	0	108	V104 L108	V104-L106 PolarHBondContact O-N 2.94Å; V104-L106 VanDerWaalsContact O-N 3.08Å; L106-L108 PolarHBondContact O-N 3.45Å
107	L	25.5	Very low	36	Very low	158 Å²	158	129.2 Å²	129.2	83%	0.827	72%	0.715	S	S	*	*			trans	-59.2	121	147.2	-73.3	171.9	0	0	0	106.2	S105	S105-L107 PolarHBondContact O-N 3.08Å
108	L	26.8	Very low	34.1	Very low	151 Å²	151	130.8 Å²	130.8	79%	0.791	73%	0.732	S	S	*	*			trans	-51.9	135.2	162.7	-88.5	78.3	0	0	0	107.7	L106 R110	L106-L108 PolarHBondContact O-N 3.45Å; L108-R110 VanDerWaalsContact C-N 3.34Å; L108-R110 PolarHBondContact O-N 2.96Å
109	P	26.1	Very low	32.3	Very low	126 Å²	126	133.3 Å²	133.3	82%	0.818	76%	0.759	S	S	*	*			trans	-55.4	106.3	153.9	-20.3	33.2	0	0	0	107.1	L111	P109-L111 PolarHBondContact O-N 3.34Å
110	R	22.7	Very low	30.9	Very low	199 Å²	199	136.8 Å²	136.8	75%	0.751	77%	0.772	S	S	*	*			trans	-58.8	129.2	175.1	-165.8	-177.2	-166.1	-161.9	11.3	107	L108 E112	L108-R110 VanDerWaalsContact C-N 3.34Å; L108-R110 PolarHBondContact O-N 2.96Å; R110-E112 HydrophobicContact CB-CG 4.35Å; R110-E112 WeakPolarHBondContact CD-OE1 3.41Å; R110-E112 HydrophobicContact CG-CG 4.11Å; R110-E112 IonicContact CZ-OE1 3.58Å; R110-E112 IonicContact NE-OE1 3.13Å; R110-E112 IonicContact NH1-OE1 2.69Å; R110-E112 PolarHBondContact NH1-OE1 3.08Å; R110-E112 PolarHBondContact O-N 2.94Å
111	L	29.1	Very low	29.3	Very low	178 Å²	178	139.5 Å²	139.5	93%	0.932	77%	0.773	S	S	*	*			trans	-63	87.3	166.3	-82.4	156.9	0	0	0	108.4	P109	P109-L111 PolarHBondContact O-N 3.34Å
112	E	22.7	Very low	27.8	Very low	138 Å²	138	138 Å²	138	65%	0.645	77%	0.766	S	S	*	*			trans	-92.8	105.8	166.8	-69.4	-160	167.3	0	0	109.3	R110 N114	R110-E112 HydrophobicContact CB-CG 4.35Å; R110-E112 WeakPolarHBondContact CD-OE1 3.41Å; R110-E112 HydrophobicContact CG-CG 4.11Å; R110-E112 IonicContact CZ-OE1 3.58Å; R110-E112 IonicContact NE-OE1 3.13Å; R110-E112 IonicContact NH1-OE1 2.69Å; R110-E112 PolarHBondContact NH1-OE1 3.08Å; R110-E112 PolarHBondContact O-N 2.94Å; E112-N114 PolarHBondContact O-N 3.17Å
113	C	22	Very low	27	Very low	104 Å²	104	139.2 Å²	139.2	70%	0.703	77%	0.772	S	S	*	*			trans	-63.7	119	176	173.8	0	0	0	0	110.6
114	N	23.3	Very low	26.2	Very low	165 Å²	165	140.4 Å²	140.4	88%	0.882	77%	0.765	S	S	*	*			trans	-98.2	106	154.3	-86.2	-38.3	0	0	0	109.6	E112	E112-N114 PolarHBondContact O-N 3.17Å
115	R	23.6	Very low	25.7	Very low	227 Å²	227	143.3 Å²	143.3	86%	0.857	78%	0.776	S	S	*	*			trans	-61.3	154.7	151.7	-77	174	170.7	163.7	-4.5	108.5
116	A	21.9	Very low	26.1	Very low	88 Å²	88	143.8 Å²	143.8	73%	0.727	78%	0.777	S	S	*	*			cis	-144.5	-178.1	2	0	0	0	0	0	107.4
117	I	23.3	Very low	25.9	Very low	158 Å²	158	140.1 Å²	140.1	81%	0.81	77%	0.774	S	S	*	*				-166.3	139.5	51.5	-74.3	175.4	0	0	0	109.4
118	S	24.6	Very low	26	Very low	115 Å²	115	137.7 Å²	137.7	80%	0.804	77%	0.77	S	S	*	*			trans	58.4	135.5	161.5	-147.6	0	0	0	0	118.3
119	A	26.8	Very low	25.9	Very low	91 Å²	91	135.1 Å²	135.1	75%	0.752	77%	0.765	S	S	*	*			cis	-160.1	145.2	38.5	0	0	0	0	0	114.1
120	H	26.3	Very low	25.9	Very low	169 Å²	169	136.3 Å²	136.3	78%	0.782	76%	0.764	S	S	*	*			trans	-9	153.7	159.3	-99.8	-117.6	0	0	0	123.9
121	H	28	Very low	26.1	Very low	154 Å²	154	132.2 Å²	132.2	71%	0.713	77%	0.766	S	S	*	*			trans	83.1	145.2	157.8	-78.4	-138.6	0	0	0	119.5
122	N	30	Very low	26.7	Very low	107 Å²	107	129.6 Å²	129.6	57%	0.572	76%	0.759	S	S	*	*			cis	-175.2	140.4	-31.7	-123.8	-30	0	0	0	109.3
123	L	27.3	Very low	26.8	Very low	151 Å²	151	126.7 Å²	126.7	79%	0.791	76%	0.759	S	S	*	*			trans	62.1	158.1	155.3	-54.6	164.9	0	0	0	116.6
124	C	25.7	Very low	27	Very low	113 Å²	113	128.5 Å²	128.5	76%	0.764	77%	0.767	S	S	*	*			cis	-154.6	157.8	-4.6	-128.7	0	0	0	0	110.8
125	L	24.3	Very low	27.2	Very low	161 Å²	161	125 Å²	125	84%	0.843	76%	0.761	S	S	*	*			trans	-88.7	-173.5	153.9	-77.5	169.3	0	0	0	108.6
126	P	40.2	Very low	27.4	Very low	122 Å²	122	119.5 Å²	119.5	79%	0.792	76%	0.757	S	S	*	*			cis	-133.4	-175.1	-9.7	24.9	-0.4	0	0	0	114.6
127	G	24.8	Very low	27.8	Very low	67 Å²	67	126.5 Å²	126.5	69%	0.691	77%	0.765	S	S	*	*			trans	108.3	150.8	139.4	0	0	0	0	0	116.9
128	S	26	Very low	27.9	Very low	107 Å²	107	125.1 Å²	125.1	75%	0.748	76%	0.764	S	S	*	*			cis	168.5	140.1	-21.7	39.7	0	0	0	0	107.2
129	S	24.7	Very low	28	Very low	97 Å²	97	126.3 Å²	126.3	68%	0.678	77%	0.766	S	S	*	*			trans	81.1	146.7	148.6	80.1	0	0	0	0	121.7
130	N	26.8	Very low	28	Very low	152 Å²	152	124.7 Å²	124.7	81%	0.813	76%	0.758	S	S	*	*			trans	84.8	98.6	150.9	-57.3	-18.1	0	0	0	120.7
131	S	27.4	Very low	28	Very low	112 Å²	112	124.2 Å²	124.2	78%	0.783	76%	0.76	S	S	*	*			trans	-66.6	164.6	134.2	-33.9	0	0	0	0	109.6
132	P	40.1	Very low	27.8	Very low	123 Å²	123	123.4 Å²	123.4	80%	0.799	77%	0.766	S	S	*	*				-152.5	-178.3	64.5	40.9	-20	0	0	0	117.6
133	A	26.3	Very low	27.5	Very low	78 Å²	78	122.9 Å²	122.9	65%	0.645	78%	0.776	S	S	*	*			trans	90.3	115.2	141.6	0	0	0	0	0	122.9
134	T	26.6	Very low	27.6	Very low	142 Å²	142	123.3 Å²	123.3	87%	0.871	77%	0.774	S	S	*	*				84.6	140.3	126.5	52.5	0	0	0	0	125
135	A	27.4	Very low	27.9	Very low	90 Å²	90	123.6 Å²	123.6	74%	0.744	78%	0.775	S	S	*	*			trans	93.3	85.6	143.3	0	0	0	0	0	122.3
136	S	26.7	Very low	28.1	Very low	112 Å²	112	123.7 Å²	123.7	78%	0.783	77%	0.769	S	S	*	*				37.4	139.6	119	-60.5	0	0	0	0	125.5
137	R	30.5	Very low	27.4	Very low	235 Å²	235	123.9 Å²	123.9	89%	0.887	77%	0.77	S	S	*	*			trans	78.1	117	148.8	-76.8	175	134.6	168.8	-5.9	117.5
138	V	26.3	Very low	27.4	Very low	130 Å²	130	128.8 Å²	128.8	79%	0.788	77%	0.774	S	S	*	*				98	115.2	57.7	160.6	0	0	0	0	112.1
139	V	26.5	Very low	27.3	Very low	140 Å²	140	131.5 Å²	131.5	85%	0.848	78%	0.779	S	S	*	*			trans	168.7	146.6	135.7	157.1	0	0	0	0	106.2
140	G	25.3	Very low	27.3	Very low	57 Å²	57	137.6 Å²	137.6	59%	0.588	79%	0.789	S	S	*	*			trans	-129.9	-169.5	174.7	0	0	0	0	0	111.9
141	I	27.2	Very low	27.3	Very low	159 Å²	159	137.1 Å²	137.1	82%	0.815	79%	0.791	S	S	*	*			trans	147.9	144.3	152.2	-78.8	163.4	0	0	0	112
142	T	24.3	Very low	27.2	Very low	136 Å²	136	136.9 Å²	136.9	83%	0.834	79%	0.789	S	S	*	*			trans	79.5	133	162.5	38.9	0	0	0	0	124.1
143	A	23.6	Very low	26.8	Very low	97 Å²	97	136.9 Å²	136.9	80%	0.802	79%	0.791	S	S	*	*			trans	101.4	90.8	140.4	0	0	0	0	0	120.8
144	E	29.2	Very low	27.3	Very low	159 Å²	159	137.5 Å²	137.5	74%	0.743	79%	0.791	S	S	*	*			trans	-47.7	154.2	143.6	-83.4	-86.2	157.6	0	0	112.4
145	P	32.6	Very low	27.6	Very low	120 Å²	120	135.4 Å²	135.4	78%	0.779	78%	0.781	S	S	*	*				-148	164.4	64	38.7	-18.4	0	0	0	119.6
146	K	28.7	Very low	27.9	Very low	163 Å²	163	138.7 Å²	138.7	71%	0.709	79%	0.785	S	S	*	*			trans	-44.4	157.9	167.3	-68.7	176.9	173.5	177.7	0	115.9
147	P	24	Very low	28.3	Very low	125 Å²	125	140.8 Å²	140.8	81%	0.812	79%	0.787	S	S	*	*				-129.8	168.1	108.3	37.5	-31.3	0	0	0	115.2
148	E	26.4	Very low	28.5	Very low	170 Å²	170	132.9 Å²	132.9	79%	0.794	77%	0.772	S	S	*	*			trans	-87.3	152.8	-171.1	-55.8	176.3	140.8	0	0	113.1
149	I	23.7	Very low	28.8	Very low	164 Å²	164	133.9 Å²	133.9	84%	0.841	77%	0.766	S	S	*	*			trans	-130.5	131.9	173.5	-60.3	-178.9	0	0	0	110.7
150	Y	24	Very low	29.1	Very low	226 Å²	226	131 Å²	131	89%	0.886	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-68.1	142.9	-178.5	-76.3	-107.2	0	0	0	113.3
151	T	26.4	Very low	29.4	Very low	141 Å²	141	132.3 Å²	132.3	87%	0.865	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-84.7	117.3	175.7	53	0	0	0	0	112.6
152	C	24.7	Very low	29.8	Very low	108 Å²	108	131.5 Å²	131.5	73%	0.73	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-74.2	140.8	170.5	-172.8	0	0	0	0	111.7	S154	C152-S154 PolarHBondContact SG-OG 2.8Å
153	S	33.6	Very low	30.4	Very low	122 Å²	122	131 Å²	131	85%	0.853	73%	0.732	S	S	*	*	S	Bend	trans	-102.8	29.6	-165.4	52.5	0	0	0	0	115.7
154	S	36.6	Very low	31	Very low	92 Å²	92	134 Å²	134	64%	0.643	73%	0.727	S	S	*	*			trans	-118.8	5.4	-170.3	55.5	0	0	0	0	117.1	C152	C152-S154 PolarHBondContact SG-OG 2.8Å
155	C	31.9	Very low	31.3	Very low	97 Å²	97	132.3 Å²	132.3	66%	0.655	72%	0.722	S	S	*	*			trans	-107.3	34	-170.6	-58.8	0	0	0	0	116.3	L157	C155-L157 PolarHBondContact O-N 2.9Å; C155-L157 VanDerWaalsContact O-N 3.14Å
156	L	34.2	Very low	31.7	Very low	160 Å²	160	130.1 Å²	130.1	84%	0.838	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	18.1	-175.8	-90.4	166.9	0	0	0	116.5
157	L	35	Very low	32.4	Very low	156 Å²	156	129 Å²	129	82%	0.817	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-7.6	175.4	-77.2	167.9	0	0	0	114.7	C155	C155-L157 PolarHBondContact O-N 2.9Å; C155-L157 VanDerWaalsContact O-N 3.14Å
158	A	34.6	Very low	33.2	Very low	68 Å²	68	129.7 Å²	129.7	56%	0.562	70%	0.699	S	S	*	*	S	Bend	trans	-86.4	-25.2	178.7	0	0	0	0	0	114.1	S160	A158-S160 VanDerWaalsContact C-N 3.35Å; A158-S160 PolarHBondContact O-N 3.02Å
159	F	32.6	Very low	33.9	Very low	152 Å²	152	125.8 Å²	125.8	67%	0.667	69%	0.687	S	S	*	*	H	α-helix	trans	-75.7	-15.9	-171.9	-110.8	-89.2	0	0	0	115.1
160	S	33	Very low	34.6	Very low	78 Å²	78	123.7 Å²	123.7	55%	0.545	68%	0.677	S	S	.	*	H	α-helix	trans	-80.7	-26.2	179.8	49.6	0	0	0	0	113.7	A158	A158-S160 VanDerWaalsContact C-N 3.35Å; A158-S160 PolarHBondContact O-N 3.02Å
161	C	31.6	Very low	35.4	Very low	85 Å²	85	120 Å²	120	57%	0.574	67%	0.668	S	S	*	*	H	α-helix	trans	-81.2	-32.8	-177.9	-72.6	0	0	0	0	113.5	F164	C161-F164 PolarHBondContact O-N 3.09Å
162	Q	35.1	Very low	35.9	Very low	142 Å²	142	119.2 Å²	119.2	66%	0.664	66%	0.657	S	S	*	*	H	α-helix	trans	-69.4	-34.7	179.1	-79.1	-173.7	-34.9	0	0	113.4	F164 S166	Q162-F164 VanDerWaalsContact C-N 3.32Å; Q162-F164 PolarHBondContact O-N 2.72Å; Q162-S166 PolarHBondContact O-N 3.34Å; Q162-S166 PolarHBondContact O-OG 3.01Å
163	Q	37.5	Very low	36.3	Very low	125 Å²	125	121.4 Å²	121.4	58%	0.584	65%	0.654	S	S	*	*	H	α-helix	trans	-71.5	-24.2	176.9	-76.6	-170.8	-11.8	0	0	113.7	S166	Q163-S166 PolarHBondContact O-OG 3.39Å
164	F	34.9	Very low	36.4	Very low	160 Å²	160	122.1 Å²	122.1	70%	0.702	65%	0.648	S	S	*	*	H	α-helix	trans	-79.5	-30.9	-178.8	-153.9	-95.3	0	0	0	112.6	C161 Q162	C161-F164 PolarHBondContact O-N 3.09Å; Q162-F164 VanDerWaalsContact C-N 3.32Å; Q162-F164 PolarHBondContact O-N 2.72Å
165	L	36.3	Very low	36.6	Very low	124 Å²	124	120.9 Å²	120.9	65%	0.649	65%	0.649	S	S	*	*	H	α-helix	trans	-84.3	-34.8	179.9	-68.3	170.5	0	0	0	113	Q167 H168	L165-Q167 VanDerWaalsContact C-N 3.29Å; L165-Q167 PolarHBondContact O-N 3.2Å; L165-H168 PolarHBondContact O-N 3.37Å
166	S	40.9	Very low	36.6	Very low	75 Å²	75	123.5 Å²	123.5	52%	0.524	66%	0.656	S	S	.	*	H	α-helix	trans	-65.9	-28.9	-179.8	64.7	0	0	0	0	113.7	Q162 Q163 H168	Q162-S166 PolarHBondContact O-N 3.34Å; Q162-S166 PolarHBondContact O-OG 3.01Å; Q163-S166 PolarHBondContact O-OG 3.39Å; S166-H168 PolarHBondContact O-N 2.67Å
167	Q	42.6	Very low	36.5	Very low	138 Å²	138	121.5 Å²	121.5	65%	0.645	65%	0.654	S	S	*	*	H	α-helix	trans	-78.8	-17.2	-175.9	-155.5	165.7	53.9	0	0	114	L165	L165-Q167 VanDerWaalsContact C-N 3.29Å; L165-Q167 PolarHBondContact O-N 3.2Å
168	H	41.7	Very low	36.5	Very low	140 Å²	140	118.6 Å²	118.6	65%	0.648	65%	0.653	S	S	*	*	H	α-helix	trans	-98.4	-26.5	178.5	-95.9	-79.1	0	0	0	114.3	L165 S166	L165-H168 PolarHBondContact O-N 3.37Å; S166-H168 PolarHBondContact O-N 2.67Å
169	V	41.3	Very low	36.3	Very low	88 Å²	88	123.9 Å²	123.9	53%	0.533	67%	0.666	S	S	.	*	H	α-helix	trans	-77.7	-36.2	178.2	179.3	0	0	0	0	111.9	Q171 I172	V169-Q171 PolarHBondContact O-N 3.29Å; V169-I172 PolarHBondContact O-N 3.26Å; V169-I172 VanDerWaalsContact O-N 3.12Å
170	L	38.7	Very low	36.3	Very low	121 Å²	121	123.3 Å²	123.3	63%	0.634	67%	0.67	S	S	*	*	H	α-helix	trans	-68.9	-16.8	-175	-137.9	80.6	0	0	0	114.8
171	Q	39.9	Very low	36	Very low	147 Å²	147	129.3 Å²	129.3	69%	0.687	69%	0.689	S	S	*	*	H	α-helix	trans	-86.2	-10.5	175.8	-73.9	-66.9	-69	0	0	113.5	V169	V169-Q171 PolarHBondContact O-N 3.29Å
172	I	37.9	Very low	35.5	Very low	125 Å²	125	133.4 Å²	133.4	64%	0.641	70%	0.697	S	S	*	*	H	α-helix	trans	-90.6	-28.6	177.5	-62.3	176	0	0	0	110.7	V169	V169-I172 PolarHBondContact O-N 3.26Å; V169-I172 VanDerWaalsContact O-N 3.12Å
173	F	33.2	Very low	35.1	Very low	154 Å²	154	134.4 Å²	134.4	68%	0.675	70%	0.701	S	S	*	*	H	α-helix	trans	-84.6	-19.9	-179.5	-95.6	-88.3	0	0	0	115.8	G175	F173-G175 VanDerWaalsContact C-N 3.27Å; F173-G175 PolarHBondContact O-N 2.87Å
174	L	35.7	Very low	34.9	Very low	138 Å²	138	134.2 Å²	134.2	72%	0.723	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	0.6	177.4	-80.4	166.7	0	0	0	114.2
175	G	39.3	Very low	34.4	Very low	65 Å²	65	130 Å²	130	67%	0.67	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-1.1	177.9	0	0	0	0	0	115.7	F173	F173-G175 VanDerWaalsContact C-N 3.27Å; F173-G175 PolarHBondContact O-N 2.87Å
176	L	32	Very low	33.8	Very low	152 Å²	152	131.9 Å²	131.9	80%	0.796	72%	0.724	S	S	*	*	S	Bend	trans	-128.1	8.7	-169.1	-76.8	169.6	0	0	0	115.3
177	C	32.3	Very low	33	Very low	118 Å²	118	133.7 Å²	133.7	80%	0.797	74%	0.736	S	S	*	*	S	Bend	trans	-126.5	52	179.4	-65.6	0	0	0	0	112.3
178	A	34.7	Very low	32.3	Very low	95 Å²	95	132.6 Å²	132.6	79%	0.785	74%	0.744	S	S	*	*			trans	-145.6	38.2	178.5	0	0	0	0	0	113.5
179	E	31.3	Very low	32.1	Very low	180 Å²	180	132 Å²	132	84%	0.841	75%	0.752	S	S	*	*			trans	-143.4	146.2	168	-108.6	167.9	-158.8	0	0	109.8
180	N	32.2	Very low	31.3	Very low	139 Å²	139	131.5 Å²	131.5	74%	0.743	77%	0.765	S	S	*	*			trans	76.2	93	-176.6	-48	-54.4	0	0	0	117.3
181	H	27.5	Very low	30.8	Very low	204 Å²	204	132.9 Å²	132.9	94%	0.944	77%	0.768	S	S	*	*				-152.5	145.4	125	-90.8	-60.5	0	0	0	109.9
182	F	20.6	Very low	30	Very low	172 Å²	172	135.7 Å²	135.7	75%	0.754	77%	0.773	S	S	*	*			trans	-123.5	145.2	-164.4	-118.2	-67.2	0	0	0	111.3
183	H	25.6	Very low	29.4	Very low	162 Å²	162	138.1 Å²	138.1	75%	0.75	78%	0.778	S	S	*	*			trans	66.9	165.1	152.9	-74	-39.6	0	0	0	120.6
184	P	34.8	Very low	29.1	Very low	121 Å²	121	139.4 Å²	139.4	79%	0.786	79%	0.787	S	S	*	*			cis	-135.6	167.7	-18.6	29.2	-8.5	0	0	0	116.7
185	G	23	Very low	28.7	Very low	72 Å²	72	142.4 Å²	142.4	74%	0.742	80%	0.797	S	S	*	*			trans	84.8	148	151.7	0	0	0	0	0	118
186	N	24.4	Very low	27.9	Very low	164 Å²	164	142.6 Å²	142.6	88%	0.877	80%	0.799	S	S	*	*			cis	-160.3	168.6	-7.1	-142	5.7	0	0	0	111.1
187	S	25	Very low	27.7	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	81%	0.807	S	S	*	*			trans	90.1	102	165.3	-49.9	0	0	0	0	119.7
188	S	28.1	Very low	27.3	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	81%	0.81	S	S	*	*			trans	-81.2	-160.6	175.2	-25.3	0	0	0	0	113.4
189	P	37.3	Very low	26.7	Very low	126 Å²	126	154.4 Å²	154.4	82%	0.818	81%	0.814	S	S	*	*			cis	-133	170.5	-31.8	30.2	-11	0	0	0	114.3
190	G	24.6	Very low	26.3	Very low	79 Å²	79	151.8 Å²	151.8	81%	0.814	82%	0.816	S	S	*	*			trans	-151.3	92	170.2	0	0	0	0	0	114.5
191	H	27	Very low	25.9	Very low	149 Å²	149	152.6 Å²	152.6	69%	0.69	82%	0.815	S	S	*	*			trans	-70.9	156.9	176.3	-100.7	-101.3	0	0	0	112.5
192	W	24.5	Very low	25.7	Very low	207 Å²	207	149.6 Å²	149.6	78%	0.784	81%	0.811	S	S	*	*			cis	-128.7	-166	5.6	-69.2	86.1	0	0	0	109.6
193	K	24.2	Very low	25.8	Very low	175 Å²	175	145.7 Å²	145.7	76%	0.761	80%	0.804	S	S	*	*			cis	-155.8	-174.4	5.1	-150.6	146	-176.1	173.7	0	111.1
194	Q	27.9	Very low	25.6	Very low	182 Å²	182	143.3 Å²	143.3	85%	0.85	81%	0.805	S	S	*	*			trans	-131.3	151.3	174	-71	172.9	-29.6	0	0	112
195	Q	26	Very low	24.9	Very low	200 Å²	200	146.8 Å²	146.8	94%	0.935	80%	0.802	S	S	*	*			trans	-174.3	134.9	138.1	-99.8	169.3	8	0	0	105.9
196	G	23.4	Very low	24.9	Very low	69 Å²	69	153.5 Å²	153.5	71%	0.711	81%	0.812	S	S	*	*			cis	125.2	80.2	1.5	0	0	0	0	0	111.1
197	Q	27.6	Very low	24.7	Very low	205 Å²	205	152.5 Å²	152.5	96%	0.958	80%	0.802	S	S	*	*			trans	-161.3	153.7	158.3	-115.1	166.3	24	0	0	114.1
198	Q	23.8	Very low	24.7	Very low	187 Å²	187	154.5 Å²	154.5	87%	0.874	80%	0.804	S	S	*	*			trans	-98.3	168.6	-145.4	-160.8	167.4	-13.3	0	0	113.5
199	Y	22.2	Very low	24.5	Very low	221 Å²	221	154 Å²	154	87%	0.867	81%	0.806	S	S	*	*			trans	-56.2	149.6	172.3	-88.2	-118.2	0	0	0	114.2
200	S	23.4	Very low	23.8	Very low	125 Å²	125	157.6 Å²	157.6	87%	0.874	81%	0.812	S	S	*	*			trans	-146.2	107.5	136.8	60.6	0	0	0	0	112.7
201	H	22.4	Very low	23.8	Very low	157 Å²	157	157.8 Å²	157.8	73%	0.727	81%	0.814	S	S	*	*			trans	-85.8	145.4	152.4	178.1	-93.8	0	0	0	106.8
202	V	23	Very low	23.6	Very low	141 Å²	141	159.1 Å²	159.1	86%	0.855	82%	0.821	S	S	*	*			trans	-175.9	148.6	144.6	140.4	0	0	0	0	110.7
203	S	22.7	Very low	23.6	Very low	89 Å²	89	156 Å²	156	62%	0.622	82%	0.815	S	S	*	*			trans	-119.6	140.5	-176.3	53.1	0	0	0	0	112
204	C	21.7	Very low	23.6	Very low	113 Å²	113	157.4 Å²	157.4	76%	0.764	82%	0.815	S	S	*	*			trans	76	164.7	146.2	-151.3	0	0	0	0	118.8
205	W	20.8	Very low	23.3	Very low	193 Å²	193	152.7 Å²	152.7	73%	0.731	82%	0.815	S	S	*	*			trans	74.7	132.4	176.2	-67.8	69.6	0	0	0	119	E207	W205-E207 HydrophobicContact CE3-CG 4.09Å; W205-E207 HydrophobicContact CZ3-CG 4.07Å
206	F	22.2	Very low	23.1	Very low	214 Å²	214	147.2 Å²	147.2	94%	0.939	81%	0.813	S	S	*	*			trans	-153.4	135.4	133.3	-112.7	-74.5	0	0	0	109.8
207	E	21.8	Very low	23.1	Very low	143 Å²	143	147.7 Å²	147.7	67%	0.668	82%	0.818	S	S	*	*			trans	-101	171.3	171.4	-73.9	-177.9	124.1	0	0	111.2	W205	W205-E207 HydrophobicContact CE3-CG 4.09Å; W205-E207 HydrophobicContact CZ3-CG 4.07Å
208	N	23.4	Very low	22.9	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	81%	0.81	S	S	*	*			trans	-24.5	149.6	174.4	-54.6	-32.9	0	0	0	119.2
209	A	24	Very low	22.9	Very low	104 Å²	104	143.9 Å²	143.9	86%	0.86	81%	0.809	S	S	*	*			trans	-134.7	133.4	147.4	0	0	0	0	0	109.4
210	E	23.5	Very low	23.9	Very low	202 Å²	202	138.4 Å²	138.4	94%	0.944	80%	0.801	S	S	*	*			trans	-87.7	154	172.2	-64.3	-178.7	133.2	0	0	110.7
211	G	24.5	Very low	23.8	Very low	83 Å²	83	144.3 Å²	144.3	86%	0.856	80%	0.804	S	S	*	*			trans	-172.3	123.4	175.8	0	0	0	0	0	110.9
212	Q	22.8	Very low	23.8	Very low	177 Å²	177	142 Å²	142	83%	0.827	81%	0.806	S	S	*	*			trans	-127.1	141.4	-164.9	169.1	175.6	-29.4	0	0	110.7
213	E	24	Very low	23.8	Very low	141 Å²	141	139.7 Å²	139.7	66%	0.659	80%	0.801	S	S	*	*			trans	-177.7	168.5	146.7	-99.1	-70.3	124.5	0	0	111.4
214	R	25.3	Very low	23.8	Very low	204 Å²	204	146.4 Å²	146.4	77%	0.77	81%	0.813	S	S	*	*			trans	-94.8	166.3	-144.5	-56.7	156.6	-145.1	-112.2	-11.7	118.1
215	G	21.6	Very low	23.9	Very low	83 Å²	83	145.8 Å²	145.8	86%	0.856	81%	0.806	S	S	*	*			trans	86.7	146.8	145.4	0	0	0	0	0	116.6
216	G	22	Very low	24.1	Very low	85 Å²	85	145 Å²	145	88%	0.876	81%	0.81	S	S	*	*			cis	149.7	119.6	-2.1	0	0	0	0	0	110.2
217	G	21.9	Very low	24.2	Very low	79 Å²	79	143.9 Å²	143.9	81%	0.814	81%	0.808	S	S	*	*			trans	160.8	154	179.7	0	0	0	0	0	114.8
218	S	24.9	Very low	24.3	Very low	113 Å²	113	147.4 Å²	147.4	79%	0.79	82%	0.815	S	S	*	*			trans	-135.7	134.2	-169.2	-68.6	0	0	0	0	114.6
219	K	23.5	Very low	24.3	Very low	199 Å²	199	149.7 Å²	149.7	87%	0.865	82%	0.821	S	S	*	*			trans	65.5	172.5	155.3	-64.3	179.3	180	178.9	0	117.3
220	P	41.9	Very low	24.2	Very low	107 Å²	107	150.1 Å²	150.1	70%	0.695	81%	0.813	S	S	*	*				-134.8	-161.1	-53.2	41.1	-25.1	0	0	0	112.8
221	W	21.6	Very low	24.3	Very low	248 Å²	248	145.2 Å²	145.2	94%	0.939	80%	0.801	S	S	*	*			trans	74.3	153.2	174.2	-89.5	-31.7	0	0	0	117
222	S	23	Very low	24.3	Very low	109 Å²	109	152.2 Å²	152.2	76%	0.762	80%	0.802	S	S	*	*			cis	-153	175.6	-4.9	49.3	0	0	0	0	111.6
223	A	22	Very low	24.4	Very low	92 Å²	92	148.1 Å²	148.1	76%	0.76	80%	0.798	S	S	*	*			trans	-83.8	153.5	-169.5	0	0	0	0	0	116.3
224	R	23.8	Very low	24.6	Very low	230 Å²	230	151 Å²	151	87%	0.868	81%	0.809	S	S	*	*			trans	-162.9	92.5	146.5	-159	166.7	-78.7	-144.9	-1.6	108.1
225	T	22.7	Very low	24.7	Very low	101 Å²	101	147.1 Å²	147.1	62%	0.62	81%	0.81	S	S	*	*				53.1	122.3	103.8	60.3	0	0	0	0	115.8
226	E	24.8	Very low	24.8	Very low	176 Å²	176	148.7 Å²	148.7	82%	0.822	81%	0.808	S	S	*	*			trans	78.2	141.3	143.6	-72.1	160.7	-172.2	0	0	117.5
227	E	24.9	Very low	25.5	Very low	190 Å²	190	150.4 Å²	150.4	89%	0.888	80%	0.804	S	S	*	*			cis	-127.8	179	8.8	-71.7	-170.1	120.3	0	0	114.1
228	R	24.5	Very low	25.6	Very low	217 Å²	217	155.5 Å²	155.5	82%	0.819	81%	0.811	S	S	*	*			trans	-140.5	105.5	-164.6	167.9	-139.5	-165.1	170.4	5.8	110.3
229	E	22.3	Very low	25.7	Very low	203 Å²	203	157.9 Å²	157.9	95%	0.949	81%	0.81	S	S	*	*			trans	-127.7	96.5	165.3	-73.6	-132.6	124.1	0	0	112.9
230	T	23.2	Very low	25.6	Very low	113 Å²	113	159 Å²	159	69%	0.693	81%	0.808	S	S	*	*			trans	-94.4	130.4	155.6	47.5	0	0	0	0	109.1
231	S	24.8	Very low	24.8	Very low	99 Å²	99	163.7 Å²	163.7	69%	0.692	82%	0.821	S	S	*	*				169.5	128.4	125.1	-83.7	0	0	0	0	117.5
232	R	25.9	Very low	24.9	Very low	231 Å²	231	157.6 Å²	157.6	87%	0.872	82%	0.816	S	S	*	*				51.3	127.7	122.2	-58.2	-178.9	179.6	175.8	3	122.7
233	A	23.5	Very low	24.9	Very low	91 Å²	91	157.4 Å²	157.4	75%	0.752	82%	0.822	S	S	*	*				98.3	150.7	119	0	0	0	0	0	122.1
234	F	28.2	Very low	25.1	Very low	200 Å²	200	158.6 Å²	158.6	88%	0.877	83%	0.825	S	S	*	*			trans	-37.8	157.3	176.2	-63.2	-95.4	0	0	0	117.6
235	P	27.2	Very low	25.5	Very low	123 Å²	123	153.3 Å²	153.3	80%	0.799	82%	0.82	S	S	*	*				-132.3	156.1	128.4	37.2	-27.7	0	0	0	115.9
236	S	24.3	Very low	25.6	Very low	116 Å²	116	160.6 Å²	160.6	81%	0.811	84%	0.836	S	S	*	*			trans	-161.1	155.5	159.6	-76.8	0	0	0	0	106.5
237	P	37	Very low	25.6	Very low	121 Å²	121	162.4 Å²	162.4	79%	0.786	84%	0.841	S	S	*	*			cis	-124.1	173.5	-9.7	39.5	-25.2	0	0	0	113.1
238	L	23.7	Very low	25.6	Very low	186 Å²	186	156.3 Å²	156.3	97%	0.974	83%	0.83	S	S	*	*			trans	-132.9	154.1	159.2	-91.3	174.3	0	0	0	111
239	Q	26.2	Very low	25.7	Very low	163 Å²	163	154 Å²	154	76%	0.762	83%	0.834	S	S	*	*			trans	-122.2	134.4	-157.5	178.9	171.3	-24	0	0	112.2
240	R	22.9	Very low	25.8	Very low	222 Å²	222	152.9 Å²	152.9	84%	0.838	83%	0.83	S	S	*	*			trans	50.4	122.1	165.5	-69.6	-177.4	-178.7	-165.4	0.4	118.6
241	Q	24.3	Very low	25.8	Very low	206 Å²	206	154 Å²	154	96%	0.963	84%	0.837	S	S	*	*				-150.1	153.9	118.5	-112.9	169.2	75.5	0	0	110.8
242	S	23.4	Very low	25.8	Very low	120 Å²	120	155.1 Å²	155.1	84%	0.839	84%	0.84	S	S	*	*			trans	-114.3	131.7	-168.2	48.8	0	0	0	0	111.6
243	A	22.9	Very low	25.7	Very low	106 Å²	106	152.6 Å²	152.6	88%	0.876	84%	0.838	S	S	*	*			trans	-146.7	139.3	165.6	0	0	0	0	0	110.6
244	S	27	Very low	25.7	Very low	117 Å²	117	154.8 Å²	154.8	82%	0.818	84%	0.842	S	S	*	*			trans	-115.5	-177.2	176.9	-141.2	0	0	0	0	109.3
245	P	31	Very low	25.6	Very low	119 Å²	119	153.2 Å²	153.2	77%	0.773	84%	0.837	S	S	*	*				-107	147.9	-121.7	26.8	-8.1	0	0	0	114.2
246	R	25.5	Very low	25.7	Very low	253 Å²	253	153 Å²	153	96%	0.955	84%	0.836	S	S	*	*			trans	-88.3	117.9	168.5	-78.6	-172.6	172.4	-171.6	-2.3	111.4
247	K	25.7	Very low	25.7	Very low	214 Å²	214	152.4 Å²	152.4	93%	0.93	83%	0.831	S	S	*	*			trans	-76.6	153.2	154.3	-83.7	-178.4	172.9	180	0	109.4
248	G	24.1	Very low	25.1	Very low	63 Å²	63	151.9 Å²	151.9	65%	0.649	83%	0.831	S	S	*	*			trans	158.6	96.6	163.8	0	0	0	0	0	113.5
249	N	27	Very low	25.1	Very low	169 Å²	169	147.9 Å²	147.9	90%	0.904	83%	0.825	S	S	*	*				-176.7	133.6	106.2	-87.4	-4.5	0	0	0	111.1
250	M	23.5	Very low	25.1	Very low	178 Å²	178	149.3 Å²	149.3	88%	0.877	83%	0.831	S	S	*	*			trans	-95	152	167.5	-68	162.8	56.2	0	0	108.9
251	V	24	Very low	25.3	Very low	137 Å²	137	149.6 Å²	149.6	83%	0.83	83%	0.832	S	S	*	*			trans	-134.7	104.8	155.6	179.8	0	0	0	0	109
252	V	25.4	Very low	25.5	Very low	123 Å²	123	145.8 Å²	145.8	75%	0.745	83%	0.826	S	S	*	*			trans	34.2	120.3	142.3	-171.7	0	0	0	0	119.3
253	E	22.2	Very low	25.6	Very low	178 Å²	178	146.7 Å²	146.7	83%	0.832	82%	0.821	S	S	*	*			trans	-80.9	153.3	160.9	-60.7	-178.8	148.3	0	0	111.8
254	T	23.9	Very low	26.1	Very low	137 Å²	137	147.2 Å²	147.2	84%	0.84	82%	0.815	S	S	*	*			trans	-142.4	109.6	156.2	23	0	0	0	0	109.5
255	E	25.6	Very low	26	Very low	167 Å²	167	147.5 Å²	147.5	78%	0.78	81%	0.812	S	S	*	*			trans	-104.8	159.1	164.5	-81.2	-74.4	145.3	0	0	108.3
256	P	31.3	Very low	25.8	Very low	118 Å²	118	150.5 Å²	150.5	77%	0.766	82%	0.816	S	S	*	*				-150	156.7	101.7	38.1	-21.9	0	0	0	117.7
257	S	22.7	Very low	25.7	Very low	103 Å²	103	146 Å²	146	72%	0.72	81%	0.81	S	S	*	*			trans	105	87.1	136.1	-130.8	0	0	0	0	120.6
258	S	25	Very low	25.7	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	80%	0.797	S	S	*	*				35	126	125.9	66.4	0	0	0	0	122.4
259	A	23	Very low	25.7	Very low	102 Å²	102	147.8 Å²	147.8	84%	0.843	81%	0.805	S	S	*	*			trans	-144.8	148.4	137	0	0	0	0	0	110
260	Q	26.4	Very low	25.6	Very low	193 Å²	193	143.2 Å²	143.2	90%	0.902	80%	0.799	S	S	*	*			trans	-83.8	164.8	-164.9	-72.5	134	-52.8	0	0	115.7
261	R	27.8	Very low	25.7	Very low	227 Å²	227	143 Å²	143	86%	0.857	80%	0.8	S	S	*	*			trans	-65.1	171	167.1	-54.1	177.3	176.4	174.3	-1.7	111.1
262	P	28.4	Very low	25.8	Very low	127 Å²	127	145.7 Å²	145.7	83%	0.825	80%	0.801	S	S	*	*				-137.2	164.5	88.7	36.4	-24.1	0	0	0	114.6
263	N	26.2	Very low	25.7	Very low	138 Å²	138	148.6 Å²	148.6	74%	0.738	81%	0.806	S	S	*	*			trans	-138.1	123.6	169.6	-174.3	29.5	0	0	0	107.3
264	P	31.8	Very low	25.9	Very low	117 Å²	117	147.2 Å²	147.2	76%	0.76	80%	0.804	S	S	*	*			trans	-115.9	140.9	166	14.3	6.4	0	0	0	112.7
265	V	25.6	Very low	26	Very low	124 Å²	124	149.8 Å²	149.8	75%	0.752	81%	0.806	S	S	*	*			trans	-98.3	142.6	171.4	172	0	0	0	0	108.3
266	Q	26.5	Very low	26.1	Very low	181 Å²	181	147.3 Å²	147.3	85%	0.846	80%	0.802	S	S	*	*				174.8	158.2	128.3	-98.3	-179.6	-4.2	0	0	116
267	L	24.3	Very low	25.9	Very low	158 Å²	158	150.2 Å²	150.2	83%	0.827	81%	0.811	S	S	*	*			trans	89	65.9	154.1	-125.7	69.6	0	0	0	121.6
268	D	25.1	Very low	26.2	Very low	125 Å²	125	156.1 Å²	156.1	67%	0.668	82%	0.817	S	S	*	*				9.4	123.2	118.3	-168.9	32.8	0	0	0	119.5
269	K	25.1	Very low	26.4	Very low	190 Å²	190	160.9 Å²	160.9	83%	0.826	82%	0.824	S	S	*	*				159.8	126.8	115.9	-83.9	-176.7	-174.2	173.6	0	113.6
270	G	24.1	Very low	26.5	Very low	74 Å²	74	159.5 Å²	159.5	76%	0.763	82%	0.82	S	S	*	*			trans	-178.4	123.5	170.1	0	0	0	0	0	110.5
271	L	25.6	Very low	26.5	Very low	174 Å²	174	155.1 Å²	155.1	91%	0.911	82%	0.817	S	S	*	*			trans	-66.5	153.6	-161.1	-97	75.1	0	0	0	116.4
272	K	24.9	Very low	26.6	Very low	192 Å²	192	152.2 Å²	152.2	84%	0.835	82%	0.817	S	S	*	*			trans	-38.6	144.8	156.7	-57.9	166.7	175.2	177.2	0	113.4
273	E	25.3	Very low	26.4	Very low	184 Å²	184	153.7 Å²	153.7	86%	0.86	82%	0.817	S	S	*	*				-168.9	160	123.2	-110.1	168.9	-160.2	0	0	113
274	L	26.2	Very low	26.3	Very low	150 Å²	150	152.8 Å²	152.8	79%	0.785	82%	0.82	S	S	*	*			trans	67.7	65.3	167	-75	153.9	0	0	0	119.5
275	E	26	Very low	26.1	Very low	191 Å²	191	158.5 Å²	158.5	89%	0.893	83%	0.827	S	S	*	*			trans	-90.4	80.7	149.9	-174	178.3	-144.1	0	0	110.4
276	T	26.1	Very low	26	Very low	114 Å²	114	160.5 Å²	160.5	70%	0.699	83%	0.828	S	S	*	*			trans	-171.7	106.3	159.8	0.3	0	0	0	0	112.3
277	L	28.6	Very low	25.9	Very low	179 Å²	179	162.9 Å²	162.9	94%	0.937	83%	0.831	S	S	*	*			trans	-166.9	103.3	132.7	-107	163	0	0	0	111.7
278	R	27.5	Very low	25.9	Very low	227 Å²	227	163.3 Å²	163.3	86%	0.857	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-54.7	146.5	-178.9	-174.1	175.9	-65.7	-169.1	-1.2	113.6	G280	R278-G280 PolarHBondContact O-N 3.12Å
279	F	29.4	Very low	26.1	Very low	212 Å²	212	162.8 Å²	162.8	93%	0.93	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-50.5	128.5	168.3	-76.8	-101.8	0	0	0	112.1
280	G	25.2	Very low	26.1	Very low	72 Å²	72	160.7 Å²	160.7	74%	0.742	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-96.9	122.9	170.3	0	0	0	0	0	111.6	R278	R278-G280 PolarHBondContact O-N 3.12Å
281	A	27.3	Very low	26.4	Very low	102 Å²	102	164.4 Å²	164.4	84%	0.843	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-75.3	144.9	168.3	0	0	0	0	0	110.3
282	I	28.4	Very low	26.3	Very low	166 Å²	166	162.9 Å²	162.9	85%	0.851	82%	0.82	S	S	*	*			trans	-116.1	114	167.4	-60.5	-180	0	0	0	107.7
283	N	25.6	Very low	26.5	Very low	157 Å²	157	161.2 Å²	161.2	84%	0.84	82%	0.819	S	S	*	*			trans	-89.2	144.7	174.9	-159.2	3.1	0	0	0	109.1
284	C	24.7	Very low	26.5	Very low	119 Å²	119	160.1 Å²	160.1	80%	0.804	81%	0.814	S	S	*	*			trans	-79.1	141.4	177.7	-64.1	0	0	0	0	110.5
285	R	25.8	Very low	26.6	Very low	238 Å²	238	157.3 Å²	157.3	90%	0.898	81%	0.807	S	S	*	*			trans	-150.9	149.1	157.4	-125.4	176.4	-178.2	170.7	0.9	111.4
286	E	25.2	Very low	26.6	Very low	166 Å²	166	155.9 Å²	155.9	78%	0.776	81%	0.806	S	S	*	*			trans	-76.7	151.8	-169	-53.7	108	147.7	0	0	113.6
287	Y	22.6	Very low	26.8	Very low	231 Å²	231	159.9 Å²	159.9	91%	0.906	81%	0.814	S	S	*	*			trans	-159.4	146.7	132.8	-134.6	-102.3	0	0	0	112.2
288	E	24.4	Very low	26.8	Very low	167 Å²	167	158.7 Å²	158.7	78%	0.78	81%	0.807	S	S	*	*			trans	-74.7	153.4	179.8	-66.1	-71.7	143.6	0	0	112.6
289	P	29.6	Very low	26.8	Very low	114 Å²	114	153.8 Å²	153.8	74%	0.74	80%	0.802	S	S	*	*			trans	-105.9	131.2	166.1	35.6	-25.3	0	0	0	112.3
290	D	25.4	Very low	27	Very low	146 Å²	146	151 Å²	151	78%	0.781	80%	0.797	S	S	*	*			trans	-135.7	143.9	169.7	-131.4	-19.7	0	0	0	112.3
291	H	29.7	Very low	27.7	Very low	152 Å²	152	152.6 Å²	152.6	70%	0.704	79%	0.794	S	S	*	*			trans	63.2	110.8	170.4	-75.4	-73.8	0	0	0	123.6
292	N	24.8	Very low	28.1	Very low	141 Å²	141	157.8 Å²	157.8	75%	0.754	79%	0.792	S	S	*	*				24.2	127.8	129	-63.8	-16.6	0	0	0	121.4
293	L	28.2	Very low	28.6	Very low	158 Å²	158	157 Å²	157	83%	0.827	80%	0.795	S	S	*	*				-167.1	175.2	95.5	-141.9	67.1	0	0	0	112.9
294	E	25.5	Very low	29.6	Very low	160 Å²	160	155.2 Å²	155.2	75%	0.748	79%	0.785	S	S	*	*			trans	-72	157.4	-154.9	-68	163.1	108.6	0	0	120.2
295	S	28.9	Very low	30.6	Very low	92 Å²	92	158.3 Å²	158.3	64%	0.643	79%	0.792	S	S	*	*			trans	32.5	132.5	142.2	74.9	0	0	0	0	122.4
296	N	26.7	Very low	31.6	Very low	160 Å²	160	150 Å²	150	86%	0.856	78%	0.782	S	S	*	*				-164.6	157	105	-100.7	-57.7	0	0	0	113.1
297	F	28.5	Very low	33	Very low	199 Å²	199	150.4 Å²	150.4	87%	0.873	78%	0.781	S	S	*	*			trans	-88.4	170.5	179.4	-94.6	-106.9	0	0	0	112.7
298	I	29.4	Very low	35.1	Very low	153 Å²	153	144.9 Å²	144.9	79%	0.785	76%	0.761	S	S	*	*			trans	117.3	120.1	149.4	-56	-173.7	0	0	0	116.8
299	T	27.4	Very low	37.4	Very low	125 Å²	125	141.1 Å²	141.1	77%	0.767	75%	0.751	S	S	*	*			trans	66.3	106.1	161.1	49.8	0	0	0	0	124
300	N	34.4	Very low	39.6	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	73%	0.732	S	S	*	*				8.5	151.7	125.3	-87.2	-44.2	0	0	0	120.2
301	P	40	Very low	42.1	Very low	106 Å²	106	138 Å²	138	69%	0.688	72%	0.721	S	S	*	*			cis	-152.6	164.2	38.8	38.9	-16.9	0	0	0	120.8
302	R	35.4	Very low	44.6	Very low	211 Å²	211	130.8 Å²	130.8	80%	0.796	69%	0.688	S	S	*	*			trans	57	120	146.2	-70.3	171.2	-177.7	167.1	1.3	121.7
303	T	38.1	Very low	47.2	Very low	150 Å²	150	128.7 Å²	128.7	92%	0.92	69%	0.685	S	S	*	*				-137	132.7	117.7	19.3	0	0	0	0	110.6
304	L	46.2	Very low	49.5	Very low	118 Å²	118	124.6 Å²	124.6	62%	0.618	66%	0.664	S	S	*	*			trans	-108.6	95.5	-173.6	-81.6	157.1	0	0	0	110.6
305	L	46.3	Very low	52.2	Low	184 Å²	184	119.3 Å²	119.3	96%	0.963	64%	0.644	S	S	*	*			trans	-153.1	122.3	159.7	-144.3	69.2	0	0	0	111.4
306	G	47.3	Very low	54.6	Low	65 Å²	65	117.6 Å²	117.6	67%	0.67	64%	0.64	S	S	*	*			trans	97.9	33.4	175.1	0	0	0	0	0	116.9	K308	G306-K308 PolarHBondContact O-N 2.79Å
307	K	54.4	Low	57.1	Low	174 Å²	174	117.7 Å²	117.7	76%	0.757	63%	0.628	S	S	*	*			trans	-54.2	126.6	161.1	-73.4	-172.1	178.1	-176.8	0	108.6	P309	K307-P309 WeakPolarHBondContact O-CD 3.15Å
308	K	66.3	Low	59.5	Low	114 Å²	114	110.7 Å²	110.7	50%	0.496	60%	0.604	S	S	.	*			trans	-107	82.7	173.5	-72.2	-172.4	-164.6	165.7	0	108.1	G306 Y310 S318 F319	G306-K308 PolarHBondContact O-N 2.79Å; K308-Y310 PolarHBondContact O-N 3.2Å; K308-S318 VanDerWaalsContact CD-O 3.23Å; K308-S318 WeakPolarHBondContact CD-O 3.4Å; K308-S318 WeakPolarHBondContact O-CB 3.37Å; K308-F319 CarbonylContact C-O 3.59Å; K308-F319 VanDerWaalsContact CA-O 3.26Å; K308-F319 WeakPolarHBondContact CA-O 3.43Å; K308-F319 WeakPolarHBondContact CB-O 3.25Å
309	P	71.8	Confident	62.2	Low	88 Å²	88	105.2 Å²	105.2	57%	0.571	58%	0.575	S	S	*	*			trans	-72.7	-10.5	-164.7	28.3	-35	0	0	0	114.3	K307	K307-P309 WeakPolarHBondContact O-CD 3.15Å
310	Y	76.6	Confident	64.9	Low	87 Å²	87	106.6 Å²	106.6	34%	0.341	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.8	98.5	-176.3	-60.6	-77.8	0	0	0	110	K308 S318 F319 D321 R322	K308-Y310 PolarHBondContact O-N 3.2Å; Y310-S318 CarbonylContact O-C 3.58Å; Y310-F319 PolarHBondContact N-O 3.27Å; Y310-F319 WeakPolarHBondContact O-CB 3.32Å; Y310-F319 PolarHBondContact O-N 2.81Å; Y310-D321 VanDerWaalsContact CE2-CA 3.49Å; Y310-R322 HydrophobicContact CD1-CB 3.83Å; Y310-R322 HydrophobicContact CD1-CG 4.12Å; Y310-R322 HydrophobicContact CE1-CB 3.58Å; Y310-R322 HydrophobicContact CE1-CG 4.05Å; Y310-R322 HydrophobicContact CG-CB 4.42Å
311	I	77.4	Confident	67.2	Low	108 Å²	108	101.6 Å²	101.6	55%	0.554	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.8	-178.7	-55.3	177.2	0	0	0	110	R317	I311-R317 WeakPolarHBondContact CA-O 3.3Å
312	C	84	Confident	69.1	Low	1 Å²	1	104.6 Å²	104.6	1%	0.007	54%	0.541	C	S	.	.			trans	-78	119.9	171.4	-176.1	0	0	0	0	110.4	D314 G316 R317 F319 L325 H329	C312-D314 PolarHBondContact O-N 3.42Å; C312-G316 VanDerWaalsContact O-CA 3.3Å; C312-G316 WeakPolarHBondContact O-CA 3.44Å; C312-G316 PolarHBondContact O-N 3.14Å; C312-R317 PolarHBondContact N-O 3.24Å; C312-F319 HydrophobicContact CB-CE2 4.13Å; C312-L325 HydrophobicContact CB-CD1 3.63Å; C312-H329 VanDerWaalsContact SG-CE1 3.5Å
313	S	79.2	Confident	71.2	Confident	97 Å²	97	98.8 Å²	98.8	68%	0.678	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-39.3	173.3	42.9	0	0	0	0	112.6	C315	S313-C315 PolarHBondContact O-N 2.73Å
314	D	75.7	Confident	73.2	Confident	72 Å²	72	92.7 Å²	92.7	39%	0.385	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-13.6	-163.9	-35.6	-34.9	0	0	0	112.8	C312 H329 H332	C312-D314 PolarHBondContact O-N 3.42Å; D314-H329 IonicContact OD2-CE1 3.47Å; D314-H329 PolarHBondContact OD2-CE1 3.24Å; D314-H329 IonicContact OD2-ND1 3.09Å; D314-H329 PolarHBondContact OD2-ND1 3.19Å; D314-H332 IonicContact OD2-CD2 3.38Å; D314-H332 PolarHBondContact OD2-CD2 3.25Å; D314-H332 IonicContact OD2-CG 3.21Å
315	C	83.1	Confident	74.9	Confident	49 Å²	49	88 Å²	88	33%	0.331	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.8	10.9	-180	72.1	0	0	0	0	115.9	S313 R317 H328 H332	S313-C315 PolarHBondContact O-N 2.73Å; C315-R317 PolarHBondContact O-N 3.22Å; C315-H328 PolarHBondContact SG-NE2 3.43Å; C315-H332 VanDerWaalsContact CB-NE2 3.28Å; C315-H332 WeakPolarHBondContact CB-NE2 3.32Å
316	G	77.6	Confident	76.5	Confident	55 Å²	55	83 Å²	83	57%	0.567	45%	0.445	S	S	*	.			trans	66.5	2.8	176.8	0	0	0	0	0	116.1	C312 S318	C312-G316 VanDerWaalsContact O-CA 3.3Å; C312-G316 WeakPolarHBondContact O-CA 3.44Å; C312-G316 PolarHBondContact O-N 3.14Å; G316-S318 PolarHBondContact O-N 3.4Å
317	R	80.1	Confident	78.1	Confident	162 Å²	162	85.4 Å²	85.4	61%	0.611	43%	0.433	S	S	*	.			trans	-72.3	131.4	-176.8	-73	-177.6	177	-160.1	-1	111.7	I311 C312 C315 F319	I311-R317 WeakPolarHBondContact CA-O 3.3Å; C312-R317 PolarHBondContact N-O 3.24Å; C315-R317 PolarHBondContact O-N 3.22Å; R317-F319 HydrophobicContact CB-CE2 3.58Å; R317-F319 HydrophobicContact CB-CZ 3.81Å; R317-F319 VanDerWaalsContact O-CD2 3.27Å; R317-F319 WeakPolarHBondContact O-CD2 3.24Å; R317-F319 WeakPolarHBondContact O-CE2 3.23Å
318	S	79.4	Confident	79.4	Confident	53 Å²	53	77.8 Å²	77.8	37%	0.371	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.2	176.6	61.5	0	0	0	0	112.7	K308 Y310 G316	K308-S318 VanDerWaalsContact CD-O 3.23Å; K308-S318 WeakPolarHBondContact CD-O 3.4Å; K308-S318 WeakPolarHBondContact O-CB 3.37Å; Y310-S318 CarbonylContact O-C 3.58Å; G316-S318 PolarHBondContact O-N 3.4Å
319	F	85.6	Confident	79.9	Confident	38 Å²	38	74.8 Å²	74.8	17%	0.167	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	150.9	-176.1	-62.9	-87.2	0	0	0	111.5	K308 Y310 C312 R317 L325 H328	K308-F319 CarbonylContact C-O 3.59Å; K308-F319 VanDerWaalsContact CA-O 3.26Å; K308-F319 WeakPolarHBondContact CA-O 3.43Å; K308-F319 WeakPolarHBondContact CB-O 3.25Å; Y310-F319 PolarHBondContact N-O 3.27Å; Y310-F319 WeakPolarHBondContact O-CB 3.32Å; Y310-F319 PolarHBondContact O-N 2.81Å; C312-F319 HydrophobicContact CB-CE2 4.13Å; R317-F319 HydrophobicContact CB-CE2 3.58Å; R317-F319 HydrophobicContact CB-CZ 3.81Å; R317-F319 VanDerWaalsContact O-CD2 3.27Å; R317-F319 WeakPolarHBondContact O-CD2 3.24Å; R317-F319 WeakPolarHBondContact O-CE2 3.23Å; F319-L325 HydrophobicContact CB-CB 4.16Å; F319-L325 HydrophobicContact CD2-CB 4.13Å; F319-L325 HydrophobicContact CD2-CD1 3.65Å; F319-L325 HydrophobicContact CE2-CD1 3.98Å; F319-L325 HydrophobicContact CG-CB 4.26Å; F319-H328 HydrophobicContact CE1-CB 3.84Å; F319-H328 AromaticContact CE1-CG 3.94Å; F319-H328 HydrophobicContact CE2-CB 4.04Å; F319-H328 AromaticContact CE2-CD2 3.28Å; F319-H328 WeakPolarHBondContact CE2-CD2 3.44Å; F319-H328 AromaticContact CE2-CG 3.7Å; F319-H328 AromaticContact CE2-NE2 3.94Å; F319-H328 HydrophobicContact CZ-CB 3.54Å; F319-H328 AromaticContact CZ-CD2 3.24Å; F319-H328 WeakPolarHBondContact CZ-CD2 3.38Å; F319-H328 AromaticContact CZ-CG 3.18Å; F319-H328 AromaticContact CZ-ND1 3.74Å; F319-H328 AromaticContact CZ-NE2 3.76Å
320	K	83.9	Confident	80.4	Confident	153 Å²	153	73.4 Å²	73.4	67%	0.665	37%	0.371	S	S	*	.	S	Bend	trans	-75.5	-25.5	-175.7	60.2	164.7	-171.4	161	0	113.7
321	D	83	Confident	80.3	Confident	49 Å²	49	74.3 Å²	74.3	26%	0.262	38%	0.381	S	S	.	.	S	Bend	trans	-145.9	156.5	-177.1	60.2	56.7	0	0	0	111	Y310 S323 T324 L325	Y310-D321 VanDerWaalsContact CE2-CA 3.49Å; D321-S323 VanDerWaalsContact C-N 3.25Å; D321-S323 PolarHBondContact O-N 3.47Å; D321-S323 PolarHBondContact OD1-N 2.78Å; D321-T324 VanDerWaalsContact CG-OG1 3.26Å; D321-T324 PolarHBondContact O-N 3.01Å; D321-T324 PolarHBondContact O-OG1 3.17Å; D321-T324 WeakPolarHBondContact OD1-CA 3.31Å; D321-T324 VanDerWaalsContact OD1-CB 3.24Å; D321-T324 WeakPolarHBondContact OD1-CB 3.33Å; D321-T324 VanDerWaalsContact OD1-CG2 3.24Å; D321-T324 WeakPolarHBondContact OD1-CG2 3.26Å; D321-T324 PolarHBondContact OD1-N 3.47Å; D321-T324 PolarHBondContact OD1-OG1 3.36Å; D321-L325 PolarHBondContact O-N 3.2Å
322	R	79.1	Confident	80.3	Confident	168 Å²	168	73.6 Å²	73.6	63%	0.634	38%	0.375	S	S	*	.	H	α-helix	trans	-62.2	-34.5	-178.7	-163.3	178.5	174.5	111.4	-2.2	111.8	Y310 T324 L325 I326	Y310-R322 HydrophobicContact CD1-CB 3.83Å; Y310-R322 HydrophobicContact CD1-CG 4.12Å; Y310-R322 HydrophobicContact CE1-CB 3.58Å; Y310-R322 HydrophobicContact CE1-CG 4.05Å; Y310-R322 HydrophobicContact CG-CB 4.42Å; R322-T324 PolarHBondContact O-N 2.81Å; R322-L325 PolarHBondContact O-N 3.07Å; R322-I326 HydrophobicContact CG-CD1 3.96Å; R322-I326 HydrophobicContact CG-CG1 4.42Å; R322-I326 VanDerWaalsContact O-CG1 3.3Å; R322-I326 WeakPolarHBondContact O-CG1 3.29Å; R322-I326 PolarHBondContact O-N 3.02Å
323	S	80.1	Confident	79.9	Confident	90 Å²	90	76.5 Å²	76.5	63%	0.629	40%	0.396	S	S	*	.	H	α-helix	trans	-64.8	-37.3	-179.2	-56	0	0	0	0	112.8	D321 R327	D321-S323 VanDerWaalsContact C-N 3.25Å; D321-S323 PolarHBondContact O-N 3.47Å; D321-S323 PolarHBondContact OD1-N 2.78Å; S323-R327 WeakPolarHBondContact O-CB 3.32Å; S323-R327 PolarHBondContact O-N 3.02Å
324	T	81.1	Confident	79.4	Confident	21 Å²	21	77.7 Å²	77.7	13%	0.129	39%	0.392	C	S	.	.	H	α-helix	trans	-75.9	-32.6	175.7	49.2	0	0	0	0	112.3	D321 R322 H328	D321-T324 VanDerWaalsContact CG-OG1 3.26Å; D321-T324 PolarHBondContact O-N 3.01Å; D321-T324 PolarHBondContact O-OG1 3.17Å; D321-T324 WeakPolarHBondContact OD1-CA 3.31Å; D321-T324 VanDerWaalsContact OD1-CB 3.24Å; D321-T324 WeakPolarHBondContact OD1-CB 3.33Å; D321-T324 VanDerWaalsContact OD1-CG2 3.24Å; D321-T324 WeakPolarHBondContact OD1-CG2 3.26Å; D321-T324 PolarHBondContact OD1-N 3.47Å; D321-T324 PolarHBondContact OD1-OG1 3.36Å; R322-T324 PolarHBondContact O-N 2.81Å; T324-H328 WeakPolarHBondContact O-CB 3.23Å; T324-H328 PolarHBondContact O-N 3.08Å
325	L	81.8	Confident	79.2	Confident	19 Å²	19	79 Å²	79	10%	0.099	40%	0.396	C	S	.	.	H	α-helix	trans	-64.3	-50.5	168.5	175.5	61.6	0	0	0	111.7	C312 F319 D321 R322 R327 H328 H329	C312-L325 HydrophobicContact CB-CD1 3.63Å; F319-L325 HydrophobicContact CB-CB 4.16Å; F319-L325 HydrophobicContact CD2-CB 4.13Å; F319-L325 HydrophobicContact CD2-CD1 3.65Å; F319-L325 HydrophobicContact CE2-CD1 3.98Å; F319-L325 HydrophobicContact CG-CB 4.26Å; D321-L325 PolarHBondContact O-N 3.2Å; R322-L325 PolarHBondContact O-N 3.07Å; L325-R327 VanDerWaalsContact C-N 3.31Å; L325-R327 PolarHBondContact O-N 3.29Å; L325-H328 CarbonylContact O-C 3.57Å; L325-H328 WeakPolarHBondContact O-CA 3.29Å; L325-H328 WeakPolarHBondContact O-CB 3.18Å; L325-H328 PolarHBondContact O-N 2.82Å; L325-H329 WeakPolarHBondContact CD1-NE2 3.42Å; L325-H329 PolarHBondContact O-CD2 3.16Å; L325-H329 PolarHBondContact O-N 3.29Å
326	I	79.4	Confident	79	Confident	81 Å²	81	82.2 Å²	82.2	42%	0.415	40%	0.404	S	S	.	.	H	α-helix	trans	-57.6	-44.7	176.5	-69.7	164.5	0	0	0	110.7	R322 H328 H329 R330	R322-I326 HydrophobicContact CG-CD1 3.96Å; R322-I326 HydrophobicContact CG-CG1 4.42Å; R322-I326 VanDerWaalsContact O-CG1 3.3Å; R322-I326 WeakPolarHBondContact O-CG1 3.29Å; R322-I326 PolarHBondContact O-N 3.02Å; I326-H328 PolarHBondContact O-N 3.36Å; I326-H329 PolarHBondContact O-N 2.75Å; I326-R330 PolarHBondContact O-N 3.34Å
327	R	80.6	Confident	79.3	Confident	114 Å²	114	83 Å²	83	43%	0.43	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-22.8	175.4	-170.7	177.8	73.5	176	-0	113.2	S323 L325 Q349	S323-R327 WeakPolarHBondContact O-CB 3.32Å; S323-R327 PolarHBondContact O-N 3.02Å; L325-R327 VanDerWaalsContact C-N 3.31Å; L325-R327 PolarHBondContact O-N 3.29Å; R327-Q349 HydrophobicContact CG-CG 3.98Å
328	H	81.4	Confident	79.4	Confident	14 Å²	14	79 Å²	79	7%	0.065	38%	0.384	C	S	.	.	H	α-helix	trans	-85.3	-39.4	174.9	173	64	0	0	0	112.5	C315 F319 T324 L325 I326 R330 I331	C315-H328 PolarHBondContact SG-NE2 3.43Å; F319-H328 HydrophobicContact CE1-CB 3.84Å; F319-H328 AromaticContact CE1-CG 3.94Å; F319-H328 HydrophobicContact CE2-CB 4.04Å; F319-H328 AromaticContact CE2-CD2 3.28Å; F319-H328 WeakPolarHBondContact CE2-CD2 3.44Å; F319-H328 AromaticContact CE2-CG 3.7Å; F319-H328 AromaticContact CE2-NE2 3.94Å; F319-H328 HydrophobicContact CZ-CB 3.54Å; F319-H328 AromaticContact CZ-CD2 3.24Å; F319-H328 WeakPolarHBondContact CZ-CD2 3.38Å; F319-H328 AromaticContact CZ-CG 3.18Å; F319-H328 AromaticContact CZ-ND1 3.74Å; F319-H328 AromaticContact CZ-NE2 3.76Å; T324-H328 WeakPolarHBondContact O-CB 3.23Å; T324-H328 PolarHBondContact O-N 3.08Å; L325-H328 CarbonylContact O-C 3.57Å; L325-H328 WeakPolarHBondContact O-CA 3.29Å; L325-H328 WeakPolarHBondContact O-CB 3.18Å; L325-H328 PolarHBondContact O-N 2.82Å; I326-H328 PolarHBondContact O-N 3.36Å; H328-R330 PolarHBondContact O-N 2.86Å; H328-I331 WeakPolarHBondContact O-CB 3.24Å; H328-I331 WeakPolarHBondContact O-CG1 3.48Å; H328-I331 PolarHBondContact O-N 2.97Å
329	H	77.8	Confident	79.6	Confident	51 Å²	51	80.5 Å²	80.5	24%	0.236	39%	0.391	C	S	.	.	H	α-helix	trans	-57.4	-30.4	173.3	-79	-74.8	0	0	0	112.8	C312 D314 L325 I326 I331 H332 S333	C312-H329 VanDerWaalsContact SG-CE1 3.5Å; D314-H329 IonicContact OD2-CE1 3.47Å; D314-H329 PolarHBondContact OD2-CE1 3.24Å; D314-H329 IonicContact OD2-ND1 3.09Å; D314-H329 PolarHBondContact OD2-ND1 3.19Å; L325-H329 WeakPolarHBondContact CD1-NE2 3.42Å; L325-H329 PolarHBondContact O-CD2 3.16Å; L325-H329 PolarHBondContact O-N 3.29Å; I326-H329 PolarHBondContact O-N 2.75Å; H329-I331 PolarHBondContact O-N 3.43Å; H329-H332 WeakPolarHBondContact O-CA 3.26Å; H329-H332 WeakPolarHBondContact O-CB 3.21Å; H329-H332 PolarHBondContact O-N 3.29Å; H329-S333 PolarHBondContact O-N 3.02Å; H329-S333 PolarHBondContact O-OG 3.34Å
330	R	81.7	Confident	79.6	Confident	59 Å²	59	78.7 Å²	78.7	22%	0.223	38%	0.384	C	S	.	.	H	α-helix	trans	-58.4	-12.6	170.4	-65.4	-177.9	-175.4	160.7	4.4	115	I326 H328 M334 E335 S348	I326-R330 PolarHBondContact O-N 3.34Å; H328-R330 PolarHBondContact O-N 2.86Å; R330-M334 PolarHBondContact O-N 2.92Å; R330-E335 HydrophobicContact CB-CB 4.35Å; R330-E335 HydrophobicContact CG-CB 4.11Å; R330-S348 PolarHBondContact NH1-O 3.13Å; R330-S348 VanDerWaalsContact NH1-O 3.12Å
331	I	75.3	Confident	79.5	Confident	106 Å²	106	76.5 Å²	76.5	54%	0.544	39%	0.387	S	S	.	.	H	α-helix	trans	-79.4	-35.9	170.8	-56.3	-179.7	0	0	0	110.2	H328 H329	H328-I331 WeakPolarHBondContact O-CB 3.24Å; H328-I331 WeakPolarHBondContact O-CG1 3.48Å; H328-I331 PolarHBondContact O-N 2.97Å; H329-I331 PolarHBondContact O-N 3.43Å
332	H	77.1	Confident	79.4	Confident	93 Å²	93	79.9 Å²	79.9	43%	0.431	40%	0.402	S	S	.	.	H	α-helix	trans	-80.8	-47.7	178.3	-60.2	-57.8	0	0	0	111.9	D314 C315 H329 M334	D314-H332 IonicContact OD2-CD2 3.38Å; D314-H332 PolarHBondContact OD2-CD2 3.25Å; D314-H332 IonicContact OD2-CG 3.21Å; C315-H332 VanDerWaalsContact CB-NE2 3.28Å; C315-H332 WeakPolarHBondContact CB-NE2 3.32Å; H329-H332 WeakPolarHBondContact O-CA 3.26Å; H329-H332 WeakPolarHBondContact O-CB 3.21Å; H329-H332 PolarHBondContact O-N 3.29Å; H332-M334 PolarHBondContact O-N 3.14Å
333	S	75.3	Confident	79.4	Confident	62 Å²	62	74.5 Å²	74.5	43%	0.434	39%	0.389	S	S	.	.	S	Bend	trans	-73.7	-3.5	176.3	67.4	0	0	0	0	114.2	H329 E335	H329-S333 PolarHBondContact O-N 3.02Å; H329-S333 PolarHBondContact O-OG 3.34Å; S333-E335 WeakPolarHBondContact CB-OE1 3.26Å; S333-E335 PolarHBondContact O-N 2.93Å; S333-E335 WeakPolarHBondContact OG-CG 3.01Å; S333-E335 PolarHBondContact OG-OE1 3.45Å
334	M	67.8	Low	79.4	Confident	123 Å²	123	72.8 Å²	72.8	61%	0.606	39%	0.386	S	S	*	.			trans	53.6	10.4	-172.7	-63.5	-148.5	-175.9	0	0	116	R330 H332 K336	R330-M334 PolarHBondContact O-N 2.92Å; H332-M334 PolarHBondContact O-N 3.14Å; M334-K336 PolarHBondContact O-N 3.43Å
335	E	71.8	Confident	79.4	Confident	100 Å²	100	79.3 Å²	79.3	47%	0.467	41%	0.408	S	S	.	.			trans	-55	128.3	179.2	-82.6	167.2	-130.6	0	0	112.5	R330 S333	R330-E335 HydrophobicContact CB-CB 4.35Å; R330-E335 HydrophobicContact CG-CB 4.11Å; S333-E335 WeakPolarHBondContact CB-OE1 3.26Å; S333-E335 PolarHBondContact O-N 2.93Å; S333-E335 WeakPolarHBondContact OG-CG 3.01Å; S333-E335 PolarHBondContact OG-OE1 3.45Å
336	K	80.3	Confident	79.4	Confident	115 Å²	115	79.3 Å²	79.3	50%	0.5	41%	0.413	S	S	.	.			trans	-127.4	71	178.7	-74.7	158.2	-175	159.9	0	110.5	M334 Y338 F347	M334-K336 PolarHBondContact O-N 3.43Å; K336-Y338 PolarHBondContact O-N 3.3Å; K336-F347 CarbonylContact C-O 3.25Å; K336-F347 VanDerWaalsContact C-O 3.26Å; K336-F347 WeakPolarHBondContact CA-O 3.44Å
337	P	82.1	Confident	79.6	Confident	71 Å²	71	77 Å²	77	46%	0.461	40%	0.4	S	S	.	.			trans	-64.8	-13.3	-173.1	-21.2	34.5	0	0	0	114.5
338	Y	83.6	Confident	79.7	Confident	78 Å²	78	73 Å²	73	31%	0.306	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	95.2	-177.6	-54.2	-78.7	0	0	0	109.5	K336 G346 F347 K350	K336-Y338 PolarHBondContact O-N 3.3Å; Y338-G346 CarbonylContact O-C 3.49Å; Y338-F347 WeakPolarHBondContact CD2-O 3.39Å; Y338-F347 PolarHBondContact N-O 2.95Å; Y338-F347 VanDerWaalsContact N-O 3.1Å; Y338-F347 PolarHBondContact O-N 3.19Å; Y338-K350 HydrophobicContact CD1-CB 3.84Å; Y338-K350 HydrophobicContact CD1-CG 4.2Å; Y338-K350 HydrophobicContact CE1-CB 3.71Å; Y338-K350 HydrophobicContact CE1-CD 4.5Å; Y338-K350 HydrophobicContact CE1-CG 4.24Å; Y338-K350 HydrophobicContact CG-CB 4.32Å
339	V	82.1	Confident	79.8	Confident	85 Å²	85	74.7 Å²	74.7	52%	0.515	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138.8	-179.9	-176.5	0	0	0	0	110.6
340	C	86.2	Confident	80	Confident	1 Å²	1	79 Å²	79	1%	0.007	42%	0.415	C	S	.	.			trans	-77.4	120.8	170.7	-170.7	0	0	0	0	110.3	E342 G344 R345 L353	C340-E342 VanDerWaalsContact C-N 3.25Å; C340-E342 PolarHBondContact O-N 3.08Å; C340-G344 VanDerWaalsContact O-CA 3.29Å; C340-G344 WeakPolarHBondContact O-CA 3.48Å; C340-G344 PolarHBondContact O-N 2.83Å; C340-R345 PolarHBondContact N-O 3.12Å; C340-L353 HydrophobicContact CB-CD1 3.61Å
341	S	82.9	Confident	80	Confident	106 Å²	106	79.7 Å²	79.7	74%	0.741	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-32.4	177.8	42.7	0	0	0	0	113.3
342	E	79.9	Confident	80.3	Confident	120 Å²	120	76.6 Å²	76.6	56%	0.561	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-22.7	-172.4	-64.4	166.4	-113.3	0	0	114.1	C340 H360	C340-E342 VanDerWaalsContact C-N 3.25Å; C340-E342 PolarHBondContact O-N 3.08Å; E342-H360 IonicContact OE1-CD2 3.76Å; E342-H360 WeakPolarHBondContact OE2-CB 3.4Å; E342-H360 IonicContact OE2-CD2 3.54Å; E342-H360 PolarHBondContact OE2-CD2 3.08Å; E342-H360 IonicContact OE2-CG 3.43Å
343	C	80.1	Confident	80.6	Confident	55 Å²	55	73 Å²	73	37%	0.372	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.8	10.3	-177.2	70.8	0	0	0	0	115.1	R345 H356 H360	C343-R345 PolarHBondContact O-N 3.24Å; C343-R345 VanDerWaalsContact SG-CB 3.58Å; C343-H356 PolarHBondContact SG-NE2 3.14Å; C343-H360 WeakPolarHBondContact CB-NE2 3.24Å; C343-H360 PolarHBondContact SG-NE2 2.79Å
344	G	79.4	Confident	80.9	Confident	55 Å²	55	72.4 Å²	72.4	57%	0.567	39%	0.394	S	S	*	.			trans	64.9	4.6	179.7	0	0	0	0	0	115.3	C340 G346	C340-G344 VanDerWaalsContact O-CA 3.29Å; C340-G344 WeakPolarHBondContact O-CA 3.48Å; C340-G344 PolarHBondContact O-N 2.83Å; G344-G346 PolarHBondContact O-N 3.42Å
345	R	80.7	Confident	81.4	Confident	157 Å²	157	72.2 Å²	72.2	59%	0.592	39%	0.386	S	S	*	.			trans	-77.5	119.1	-172.3	-169	171	-176.6	166.5	5.1	111.7	C340 C343 F347	C340-R345 PolarHBondContact N-O 3.12Å; C343-R345 PolarHBondContact O-N 3.24Å; C343-R345 VanDerWaalsContact SG-CB 3.58Å; R345-F347 HydrophobicContact CB-CE2 4.01Å; R345-F347 HydrophobicContact CB-CZ 4.34Å; R345-F347 HydrophobicContact CG-CE2 3.83Å; R345-F347 HydrophobicContact CG-CZ 3.78Å; R345-F347 VanDerWaalsContact O-CD2 3.27Å; R345-F347 WeakPolarHBondContact O-CD2 3.41Å; R345-F347 WeakPolarHBondContact O-CE2 3.2Å
346	G	81.4	Confident	81.9	Confident	19 Å²	19	68.3 Å²	68.3	20%	0.196	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	143.4	177	0	0	0	0	0	115.2	Y338 G344	Y338-G346 CarbonylContact O-C 3.49Å; G344-G346 PolarHBondContact O-N 3.42Å
347	F	84.6	Confident	81.9	Confident	33 Å²	33	66.1 Å²	66.1	15%	0.145	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.4	176.4	-59.9	-91.5	0	0	0	111.6	K336 Y338 R345 Q349 N352 L353 H356	K336-F347 CarbonylContact C-O 3.25Å; K336-F347 VanDerWaalsContact C-O 3.26Å; K336-F347 WeakPolarHBondContact CA-O 3.44Å; Y338-F347 WeakPolarHBondContact CD2-O 3.39Å; Y338-F347 PolarHBondContact N-O 2.95Å; Y338-F347 VanDerWaalsContact N-O 3.1Å; Y338-F347 PolarHBondContact O-N 3.19Å; R345-F347 HydrophobicContact CB-CE2 4.01Å; R345-F347 HydrophobicContact CB-CZ 4.34Å; R345-F347 HydrophobicContact CG-CE2 3.83Å; R345-F347 HydrophobicContact CG-CZ 3.78Å; R345-F347 VanDerWaalsContact O-CD2 3.27Å; R345-F347 WeakPolarHBondContact O-CD2 3.41Å; R345-F347 WeakPolarHBondContact O-CE2 3.2Å; F347-Q349 VanDerWaalsContact C-N 3.32Å; F347-Q349 PolarHBondContact O-N 3.05Å; F347-N352 HydrophobicContact CB-CB 4.27Å; F347-N352 HydrophobicContact CD1-CB 3.87Å; F347-N352 HydrophobicContact CG-CB 4.35Å; F347-L353 HydrophobicContact CB-CB 4.35Å; F347-L353 HydrophobicContact CD2-CB 3.99Å; F347-L353 HydrophobicContact CD2-CD1 3.91Å; F347-L353 HydrophobicContact CE2-CD1 4.1Å; F347-L353 HydrophobicContact CG-CB 4.3Å; F347-H356 HydrophobicContact CE1-CB 4Å; F347-H356 HydrophobicContact CE2-CB 3.99Å; F347-H356 AromaticContact CE2-CD2 3.17Å; F347-H356 WeakPolarHBondContact CE2-CD2 3.44Å; F347-H356 AromaticContact CE2-CG 3.73Å; F347-H356 AromaticContact CE2-NE2 3.94Å; F347-H356 HydrophobicContact CZ-CB 3.48Å; F347-H356 VanDerWaalsContact CZ-CB 3.48Å; F347-H356 AromaticContact CZ-CD2 3.21Å; F347-H356 WeakPolarHBondContact CZ-CD2 3.46Å; F347-H356 AromaticContact CZ-CG 3.3Å; F347-H356 AromaticContact CZ-NE2 3.91Å
348	S	82.5	Confident	81.9	Confident	29 Å²	29	65.9 Å²	65.9	20%	0.203	35%	0.349	C	S	.	.	S	Bend	trans	-80.9	-7.2	177.5	56.4	0	0	0	0	114.5	R330	R330-S348 PolarHBondContact NH1-O 3.13Å; R330-S348 VanDerWaalsContact NH1-O 3.12Å
349	Q	82.9	Confident	81.4	Confident	51 Å²	51	64.6 Å²	64.6	24%	0.238	35%	0.35	C	S	.	.	S	Bend	trans	-144	136.2	-177.3	-53.3	-179.8	22.9	0	0	111.7	R327 F347 S351 N352 L353	R327-Q349 HydrophobicContact CG-CG 3.98Å; F347-Q349 VanDerWaalsContact C-N 3.32Å; F347-Q349 PolarHBondContact O-N 3.05Å; Q349-S351 VanDerWaalsContact C-N 3.33Å; Q349-S351 PolarHBondContact O-N 3.38Å; Q349-N352 HydrophobicContact CB-CB 4.44Å; Q349-N352 WeakPolarHBondContact O-CB 3.43Å; Q349-N352 PolarHBondContact O-N 2.67Å; Q349-L353 PolarHBondContact O-N 3.08Å
350	K	83.1	Confident	81.1	Confident	140 Å²	140	65 Å²	65	61%	0.609	35%	0.346	S	S	*	.	H	α-helix	trans	-55.5	-42.5	177.8	-166.9	174.9	-178.1	177.8	0	112.9	Y338 N352 L353 S354	Y338-K350 HydrophobicContact CD1-CB 3.84Å; Y338-K350 HydrophobicContact CD1-CG 4.2Å; Y338-K350 HydrophobicContact CE1-CB 3.71Å; Y338-K350 HydrophobicContact CE1-CD 4.5Å; Y338-K350 HydrophobicContact CE1-CG 4.24Å; Y338-K350 HydrophobicContact CG-CB 4.32Å; K350-N352 VanDerWaalsContact C-N 3.25Å; K350-N352 PolarHBondContact O-N 2.89Å; K350-L353 WeakPolarHBondContact O-CB 3.48Å; K350-L353 PolarHBondContact O-N 3.15Å; K350-L353 VanDerWaalsContact O-N 3.11Å; K350-S354 PolarHBondContact O-N 3.05Å; K350-S354 PolarHBondContact O-OG 3.04Å
351	S	80.8	Confident	80.4	Confident	75 Å²	75	67 Å²	67	52%	0.524	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-29.2	177.8	55	0	0	0	0	113.9	Q349 R355	Q349-S351 VanDerWaalsContact C-N 3.33Å; Q349-S351 PolarHBondContact O-N 3.38Å; S351-R355 WeakPolarHBondContact O-CB 3.44Å; S351-R355 PolarHBondContact O-N 2.87Å; S351-R355 VanDerWaalsContact O-N 3.12Å
352	N	81.4	Confident	79.5	Confident	40 Å²	40	70.2 Å²	70.2	21%	0.214	36%	0.363	C	S	.	.	H	α-helix	trans	-76.1	-38.7	174.4	-73.4	-34.3	0	0	0	111.6	F347 Q349 K350 R355 H356	F347-N352 HydrophobicContact CB-CB 4.27Å; F347-N352 HydrophobicContact CD1-CB 3.87Å; F347-N352 HydrophobicContact CG-CB 4.35Å; Q349-N352 HydrophobicContact CB-CB 4.44Å; Q349-N352 WeakPolarHBondContact O-CB 3.43Å; Q349-N352 PolarHBondContact O-N 2.67Å; K350-N352 VanDerWaalsContact C-N 3.25Å; K350-N352 PolarHBondContact O-N 2.89Å; N352-R355 PolarHBondContact OD1-NH2 3.13Å; N352-H356 WeakPolarHBondContact O-CB 3.43Å; N352-H356 PolarHBondContact O-N 3.32Å
353	L	83.6	Confident	79.2	Confident	18 Å²	18	70.1 Å²	70.1	9%	0.094	36%	0.363	C	S	.	.	H	α-helix	trans	-61.5	-50.7	171.2	173.2	59.9	0	0	0	110.8	C340 F347 Q349 K350 R355 H356 Q357	C340-L353 HydrophobicContact CB-CD1 3.61Å; F347-L353 HydrophobicContact CB-CB 4.35Å; F347-L353 HydrophobicContact CD2-CB 3.99Å; F347-L353 HydrophobicContact CD2-CD1 3.91Å; F347-L353 HydrophobicContact CE2-CD1 4.1Å; F347-L353 HydrophobicContact CG-CB 4.3Å; Q349-L353 PolarHBondContact O-N 3.08Å; K350-L353 WeakPolarHBondContact O-CB 3.48Å; K350-L353 PolarHBondContact O-N 3.15Å; K350-L353 VanDerWaalsContact O-N 3.11Å; L353-R355 VanDerWaalsContact C-N 3.3Å; L353-R355 PolarHBondContact O-N 3.21Å; L353-H356 CarbonylContact O-C 3.53Å; L353-H356 WeakPolarHBondContact O-CA 3.39Å; L353-H356 WeakPolarHBondContact O-CB 3.43Å; L353-H356 PolarHBondContact O-N 3.1Å; L353-Q357 HydrophobicContact CD1-CG 4.08Å; L353-Q357 HydrophobicContact CG-CG 4.44Å; L353-Q357 PolarHBondContact O-N 2.91Å
354	S	81.3	Confident	79.2	Confident	50 Å²	50	71.8 Å²	71.8	35%	0.35	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-35.3	179.3	-53.4	0	0	0	0	113.2	K350 H356	K350-S354 PolarHBondContact O-N 3.05Å; K350-S354 PolarHBondContact O-OG 3.04Å; S354-H356 VanDerWaalsContact C-N 3.31Å
355	R	79.6	Confident	79.3	Confident	118 Å²	118	72.8 Å²	72.8	45%	0.445	36%	0.36	S	S	.	.	H	α-helix	trans	-69.4	-28.8	171.3	176.6	168.8	55.4	172.7	-5.2	112.8	S351 N352 L353	S351-R355 WeakPolarHBondContact O-CB 3.44Å; S351-R355 PolarHBondContact O-N 2.87Å; S351-R355 VanDerWaalsContact O-N 3.12Å; N352-R355 PolarHBondContact OD1-NH2 3.13Å; L353-R355 VanDerWaalsContact C-N 3.3Å; L353-R355 PolarHBondContact O-N 3.21Å
356	H	81.5	Confident	79.3	Confident	19 Å²	19	69 Å²	69	9%	0.088	35%	0.347	C	S	.	.	H	α-helix	trans	-79.5	-32.7	176.1	168.3	53.4	0	0	0	113	C343 F347 N352 L353 S354 R358 T359 H360	C343-H356 PolarHBondContact SG-NE2 3.14Å; F347-H356 HydrophobicContact CE1-CB 4Å; F347-H356 HydrophobicContact CE2-CB 3.99Å; F347-H356 AromaticContact CE2-CD2 3.17Å; F347-H356 WeakPolarHBondContact CE2-CD2 3.44Å; F347-H356 AromaticContact CE2-CG 3.73Å; F347-H356 AromaticContact CE2-NE2 3.94Å; F347-H356 HydrophobicContact CZ-CB 3.48Å; F347-H356 VanDerWaalsContact CZ-CB 3.48Å; F347-H356 AromaticContact CZ-CD2 3.21Å; F347-H356 WeakPolarHBondContact CZ-CD2 3.46Å; F347-H356 AromaticContact CZ-CG 3.3Å; F347-H356 AromaticContact CZ-NE2 3.91Å; N352-H356 WeakPolarHBondContact O-CB 3.43Å; N352-H356 PolarHBondContact O-N 3.32Å; L353-H356 CarbonylContact O-C 3.53Å; L353-H356 WeakPolarHBondContact O-CA 3.39Å; L353-H356 WeakPolarHBondContact O-CB 3.43Å; L353-H356 PolarHBondContact O-N 3.1Å; S354-H356 VanDerWaalsContact C-N 3.31Å; H356-R358 PolarHBondContact O-N 3.32Å; H356-T359 PolarHBondContact CE1-OG1 3.46Å; H356-T359 PolarHBondContact ND1-OG1 3.38Å; H356-T359 WeakPolarHBondContact O-CA 3.5Å; H356-T359 VanDerWaalsContact O-CB 3.27Å; H356-T359 WeakPolarHBondContact O-CB 3.15Å; H356-T359 WeakPolarHBondContact O-CG2 3.47Å; H356-T359 PolarHBondContact O-N 3.43Å; H356-T359 PolarHBondContact O-OG1 2.91Å; H356-H360 AromaticContact CE1-NE2 3.88Å
357	Q	81.1	Confident	79.5	Confident	68 Å²	68	73.1 Å²	73.1	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-59.1	-32.6	174.9	-71.6	170.6	-66	0	0	111.6	L353 T359 H360 S361	L353-Q357 HydrophobicContact CD1-CG 4.08Å; L353-Q357 HydrophobicContact CG-CG 4.44Å; L353-Q357 PolarHBondContact O-N 2.91Å; Q357-T359 PolarHBondContact O-N 3.4Å; Q357-H360 PolarHBondContact O-N 3.46Å; Q357-S361 PolarHBondContact O-N 3.43Å; Q357-S361 VanDerWaalsContact O-N 3.08Å
358	R	80.4	Confident	79.5	Confident	66 Å²	66	71.6 Å²	71.6	25%	0.249	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	5.5	166.6	-55.6	-180	-169.6	165.1	-0.1	115.7	H356 S361 R376	H356-R358 PolarHBondContact O-N 3.32Å; R358-S361 CarbonylContact C-O 3.57Å; R358-S361 WeakPolarHBondContact CA-OG 3.24Å; R358-R376 PolarHBondContact NH1-O 3.48Å; R358-R376 VanDerWaalsContact NH1-O 3.11Å; R358-R376 WeakPolarHBondContact O-CD 3.46Å; R358-R376 WeakPolarHBondContact O-CG 3.41Å; R358-R376 PolarHBondContact O-NE 2.91Å
359	T	73.6	Confident	79.5	Confident	51 Å²	51	81.6 Å²	81.6	31%	0.313	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-18.6	168.1	69	0	0	0	0	112.8	H356 Q357	H356-T359 PolarHBondContact CE1-OG1 3.46Å; H356-T359 PolarHBondContact ND1-OG1 3.38Å; H356-T359 WeakPolarHBondContact O-CA 3.5Å; H356-T359 VanDerWaalsContact O-CB 3.27Å; H356-T359 WeakPolarHBondContact O-CB 3.15Å; H356-T359 WeakPolarHBondContact O-CG2 3.47Å; H356-T359 PolarHBondContact O-N 3.43Å; H356-T359 PolarHBondContact O-OG1 2.91Å; Q357-T359 PolarHBondContact O-N 3.4Å
360	H	76.4	Confident	79.4	Confident	94 Å²	94	85 Å²	85	44%	0.435	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-42.3	174.5	-50.2	-52.9	0	0	0	111.2	E342 C343 H356 Q357	E342-H360 IonicContact OE1-CD2 3.76Å; E342-H360 WeakPolarHBondContact OE2-CB 3.4Å; E342-H360 IonicContact OE2-CD2 3.54Å; E342-H360 PolarHBondContact OE2-CD2 3.08Å; E342-H360 IonicContact OE2-CG 3.43Å; C343-H360 WeakPolarHBondContact CB-NE2 3.24Å; C343-H360 PolarHBondContact SG-NE2 2.79Å; H356-H360 AromaticContact CE1-NE2 3.88Å; Q357-H360 PolarHBondContact O-N 3.46Å
361	S	71.6	Confident	79.3	Confident	44 Å²	44	80.8 Å²	80.8	31%	0.308	39%	0.394	S	S	.	.	S	Bend	trans	-72.9	147.6	163.8	70.2	0	0	0	0	110.9	Q357 R358 E363	Q357-S361 PolarHBondContact O-N 3.43Å; Q357-S361 VanDerWaalsContact O-N 3.08Å; R358-S361 CarbonylContact C-O 3.57Å; R358-S361 WeakPolarHBondContact CA-OG 3.24Å; S361-E363 PolarHBondContact O-N 3.41Å
362	E	64.9	Low	79.2	Confident	173 Å²	173	79.6 Å²	79.6	81%	0.808	39%	0.394	S	S	*	.			trans	-74.1	0.4	175.7	-63.2	-146.2	127.9	0	0	113.5	K364	E362-K364 WeakPolarHBondContact O-CG 3.47Å; E362-K364 PolarHBondContact O-N 2.95Å; E362-K364 VanDerWaalsContact O-N 3.15Å
363	E	73	Confident	79.2	Confident	117 Å²	117	82.7 Å²	82.7	55%	0.547	41%	0.407	S	S	.	.			trans	-55.3	116.2	-178.6	-67.2	-177.4	167.3	0	0	112.6	S361	S361-E363 PolarHBondContact O-N 3.41Å
364	K	79.4	Confident	79.1	Confident	90 Å²	90	84.2 Å²	84.2	39%	0.391	42%	0.419	S	S	.	.			trans	-125.9	75	176.4	-71	160.4	-174.8	166.4	0	109.3	E362 Y366 S374 F375 R376	E362-K364 WeakPolarHBondContact O-CG 3.47Å; E362-K364 PolarHBondContact O-N 2.95Å; E362-K364 VanDerWaalsContact O-N 3.15Å; K364-Y366 PolarHBondContact O-N 3.03Å; K364-S374 VanDerWaalsContact CB-CB 3.5Å; K364-S374 WeakPolarHBondContact CB-OG 3.38Å; K364-S374 WeakPolarHBondContact CD-O 3Å; K364-S374 VanDerWaalsContact CD-OG 3.24Å; K364-S374 WeakPolarHBondContact CD-OG 3.48Å; K364-S374 WeakPolarHBondContact O-CB 3.44Å; K364-F375 CarbonylContact C-O 3.55Å; K364-F375 WeakPolarHBondContact CA-O 3.23Å; K364-R376 HydrophobicContact CG-CG 4.13Å
365	P	81.6	Confident	79.2	Confident	77 Å²	77	83.2 Å²	83.2	50%	0.5	41%	0.408	S	S	.	.			trans	-67.5	-6.3	-167	-22	34.9	0	0	0	115.9
366	Y	81.6	Confident	79.2	Confident	77 Å²	77	82.3 Å²	82.3	30%	0.302	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	96.5	-173.7	-56.7	-81.7	0	0	0	110.4	K364 F375 S377 K378	K364-Y366 PolarHBondContact O-N 3.03Å; Y366-F375 WeakPolarHBondContact CD2-O 3.31Å; Y366-F375 PolarHBondContact N-O 3.36Å; Y366-F375 VanDerWaalsContact N-O 3.08Å; Y366-F375 PolarHBondContact O-N 3.45Å; Y366-S377 VanDerWaalsContact CD2-C 3.44Å; Y366-S377 VanDerWaalsContact CE2-CA 3.43Å; Y366-K378 HydrophobicContact CD1-CB 3.82Å; Y366-K378 HydrophobicContact CD1-CG 4.41Å; Y366-K378 HydrophobicContact CE1-CB 3.74Å; Y366-K378 HydrophobicContact CG-CB 4.41Å
367	L	84.2	Confident	79.2	Confident	105 Å²	105	82.1 Å²	82.1	55%	0.55	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	133.6	179.4	-172.2	68	0	0	0	111.9	G372	L367-G372 WeakPolarHBondContact CD1-O 3.32Å
368	C	86	Confident	79.1	Confident	1 Å²	1	85.2 Å²	85.2	1%	0.007	42%	0.418	C	S	.	.			trans	-81	122.4	164	-178.7	0	0	0	0	109.6	E370 G372 Q373 F375 L381	C368-E370 VanDerWaalsContact C-N 3.32Å; C368-E370 PolarHBondContact O-N 3.23Å; C368-G372 VanDerWaalsContact O-CA 3.32Å; C368-G372 WeakPolarHBondContact O-CA 3.47Å; C368-G372 PolarHBondContact O-N 2.97Å; C368-Q373 WeakPolarHBondContact CB-O 3.43Å; C368-Q373 PolarHBondContact N-O 3.49Å; C368-F375 HydrophobicContact CB-CE2 4.01Å; C368-L381 HydrophobicContact CB-CD1 3.52Å
369	R	80.9	Confident	79.1	Confident	239 Å²	239	85.5 Å²	85.5	90%	0.902	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-23.5	-177.6	-65.9	-174.8	175.1	-165.2	-3.1	113.8
370	E	81.5	Confident	79.4	Confident	123 Å²	123	85.8 Å²	85.8	58%	0.575	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-34.2	-176.3	-70.7	141.9	-148.4	0	0	113.2	C368 H388	C368-E370 VanDerWaalsContact C-N 3.32Å; C368-E370 PolarHBondContact O-N 3.23Å; E370-H388 WeakPolarHBondContact OE2-CB 3.42Å; E370-H388 IonicContact OE2-CD2 3.99Å; E370-H388 PolarHBondContact OE2-CD2 3.14Å; E370-H388 IonicContact OE2-CG 3.09Å
371	C	81.8	Confident	79.7	Confident	51 Å²	51	82.1 Å²	82.1	35%	0.345	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	1.3	-174.5	72.4	0	0	0	0	114.7	Q373 H384 H388	C371-Q373 PolarHBondContact O-N 3.35Å; C371-Q373 VanDerWaalsContact O-N 3.1Å; C371-Q373 VanDerWaalsContact SG-CB 3.58Å; C371-Q373 PolarHBondContact SG-N 3.18Å; C371-Q373 VanDerWaalsContact SG-N 3.43Å; C371-H384 PolarHBondContact SG-NE2 3.09Å; C371-H388 PolarHBondContact SG-NE2 3.06Å
372	G	78.5	Confident	80.2	Confident	51 Å²	51	83.6 Å²	83.6	53%	0.526	42%	0.417	S	S	.	.			trans	67.4	2.8	-177.5	0	0	0	0	0	115.6	L367 C368	L367-G372 WeakPolarHBondContact CD1-O 3.32Å; C368-G372 VanDerWaalsContact O-CA 3.32Å; C368-G372 WeakPolarHBondContact O-CA 3.47Å; C368-G372 PolarHBondContact O-N 2.97Å
373	Q	81.1	Confident	80.9	Confident	105 Å²	105	80.3 Å²	80.3	49%	0.491	40%	0.397	S	S	.	.			trans	-73.7	135.6	179.3	-67.4	-173.1	11.6	0	0	111.6	C368 C371 F375	C368-Q373 WeakPolarHBondContact CB-O 3.43Å; C368-Q373 PolarHBondContact N-O 3.49Å; C371-Q373 PolarHBondContact O-N 3.35Å; C371-Q373 VanDerWaalsContact O-N 3.1Å; C371-Q373 VanDerWaalsContact SG-CB 3.58Å; C371-Q373 PolarHBondContact SG-N 3.18Å; C371-Q373 VanDerWaalsContact SG-N 3.43Å; Q373-F375 HydrophobicContact CB-CE2 3.75Å; Q373-F375 HydrophobicContact CB-CZ 3.69Å; Q373-F375 WeakPolarHBondContact O-CD2 3.49Å; Q373-F375 WeakPolarHBondContact O-CE2 3.32Å
374	S	82.3	Confident	81.2	Confident	50 Å²	50	75.9 Å²	75.9	35%	0.35	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	141.1	-178.6	58.5	0	0	0	0	112.1	K364	K364-S374 VanDerWaalsContact CB-CB 3.5Å; K364-S374 WeakPolarHBondContact CB-OG 3.38Å; K364-S374 WeakPolarHBondContact CD-O 3Å; K364-S374 VanDerWaalsContact CD-OG 3.24Å; K364-S374 WeakPolarHBondContact CD-OG 3.48Å; K364-S374 WeakPolarHBondContact O-CB 3.44Å
375	F	82.3	Confident	81.3	Confident	29 Å²	29	75 Å²	75	13%	0.127	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.4	-173	-59	-82.3	0	0	0	112.7	K364 Y366 C368 Q373 I380 L381 H384	K364-F375 CarbonylContact C-O 3.55Å; K364-F375 WeakPolarHBondContact CA-O 3.23Å; Y366-F375 WeakPolarHBondContact CD2-O 3.31Å; Y366-F375 PolarHBondContact N-O 3.36Å; Y366-F375 VanDerWaalsContact N-O 3.08Å; Y366-F375 PolarHBondContact O-N 3.45Å; C368-F375 HydrophobicContact CB-CE2 4.01Å; Q373-F375 HydrophobicContact CB-CE2 3.75Å; Q373-F375 HydrophobicContact CB-CZ 3.69Å; Q373-F375 WeakPolarHBondContact O-CD2 3.49Å; Q373-F375 WeakPolarHBondContact O-CE2 3.32Å; F375-I380 HydrophobicContact CB-CG2 4.48Å; F375-I380 HydrophobicContact CD1-CG2 3.67Å; F375-I380 HydrophobicContact CE1-CG2 4.38Å; F375-I380 HydrophobicContact CG-CG2 4.36Å; F375-L381 HydrophobicContact CB-CB 4.22Å; F375-L381 HydrophobicContact CD2-CB 3.95Å; F375-L381 HydrophobicContact CD2-CD1 3.77Å; F375-L381 HydrophobicContact CD2-CG 4.45Å; F375-L381 HydrophobicContact CE2-CD1 4.01Å; F375-L381 HydrophobicContact CG-CB 4.27Å; F375-H384 HydrophobicContact CE1-CB 4.03Å; F375-H384 HydrophobicContact CE2-CB 4.06Å; F375-H384 AromaticContact CE2-CD2 3.38Å; F375-H384 WeakPolarHBondContact CE2-CD2 3.43Å; F375-H384 AromaticContact CE2-CG 3.73Å; F375-H384 HydrophobicContact CZ-CB 3.65Å; F375-H384 AromaticContact CZ-CD2 3.31Å; F375-H384 WeakPolarHBondContact CZ-CD2 3.39Å; F375-H384 AromaticContact CZ-CE1 3.95Å; F375-H384 AromaticContact CZ-CG 3.24Å; F375-H384 AromaticContact CZ-ND1 3.67Å; F375-H384 AromaticContact CZ-NE2 3.75Å
376	R	80.1	Confident	81.1	Confident	99 Å²	99	75.7 Å²	75.7	37%	0.374	37%	0.366	S	S	.	.	S	Bend	trans	-79.6	-20.2	-176.6	-64.3	169.2	175.3	170.6	-5.5	114.2	R358 K364	R358-R376 PolarHBondContact NH1-O 3.48Å; R358-R376 VanDerWaalsContact NH1-O 3.11Å; R358-R376 WeakPolarHBondContact O-CD 3.46Å; R358-R376 WeakPolarHBondContact O-CG 3.41Å; R358-R376 PolarHBondContact O-NE 2.91Å; K364-R376 HydrophobicContact CG-CG 4.13Å
377	S	80.5	Confident	80.8	Confident	15 Å²	15	75.9 Å²	75.9	11%	0.105	38%	0.376	C	S	.	.	S	Bend	trans	-147.5	145	174.9	68	0	0	0	0	113.1	Y366 S379 I380 L381	Y366-S377 VanDerWaalsContact CD2-C 3.44Å; Y366-S377 VanDerWaalsContact CE2-CA 3.43Å; S377-S379 PolarHBondContact O-N 3.09Å; S377-S379 VanDerWaalsContact O-N 3.16Å; S377-S379 PolarHBondContact OG-OG 2.89Å; S377-I380 PolarHBondContact O-N 3.06Å; S377-I380 WeakPolarHBondContact OG-CG1 3.22Å; S377-L381 PolarHBondContact O-N 3.18Å
378	K	80.5	Confident	80.4	Confident	133 Å²	133	74.6 Å²	74.6	58%	0.578	37%	0.367	S	S	*	.	H	α-helix	trans	-50.5	-39.4	177.2	-168.7	170	-177.4	176.1	0	113.1	Y366 I380 L381 N382	Y366-K378 HydrophobicContact CD1-CB 3.82Å; Y366-K378 HydrophobicContact CD1-CG 4.41Å; Y366-K378 HydrophobicContact CE1-CB 3.74Å; Y366-K378 HydrophobicContact CG-CB 4.41Å; K378-I380 VanDerWaalsContact C-N 3.26Å; K378-I380 PolarHBondContact O-N 2.61Å; K378-L381 PolarHBondContact O-N 2.79Å; K378-N382 WeakPolarHBondContact CG-OD1 3.42Å; K378-N382 WeakPolarHBondContact O-CB 3.4Å; K378-N382 PolarHBondContact O-N 2.96Å; K378-N382 PolarHBondContact O-OD1 3.18Å
379	S	79.4	Confident	79.7	Confident	71 Å²	71	76.6 Å²	76.6	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-60.1	-30.2	176.4	57.9	0	0	0	0	114.8	S377 R383	S377-S379 PolarHBondContact O-N 3.09Å; S377-S379 VanDerWaalsContact O-N 3.16Å; S377-S379 PolarHBondContact OG-OG 2.89Å; S379-R383 WeakPolarHBondContact O-CB 3.49Å; S379-R383 PolarHBondContact O-N 2.6Å
380	I	79.9	Confident	78.8	Confident	57 Å²	57	74.2 Å²	74.2	29%	0.292	38%	0.38	S	S	.	.	H	α-helix	trans	-83.7	-37.9	178.1	-58.6	-67.7	0	0	0	109.9	F375 S377 K378 R383 H384	F375-I380 HydrophobicContact CB-CG2 4.48Å; F375-I380 HydrophobicContact CD1-CG2 3.67Å; F375-I380 HydrophobicContact CE1-CG2 4.38Å; F375-I380 HydrophobicContact CG-CG2 4.36Å; S377-I380 PolarHBondContact O-N 3.06Å; S377-I380 WeakPolarHBondContact OG-CG1 3.22Å; K378-I380 VanDerWaalsContact C-N 3.26Å; K378-I380 PolarHBondContact O-N 2.61Å; I380-R383 PolarHBondContact O-N 3.07Å; I380-H384 WeakPolarHBondContact O-CB 3.49Å; I380-H384 PolarHBondContact O-N 3.46Å
381	L	83.1	Confident	78.1	Confident	18 Å²	18	75.9 Å²	75.9	9%	0.094	39%	0.388	C	S	.	.	H	α-helix	trans	-58.3	-53.4	169.9	169.8	60	0	0	0	111.1	C368 F375 S377 K378 R383 H384 Q385	C368-L381 HydrophobicContact CB-CD1 3.52Å; F375-L381 HydrophobicContact CB-CB 4.22Å; F375-L381 HydrophobicContact CD2-CB 3.95Å; F375-L381 HydrophobicContact CD2-CD1 3.77Å; F375-L381 HydrophobicContact CD2-CG 4.45Å; F375-L381 HydrophobicContact CE2-CD1 4.01Å; F375-L381 HydrophobicContact CG-CB 4.27Å; S377-L381 PolarHBondContact O-N 3.18Å; K378-L381 PolarHBondContact O-N 2.79Å; L381-R383 PolarHBondContact O-N 3.12Å; L381-H384 CarbonylContact O-C 3.41Å; L381-H384 WeakPolarHBondContact O-CA 3.46Å; L381-H384 WeakPolarHBondContact O-CB 3.44Å; L381-H384 PolarHBondContact O-N 3.16Å; L381-Q385 HydrophobicContact CD1-CG 4.14Å; L381-Q385 WeakPolarHBondContact O-CG 3.18Å; L381-Q385 PolarHBondContact O-N 3.42Å
382	N	81.3	Confident	77.9	Confident	74 Å²	74	76.9 Å²	76.9	40%	0.396	39%	0.386	S	S	.	.	H	α-helix	trans	-55.9	-38.2	177.3	-72.3	35.2	0	0	0	111.8	K378 W386	K378-N382 WeakPolarHBondContact CG-OD1 3.42Å; K378-N382 WeakPolarHBondContact O-CB 3.4Å; K378-N382 PolarHBondContact O-N 2.96Å; K378-N382 PolarHBondContact O-OD1 3.18Å; N382-W386 VanDerWaalsContact O-CD1 3.32Å; N382-W386 PolarHBondContact O-NE1 3.18Å
383	R	78.9	Confident	78	Confident	104 Å²	104	77.4 Å²	77.4	39%	0.392	38%	0.381	S	S	.	.	H	α-helix	trans	-69.4	-34.2	175.5	-174	176	64.6	-171.8	13.1	112.7	S379 I380 L381 E405	S379-R383 WeakPolarHBondContact O-CB 3.49Å; S379-R383 PolarHBondContact O-N 2.6Å; I380-R383 PolarHBondContact O-N 3.07Å; L381-R383 PolarHBondContact O-N 3.12Å; R383-E405 VanDerWaalsContact CD-OE1 3.25Å; R383-E405 WeakPolarHBondContact CD-OE1 3.39Å; R383-E405 IonicContact CZ-OE1 3Å; R383-E405 VanDerWaalsContact CZ-OE1 3.23Å; R383-E405 IonicContact NE-OE1 3.37Å; R383-E405 IonicContact NH1-OE1 3.72Å; R383-E405 PolarHBondContact NH1-OE1 3.29Å
384	H	80.9	Confident	78.1	Confident	25 Å²	25	76.5 Å²	76.5	12%	0.116	37%	0.373	C	S	.	.	H	α-helix	trans	-71	-34.5	176.3	171.4	72.3	0	0	0	112.2	C371 F375 I380 L381 W386 T387 H388	C371-H384 PolarHBondContact SG-NE2 3.09Å; F375-H384 HydrophobicContact CE1-CB 4.03Å; F375-H384 HydrophobicContact CE2-CB 4.06Å; F375-H384 AromaticContact CE2-CD2 3.38Å; F375-H384 WeakPolarHBondContact CE2-CD2 3.43Å; F375-H384 AromaticContact CE2-CG 3.73Å; F375-H384 HydrophobicContact CZ-CB 3.65Å; F375-H384 AromaticContact CZ-CD2 3.31Å; F375-H384 WeakPolarHBondContact CZ-CD2 3.39Å; F375-H384 AromaticContact CZ-CE1 3.95Å; F375-H384 AromaticContact CZ-CG 3.24Å; F375-H384 AromaticContact CZ-ND1 3.67Å; F375-H384 AromaticContact CZ-NE2 3.75Å; I380-H384 WeakPolarHBondContact O-CB 3.49Å; I380-H384 PolarHBondContact O-N 3.46Å; L381-H384 CarbonylContact O-C 3.41Å; L381-H384 WeakPolarHBondContact O-CA 3.46Å; L381-H384 WeakPolarHBondContact O-CB 3.44Å; L381-H384 PolarHBondContact O-N 3.16Å; H384-W386 PolarHBondContact O-N 2.88Å; H384-W386 VanDerWaalsContact O-N 3.13Å; H384-T387 WeakPolarHBondContact O-CB 2.96Å; H384-T387 WeakPolarHBondContact O-CG2 3.46Å; H384-T387 PolarHBondContact O-N 3.06Å; H384-T387 PolarHBondContact O-OG1 2.79Å; H384-H388 AromaticContact CD2-NE2 3.7Å; H384-H388 AromaticContact CE1-CE1 3.9Å; H384-H388 AromaticContact CE1-NE2 3.58Å; H384-H388 AromaticContact NE2-CE1 3.7Å; H384-H388 AromaticContact NE2-NE2 2.99Å; H384-H388 PolarHBondContact NE2-NE2 2.92Å
385	Q	80.3	Confident	78.2	Confident	70 Å²	70	78 Å²	78	33%	0.327	38%	0.38	S	S	.	.	H	α-helix	trans	-58.6	-28.5	177.6	-70.1	174.6	-76.3	0	0	113	L381 T387 H388 S389	L381-Q385 HydrophobicContact CD1-CG 4.14Å; L381-Q385 WeakPolarHBondContact O-CG 3.18Å; L381-Q385 PolarHBondContact O-N 3.42Å; Q385-T387 PolarHBondContact O-N 3.47Å; Q385-T387 VanDerWaalsContact O-N 3.09Å; Q385-H388 PolarHBondContact O-N 3.32Å; Q385-S389 PolarHBondContact O-N 3.12Å; Q385-S389 VanDerWaalsContact O-N 3.1Å
386	W	78.8	Confident	78.4	Confident	93 Å²	93	76.8 Å²	76.8	35%	0.352	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	0.8	169.3	-55.2	122.3	0	0	0	115.4	N382 H384 E391 K392 P393	N382-W386 VanDerWaalsContact O-CD1 3.32Å; N382-W386 PolarHBondContact O-NE1 3.18Å; H384-W386 PolarHBondContact O-N 2.88Å; H384-W386 VanDerWaalsContact O-N 3.13Å; W386-E391 WeakPolarHBondContact CZ3-O 3.42Å; W386-K392 WeakPolarHBondContact O-CE 3.34Å; W386-P393 HydrophobicContact CD2-CG 3.94Å; W386-P393 HydrophobicContact CE3-CG 4.14Å; W386-P393 HydrophobicContact CH2-CG 3.81Å; W386-P393 HydrophobicContact CZ2-CG 3.58Å; W386-P393 HydrophobicContact CZ3-CG 4.08Å
387	T	73.8	Confident	78.6	Confident	81 Å²	81	77.8 Å²	77.8	50%	0.497	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-21.8	166.2	66.6	0	0	0	0	112.7	H384 Q385	H384-T387 WeakPolarHBondContact O-CB 2.96Å; H384-T387 WeakPolarHBondContact O-CG2 3.46Å; H384-T387 PolarHBondContact O-N 3.06Å; H384-T387 PolarHBondContact O-OG1 2.79Å; Q385-T387 PolarHBondContact O-N 3.47Å; Q385-T387 VanDerWaalsContact O-N 3.09Å
388	H	75.6	Confident	78.7	Confident	77 Å²	77	82.5 Å²	82.5	36%	0.356	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-33	-179.3	-50.9	-46.7	0	0	0	111.5	E370 C371 H384 Q385	E370-H388 WeakPolarHBondContact OE2-CB 3.42Å; E370-H388 IonicContact OE2-CD2 3.99Å; E370-H388 PolarHBondContact OE2-CD2 3.14Å; E370-H388 IonicContact OE2-CG 3.09Å; C371-H388 PolarHBondContact SG-NE2 3.06Å; H384-H388 AromaticContact CD2-NE2 3.7Å; H384-H388 AromaticContact CE1-CE1 3.9Å; H384-H388 AromaticContact CE1-NE2 3.58Å; H384-H388 AromaticContact NE2-CE1 3.7Å; H384-H388 AromaticContact NE2-NE2 2.99Å; H384-H388 PolarHBondContact NE2-NE2 2.92Å; Q385-H388 PolarHBondContact O-N 3.32Å
389	S	72.1	Confident	78.8	Confident	44 Å²	44	78.8 Å²	78.8	31%	0.308	41%	0.408	S	S	.	.			trans	-72.7	137.1	169.5	-173	0	0	0	0	112.2	Q385 E391	Q385-S389 PolarHBondContact O-N 3.12Å; Q385-S389 VanDerWaalsContact O-N 3.1Å; S389-E391 PolarHBondContact OG-N 3.06Å; S389-E391 PolarHBondContact OG-O 2.8Å
390	E	62.7	Low	78.8	Confident	188 Å²	188	78.2 Å²	78.2	88%	0.879	41%	0.413	S	S	*	.	S	Bend	trans	-72.4	-33.8	169.7	-59.6	-167.4	157.4	0	0	111.4	K392	E390-K392 PolarHBondContact O-N 3.02Å; E390-K392 VanDerWaalsContact O-N 3.14Å
391	E	65.4	Low	78.8	Confident	159 Å²	159	82.9 Å²	82.9	74%	0.743	43%	0.427	S	S	*	.			trans	-73.4	102.7	175.5	-63.1	-168.5	162.1	0	0	110.6	W386 S389	W386-E391 WeakPolarHBondContact CZ3-O 3.42Å; S389-E391 PolarHBondContact OG-N 3.06Å; S389-E391 PolarHBondContact OG-O 2.8Å
392	K	78.4	Confident	78.7	Confident	71 Å²	71	83.1 Å²	83.1	31%	0.309	43%	0.433	S	S	.	.			trans	-103.4	130.7	177.2	-74.6	166.4	-172.8	146.5	0	109.9	W386 E390 Y394 V395 G402	W386-K392 WeakPolarHBondContact O-CE 3.34Å; E390-K392 PolarHBondContact O-N 3.02Å; E390-K392 VanDerWaalsContact O-N 3.14Å; K392-Y394 PolarHBondContact O-N 3.14Å; K392-V395 WeakPolarHBondContact O-CG2 3.21Å; K392-G402 WeakPolarHBondContact CD-O 3.36Å
393	P	81.2	Confident	78.8	Confident	63 Å²	63	81.2 Å²	81.2	41%	0.409	42%	0.421	S	S	.	.	S	Bend	trans	-59.4	-15.4	-172	-28.1	35	0	0	0	116.6	W386	W386-P393 HydrophobicContact CD2-CG 3.94Å; W386-P393 HydrophobicContact CE3-CG 4.14Å; W386-P393 HydrophobicContact CH2-CG 3.81Å; W386-P393 HydrophobicContact CZ2-CG 3.58Å; W386-P393 HydrophobicContact CZ3-CG 4.08Å
394	Y	83.4	Confident	78.8	Confident	86 Å²	86	78.2 Å²	78.2	34%	0.337	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	100.4	179.4	-51.6	-73	0	0	0	110	K392 G402 F403 K406 F409	K392-Y394 PolarHBondContact O-N 3.14Å; Y394-G402 CarbonylContact O-C 3.15Å; Y394-G402 WeakPolarHBondContact O-CA 3.18Å; Y394-F403 PolarHBondContact N-O 3.07Å; Y394-F403 PolarHBondContact O-N 3.25Å; Y394-K406 HydrophobicContact CD1-CB 4.3Å; Y394-K406 HydrophobicContact CD1-CG 4.38Å; Y394-K406 HydrophobicContact CD2-CB 4.35Å; Y394-K406 HydrophobicContact CE1-CB 3.88Å; Y394-K406 HydrophobicContact CE1-CD 4.27Å; Y394-K406 HydrophobicContact CE1-CG 4.07Å; Y394-K406 HydrophobicContact CE2-CB 3.91Å; Y394-F409 HydrophobicContact CG-CB 4.28Å; Y394-F409 HydrophobicContact CG-CG 4.47Å
395	V	83.9	Confident	78.9	Confident	82 Å²	82	79.7 Å²	79.7	50%	0.497	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.5	178.9	-174.4	0	0	0	0	110.2	K392 F409	K392-V395 WeakPolarHBondContact O-CG2 3.21Å; V395-F409 WeakPolarHBondContact O-CE2 3.48Å
396	C	86.6	Confident	79	Confident	3 Å²	3	82.6 Å²	82.6	2%	0.02	44%	0.435	C	S	.	.			trans	-79.4	119.2	171.5	-177	0	0	0	0	110.4	E398 G400 R401 F409	C396-E398 VanDerWaalsContact C-N 3.27Å; C396-E398 PolarHBondContact O-N 3.02Å; C396-G400 WeakPolarHBondContact O-CA 3.39Å; C396-G400 PolarHBondContact O-N 3.44Å; C396-R401 PolarHBondContact N-O 3.5Å; C396-F409 HydrophobicContact CB-CE2 4.08Å
397	S	83.5	Confident	79.1	Confident	119 Å²	119	82 Å²	82	83%	0.832	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-35.9	175.1	43.2	0	0	0	0	112.9
398	E	83.1	Confident	79.6	Confident	114 Å²	114	79.3 Å²	79.3	53%	0.533	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-22.8	-173.6	-60.6	174.2	-130.1	0	0	114.2	C396 H416	C396-E398 VanDerWaalsContact C-N 3.27Å; C396-E398 PolarHBondContact O-N 3.02Å; E398-H416 WeakPolarHBondContact OE2-CB 3.47Å; E398-H416 IonicContact OE2-CD2 3.53Å; E398-H416 IonicContact OE2-CG 2.58Å
399	C	82.8	Confident	80.1	Confident	56 Å²	56	77.2 Å²	77.2	38%	0.378	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	11.1	-178.2	72.9	0	0	0	0	115.2	R401 H412 H416	C399-R401 PolarHBondContact O-N 3.12Å; C399-R401 VanDerWaalsContact SG-CB 3.52Å; C399-H412 PolarHBondContact SG-NE2 3Å; C399-H416 VanDerWaalsContact CB-NE2 3.25Å; C399-H416 WeakPolarHBondContact CB-NE2 3.41Å; C399-H416 PolarHBondContact SG-NE2 2.87Å
400	G	78.9	Confident	80.6	Confident	58 Å²	58	78 Å²	78	60%	0.598	42%	0.42	S	S	*	.			trans	65.3	2.7	-179.1	0	0	0	0	0	115.4	C396 G402	C396-G400 WeakPolarHBondContact O-CA 3.39Å; C396-G400 PolarHBondContact O-N 3.44Å; G400-G402 PolarHBondContact O-N 3.28Å
401	R	80.6	Confident	81.6	Confident	156 Å²	156	74 Å²	74	59%	0.589	40%	0.396	S	S	*	.			trans	-79.2	117.9	-169.1	-166.9	171.9	-174.8	166.7	6.8	112.1	C396 C399 F403	C396-R401 PolarHBondContact N-O 3.5Å; C399-R401 PolarHBondContact O-N 3.12Å; C399-R401 VanDerWaalsContact SG-CB 3.52Å; R401-F403 HydrophobicContact CB-CE2 3.96Å; R401-F403 HydrophobicContact CB-CZ 4.41Å; R401-F403 HydrophobicContact CG-CE2 3.74Å; R401-F403 HydrophobicContact CG-CZ 3.83Å; R401-F403 VanDerWaalsContact O-CD2 3.28Å; R401-F403 WeakPolarHBondContact O-CD2 3.34Å; R401-F403 WeakPolarHBondContact O-CE2 3.29Å
402	G	80.8	Confident	82.6	Confident	22 Å²	22	67.4 Å²	67.4	23%	0.227	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	145.3	175.6	0	0	0	0	0	115.1	K392 Y394 G400	K392-G402 WeakPolarHBondContact CD-O 3.36Å; Y394-G402 CarbonylContact O-C 3.15Å; Y394-G402 WeakPolarHBondContact O-CA 3.18Å; G400-G402 PolarHBondContact O-N 3.28Å
403	F	82.1	Confident	82.8	Confident	34 Å²	34	67.8 Å²	67.8	15%	0.149	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	143.8	179.2	-62.6	-96.9	0	0	0	111.6	Y394 R401 F409 H412	Y394-F403 PolarHBondContact N-O 3.07Å; Y394-F403 PolarHBondContact O-N 3.25Å; R401-F403 HydrophobicContact CB-CE2 3.96Å; R401-F403 HydrophobicContact CB-CZ 4.41Å; R401-F403 HydrophobicContact CG-CE2 3.74Å; R401-F403 HydrophobicContact CG-CZ 3.83Å; R401-F403 VanDerWaalsContact O-CD2 3.28Å; R401-F403 WeakPolarHBondContact O-CD2 3.34Å; R401-F403 WeakPolarHBondContact O-CE2 3.29Å; F403-F409 HydrophobicContact CB-CB 4.08Å; F403-F409 HydrophobicContact CD2-CB 4.29Å; F403-F409 AromaticContact CD2-CD2 3.95Å; F403-F409 HydrophobicContact CD2-CD2 3.95Å; F403-F409 HydrophobicContact CG-CB 4.22Å; F403-H412 HydrophobicContact CE1-CB 3.89Å; F403-H412 HydrophobicContact CE2-CB 3.98Å; F403-H412 AromaticContact CE2-CD2 3.11Å; F403-H412 WeakPolarHBondContact CE2-CD2 3.28Å; F403-H412 AromaticContact CE2-CG 3.69Å; F403-H412 AromaticContact CE2-NE2 3.83Å; F403-H412 HydrophobicContact CZ-CB 3.42Å; F403-H412 VanDerWaalsContact CZ-CB 3.42Å; F403-H412 AromaticContact CZ-CD2 3.22Å; F403-H412 WeakPolarHBondContact CZ-CD2 3.25Å; F403-H412 AromaticContact CZ-CG 3.28Å; F403-H412 AromaticContact CZ-NE2 3.93Å
404	S	80.3	Confident	83	Confident	42 Å²	42	67.6 Å²	67.6	29%	0.294	36%	0.359	S	S	.	.	S	Bend	trans	-87.5	-1.9	176.6	57.7	0	0	0	0	114.5
405	E	81.9	Confident	83	Confident	55 Å²	55	67.5 Å²	67.5	26%	0.257	37%	0.368	S	S	.	.			trans	-138.5	131.6	179.4	-63.1	-177.4	158.6	0	0	111.7	R383 S407 S408 F409	R383-E405 VanDerWaalsContact CD-OE1 3.25Å; R383-E405 WeakPolarHBondContact CD-OE1 3.39Å; R383-E405 IonicContact CZ-OE1 3Å; R383-E405 VanDerWaalsContact CZ-OE1 3.23Å; R383-E405 IonicContact NE-OE1 3.37Å; R383-E405 IonicContact NH1-OE1 3.72Å; R383-E405 PolarHBondContact NH1-OE1 3.29Å; E405-S407 VanDerWaalsContact C-N 3.28Å; E405-S407 PolarHBondContact O-N 2.99Å; E405-S407 PolarHBondContact OE2-OG 3.12Å; E405-S408 PolarHBondContact O-N 2.73Å; E405-S408 VanDerWaalsContact O-N 3.13Å; E405-S408 PolarHBondContact OE2-OG 3.34Å; E405-S408 VanDerWaalsContact OE2-OG 3.12Å; E405-F409 PolarHBondContact O-N 3.38Å
406	K	82.3	Confident	82.8	Confident	132 Å²	132	68 Å²	68	57%	0.574	37%	0.365	S	S	*	.	H	α-helix	trans	-57.6	-38.3	175.5	-168.7	172.5	-178.8	174	0	112.7	Y394 S408 F409 I410	Y394-K406 HydrophobicContact CD1-CB 4.3Å; Y394-K406 HydrophobicContact CD1-CG 4.38Å; Y394-K406 HydrophobicContact CD2-CB 4.35Å; Y394-K406 HydrophobicContact CE1-CB 3.88Å; Y394-K406 HydrophobicContact CE1-CD 4.27Å; Y394-K406 HydrophobicContact CE1-CG 4.07Å; Y394-K406 HydrophobicContact CE2-CB 3.91Å; K406-S408 PolarHBondContact O-N 3.24Å; K406-F409 PolarHBondContact O-N 2.97Å; K406-I410 HydrophobicContact CG-CG1 4.25Å; K406-I410 VanDerWaalsContact O-CG1 3.29Å; K406-I410 WeakPolarHBondContact O-CG1 3.21Å; K406-I410 PolarHBondContact O-N 3.45Å
407	S	81.6	Confident	82.6	Confident	81 Å²	81	71 Å²	71	57%	0.566	39%	0.386	S	S	*	.	H	α-helix	trans	-61.4	-42.1	176.8	46.1	0	0	0	0	112.6	E405 R411	E405-S407 VanDerWaalsContact C-N 3.28Å; E405-S407 PolarHBondContact O-N 2.99Å; E405-S407 PolarHBondContact OE2-OG 3.12Å; S407-R411 WeakPolarHBondContact O-CB 3.36Å; S407-R411 PolarHBondContact O-N 2.9Å; S407-R411 VanDerWaalsContact O-N 3.14Å
408	S	84	Confident	82.4	Confident	23 Å²	23	67.3 Å²	67.3	16%	0.161	37%	0.366	C	S	.	.	H	α-helix	trans	-73.6	-35.8	178.2	-70.8	0	0	0	0	111.7	E405 K406 R411 H412	E405-S408 PolarHBondContact O-N 2.73Å; E405-S408 VanDerWaalsContact O-N 3.13Å; E405-S408 PolarHBondContact OE2-OG 3.34Å; E405-S408 VanDerWaalsContact OE2-OG 3.12Å; K406-S408 PolarHBondContact O-N 3.24Å; S408-R411 PolarHBondContact OG-NH2 3.33Å; S408-H412 WeakPolarHBondContact O-CB 2.93Å; S408-H412 PolarHBondContact O-N 2.95Å
409	F	86.2	Confident	82.2	Confident	34 Å²	34	67.1 Å²	67.1	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-54.6	170.9	172.9	-109.3	0	0	0	112.7	Y394 V395 C396 F403 E405 K406 R411 H412 Q413	Y394-F409 HydrophobicContact CG-CB 4.28Å; Y394-F409 HydrophobicContact CG-CG 4.47Å; V395-F409 WeakPolarHBondContact O-CE2 3.48Å; C396-F409 HydrophobicContact CB-CE2 4.08Å; F403-F409 HydrophobicContact CB-CB 4.08Å; F403-F409 HydrophobicContact CD2-CB 4.29Å; F403-F409 AromaticContact CD2-CD2 3.95Å; F403-F409 HydrophobicContact CD2-CD2 3.95Å; F403-F409 HydrophobicContact CG-CB 4.22Å; E405-F409 PolarHBondContact O-N 3.38Å; K406-F409 PolarHBondContact O-N 2.97Å; F409-R411 VanDerWaalsContact C-N 3.29Å; F409-R411 PolarHBondContact O-N 3.44Å; F409-H412 CarbonylContact O-C 3.54Å; F409-H412 WeakPolarHBondContact O-CA 3.31Å; F409-H412 WeakPolarHBondContact O-CB 3.19Å; F409-H412 PolarHBondContact O-N 3.45Å; F409-Q413 PolarHBondContact O-N 2.96Å
410	I	83.8	Confident	82.3	Confident	61 Å²	61	70 Å²	70	31%	0.313	37%	0.372	S	S	.	.	H	α-helix	trans	-60.4	-39	179.5	-66.2	-65	0	0	0	111.4	K406 H412 Q413 R414	K406-I410 HydrophobicContact CG-CG1 4.25Å; K406-I410 VanDerWaalsContact O-CG1 3.29Å; K406-I410 WeakPolarHBondContact O-CG1 3.21Å; K406-I410 PolarHBondContact O-N 3.45Å; I410-H412 VanDerWaalsContact C-N 3.28Å; I410-H412 PolarHBondContact O-N 3.01Å; I410-Q413 PolarHBondContact O-N 3.5Å; I410-R414 PolarHBondContact O-N 3.13Å
411	R	83.8	Confident	82.6	Confident	102 Å²	102	70.8 Å²	70.8	39%	0.385	37%	0.366	S	S	.	.	H	α-helix	trans	-63.5	-33.7	173.2	176	175	54.9	-174.7	-8.2	112.6	S407 S408 F409 D433	S407-R411 WeakPolarHBondContact O-CB 3.36Å; S407-R411 PolarHBondContact O-N 2.9Å; S407-R411 VanDerWaalsContact O-N 3.14Å; S408-R411 PolarHBondContact OG-NH2 3.33Å; F409-R411 VanDerWaalsContact C-N 3.29Å; F409-R411 PolarHBondContact O-N 3.44Å; R411-D433 WeakPolarHBondContact CD-OD2 3.33Å; R411-D433 IonicContact CZ-OD2 2.6Å; R411-D433 IonicContact NE-OD2 3.23Å; R411-D433 IonicContact NH1-OD2 3.68Å; R411-D433 PolarHBondContact NH1-OD2 2.98Å
412	H	85.4	Confident	83	Confident	21 Å²	21	67 Å²	67	10%	0.097	35%	0.352	C	S	.	.	H	α-helix	trans	-74.5	-39.2	175.5	167.2	54.7	0	0	0	112.4	C399 F403 S408 F409 I410 R414 T415	C399-H412 PolarHBondContact SG-NE2 3Å; F403-H412 HydrophobicContact CE1-CB 3.89Å; F403-H412 HydrophobicContact CE2-CB 3.98Å; F403-H412 AromaticContact CE2-CD2 3.11Å; F403-H412 WeakPolarHBondContact CE2-CD2 3.28Å; F403-H412 AromaticContact CE2-CG 3.69Å; F403-H412 AromaticContact CE2-NE2 3.83Å; F403-H412 HydrophobicContact CZ-CB 3.42Å; F403-H412 VanDerWaalsContact CZ-CB 3.42Å; F403-H412 AromaticContact CZ-CD2 3.22Å; F403-H412 WeakPolarHBondContact CZ-CD2 3.25Å; F403-H412 AromaticContact CZ-CG 3.28Å; F403-H412 AromaticContact CZ-NE2 3.93Å; S408-H412 WeakPolarHBondContact O-CB 2.93Å; S408-H412 PolarHBondContact O-N 2.95Å; F409-H412 CarbonylContact O-C 3.54Å; F409-H412 WeakPolarHBondContact O-CA 3.31Å; F409-H412 WeakPolarHBondContact O-CB 3.19Å; F409-H412 PolarHBondContact O-N 3.45Å; I410-H412 VanDerWaalsContact C-N 3.28Å; I410-H412 PolarHBondContact O-N 3.01Å; H412-R414 PolarHBondContact O-N 3.5Å; H412-T415 PolarHBondContact ND1-OG1 3.1Å; H412-T415 WeakPolarHBondContact O-CA 3.47Å; H412-T415 VanDerWaalsContact O-CB 3.31Å; H412-T415 WeakPolarHBondContact O-CB 3.04Å; H412-T415 PolarHBondContact O-N 3.26Å; H412-T415 PolarHBondContact O-OG1 3.13Å
413	Q	83.6	Confident	83.4	Confident	79 Å²	79	69.4 Å²	69.4	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-55.8	-38.8	176	-168.9	178.1	-8.7	0	0	111.7	F409 I410 T415 H416 S417	F409-Q413 PolarHBondContact O-N 2.96Å; I410-Q413 PolarHBondContact O-N 3.5Å; Q413-T415 PolarHBondContact O-N 3.33Å; Q413-T415 VanDerWaalsContact O-N 3.07Å; Q413-H416 PolarHBondContact O-N 3.19Å; Q413-S417 PolarHBondContact O-N 2.96Å
414	R	85.3	Confident	83.9	Confident	59 Å²	59	67.8 Å²	67.8	22%	0.223	36%	0.355	C	S	.	.	H	α-helix	trans	-58.8	-16.7	170.9	-68.3	-179.1	-174.5	156.9	5.1	115.5	I410 H412 H416 G418 E419 C432	I410-R414 PolarHBondContact O-N 3.13Å; H412-R414 PolarHBondContact O-N 3.5Å; R414-H416 VanDerWaalsContact C-N 3.34Å; R414-G418 PolarHBondContact O-N 3.21Å; R414-E419 HydrophobicContact CB-CB 4.41Å; R414-E419 HydrophobicContact CG-CB 4.12Å; R414-C432 HydrophobicContact CB-CB 4.08Å; R414-C432 PolarHBondContact NH1-O 2.58Å
415	T	81.9	Confident	84.3	Confident	84 Å²	84	73.8 Å²	73.8	52%	0.515	38%	0.383	S	S	.	.	H	α-helix	trans	-77.8	-21.5	174.3	67.8	0	0	0	0	112.7	H412 Q413	H412-T415 PolarHBondContact ND1-OG1 3.1Å; H412-T415 WeakPolarHBondContact O-CA 3.47Å; H412-T415 VanDerWaalsContact O-CB 3.31Å; H412-T415 WeakPolarHBondContact O-CB 3.04Å; H412-T415 PolarHBondContact O-N 3.26Å; H412-T415 PolarHBondContact O-OG1 3.13Å; Q413-T415 PolarHBondContact O-N 3.33Å; Q413-T415 VanDerWaalsContact O-N 3.07Å
416	H	81	Confident	84.5	Confident	93 Å²	93	76.8 Å²	76.8	43%	0.431	40%	0.397	S	S	.	.	H	α-helix	trans	-93.5	-50.2	175.1	-56.4	-62.5	0	0	0	112.1	E398 C399 Q413 R414 G418	E398-H416 WeakPolarHBondContact OE2-CB 3.47Å; E398-H416 IonicContact OE2-CD2 3.53Å; E398-H416 IonicContact OE2-CG 2.58Å; C399-H416 VanDerWaalsContact CB-NE2 3.25Å; C399-H416 WeakPolarHBondContact CB-NE2 3.41Å; C399-H416 PolarHBondContact SG-NE2 2.87Å; Q413-H416 PolarHBondContact O-N 3.19Å; R414-H416 VanDerWaalsContact C-N 3.34Å; H416-G418 PolarHBondContact O-N 2.67Å
417	S	81.9	Confident	84.7	Confident	67 Å²	67	72.8 Å²	72.8	47%	0.469	39%	0.385	S	S	.	.	S	Bend	trans	-64.6	-11.8	176.7	66.7	0	0	0	0	113.8	Q413 E419	Q413-S417 PolarHBondContact O-N 2.96Å; S417-E419 PolarHBondContact O-N 3.08Å; S417-E419 VanDerWaalsContact O-N 3.12Å; S417-E419 WeakPolarHBondContact OG-CG 3.46Å
418	G	79	Confident	84.8	Confident	40 Å²	40	71.4 Å²	71.4	41%	0.412	38%	0.384	S	S	.	.			trans	73.1	-3.7	-178.1	0	0	0	0	0	114.3	R414 H416 K420	R414-G418 PolarHBondContact O-N 3.21Å; H416-G418 PolarHBondContact O-N 2.67Å; G418-K420 WeakPolarHBondContact O-CD 3.29Å; G418-K420 WeakPolarHBondContact O-CG 3.26Å; G418-K420 PolarHBondContact O-N 3.34Å
419	E	79.7	Confident	84.9	Confident	111 Å²	111	78 Å²	78	52%	0.519	41%	0.405	S	S	.	.			trans	-54.3	120.8	179.8	-78.7	-177.2	-175.2	0	0	112.1	R414 S417	R414-E419 HydrophobicContact CB-CB 4.41Å; R414-E419 HydrophobicContact CG-CB 4.12Å; S417-E419 PolarHBondContact O-N 3.08Å; S417-E419 VanDerWaalsContact O-N 3.12Å; S417-E419 WeakPolarHBondContact OG-CG 3.46Å
420	K	84.2	Confident	85	Confident	117 Å²	117	78.8 Å²	78.8	51%	0.509	42%	0.415	S	S	.	.			trans	-130.3	77.9	179.6	-74.5	156.1	-179.5	169	0	110	G418 Y422 S430 F431	G418-K420 WeakPolarHBondContact O-CD 3.29Å; G418-K420 WeakPolarHBondContact O-CG 3.26Å; G418-K420 PolarHBondContact O-N 3.34Å; K420-Y422 PolarHBondContact O-N 3.06Å; K420-Y422 VanDerWaalsContact O-N 3.08Å; K420-S430 WeakPolarHBondContact CD-O 3.14Å; K420-S430 WeakPolarHBondContact O-CB 3.35Å; K420-F431 CarbonylContact C-O 3.37Å; K420-F431 VanDerWaalsContact CA-O 3.23Å; K420-F431 WeakPolarHBondContact CA-O 3.44Å
421	P	85.9	Confident	85.1	Confident	74 Å²	74	77.9 Å²	77.9	48%	0.481	41%	0.409	S	S	.	.			trans	-65.6	-13.1	-173.3	-22.1	34.6	0	0	0	114.8
422	Y	88.7	Confident	85.1	Confident	76 Å²	76	74.6 Å²	74.6	30%	0.298	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	93.5	-172.6	-57.7	-76.2	0	0	0	110.5	K420 S430 F431 D433 K434	K420-Y422 PolarHBondContact O-N 3.06Å; K420-Y422 VanDerWaalsContact O-N 3.08Å; Y422-S430 CarbonylContact O-C 3.59Å; Y422-S430 WeakPolarHBondContact O-CA 3.42Å; Y422-F431 PolarHBondContact N-O 3.37Å; Y422-F431 VanDerWaalsContact N-O 3.13Å; Y422-F431 PolarHBondContact O-N 3.19Å; Y422-D433 VanDerWaalsContact CD2-CA 3.47Å; Y422-K434 HydrophobicContact CD1-CB 3.9Å; Y422-K434 HydrophobicContact CD1-CG 4.27Å; Y422-K434 HydrophobicContact CE1-CB 3.73Å; Y422-K434 HydrophobicContact CE1-CD 4.39Å; Y422-K434 HydrophobicContact CE1-CG 4.28Å; Y422-K434 HydrophobicContact CG-CB 4.42Å
423	V	88.4	Confident	85	Confident	72 Å²	72	74.5 Å²	74.5	44%	0.436	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	136.7	-180	-169.6	0	0	0	0	111
424	C	92.2	Very high	85	Confident	1 Å²	1	77.2 Å²	77.2	1%	0.007	41%	0.412	C	S	.	.			trans	-83.9	113.6	166.6	-173.4	0	0	0	0	109.5	E426 C427 G428 R429 F431 L437	C424-E426 PolarHBondContact O-N 3.48Å; C424-C427 PolarHBondContact O-N 3.44Å; C424-G428 VanDerWaalsContact O-CA 3.31Å; C424-G428 WeakPolarHBondContact O-CA 3.28Å; C424-G428 PolarHBondContact O-N 2.78Å; C424-R429 WeakPolarHBondContact CB-O 3.42Å; C424-R429 PolarHBondContact N-O 2.64Å; C424-F431 HydrophobicContact CB-CE2 4.23Å; C424-L437 HydrophobicContact CB-CD1 3.59Å
425	L	89.1	Confident	85	Confident	168 Å²	168	77.4 Å²	77.4	88%	0.88	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-31.7	-177.2	-57.9	178.8	0	0	0	112.5	C427	L425-C427 PolarHBondContact O-N 3.37Å
426	E	87	Confident	85.2	Confident	118 Å²	118	75.9 Å²	75.9	55%	0.551	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.6	-175.5	-61.5	168.7	-104.7	0	0	114.4	C424 H444	C424-E426 PolarHBondContact O-N 3.48Å; E426-H444 IonicContact OE1-CD2 2.82Å; E426-H444 WeakPolarHBondContact OE2-CB 3.43Å; E426-H444 IonicContact OE2-CD2 3.74Å; E426-H444 IonicContact OE2-CG 2.86Å
427	C	86.1	Confident	85.7	Confident	48 Å²	48	72.3 Å²	72.3	32%	0.324	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144	12.1	179.8	73.9	0	0	0	0	115.5	C424 L425 R429 H440 H444	C424-C427 PolarHBondContact O-N 3.44Å; L425-C427 PolarHBondContact O-N 3.37Å; C427-R429 PolarHBondContact O-N 2.96Å; C427-H440 PolarHBondContact SG-NE2 3.24Å; C427-H444 WeakPolarHBondContact CB-NE2 3.23Å; C427-H444 PolarHBondContact SG-NE2 3.36Å
428	G	84.1	Confident	85.9	Confident	52 Å²	52	76.9 Å²	76.9	54%	0.536	40%	0.404	S	S	.	.			trans	63.4	5.8	179.9	0	0	0	0	0	115.5	C424	C424-G428 VanDerWaalsContact O-CA 3.31Å; C424-G428 WeakPolarHBondContact O-CA 3.28Å; C424-G428 PolarHBondContact O-N 2.78Å
429	R	84.9	Confident	86.4	Confident	162 Å²	162	80 Å²	80	61%	0.611	41%	0.406	S	S	*	.			trans	-78	127.9	-177.1	-75.2	-175	174	-164.6	-0	111.8	C424 C427 F431	C424-R429 WeakPolarHBondContact CB-O 3.42Å; C424-R429 PolarHBondContact N-O 2.64Å; C427-R429 PolarHBondContact O-N 2.96Å; R429-F431 HydrophobicContact CB-CE2 3.82Å; R429-F431 HydrophobicContact CB-CZ 4.04Å; R429-F431 WeakPolarHBondContact O-CD2 3.47Å; R429-F431 WeakPolarHBondContact O-CE2 3.47Å
430	S	88.1	Confident	86.9	Confident	50 Å²	50	75.4 Å²	75.4	35%	0.35	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.7	-179.3	-36.2	0	0	0	0	112.7	K420 Y422	K420-S430 WeakPolarHBondContact CD-O 3.14Å; K420-S430 WeakPolarHBondContact O-CB 3.35Å; Y422-S430 CarbonylContact O-C 3.59Å; Y422-S430 WeakPolarHBondContact O-CA 3.42Å
431	F	86.9	Confident	87.1	Confident	42 Å²	42	73.5 Å²	73.5	18%	0.184	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.9	-177.1	-59.9	-90.9	0	0	0	111.7	K420 Y422 C424 R429 L437 H440	K420-F431 CarbonylContact C-O 3.37Å; K420-F431 VanDerWaalsContact CA-O 3.23Å; K420-F431 WeakPolarHBondContact CA-O 3.44Å; Y422-F431 PolarHBondContact N-O 3.37Å; Y422-F431 VanDerWaalsContact N-O 3.13Å; Y422-F431 PolarHBondContact O-N 3.19Å; C424-F431 HydrophobicContact CB-CE2 4.23Å; R429-F431 HydrophobicContact CB-CE2 3.82Å; R429-F431 HydrophobicContact CB-CZ 4.04Å; R429-F431 WeakPolarHBondContact O-CD2 3.47Å; R429-F431 WeakPolarHBondContact O-CE2 3.47Å; F431-L437 HydrophobicContact CB-CB 4.3Å; F431-L437 HydrophobicContact CD2-CB 4.04Å; F431-L437 HydrophobicContact CD2-CD1 3.84Å; F431-L437 HydrophobicContact CE2-CD1 4.06Å; F431-L437 HydrophobicContact CG-CB 4.29Å; F431-H440 HydrophobicContact CE1-CB 3.97Å; F431-H440 HydrophobicContact CE2-CB 4.06Å; F431-H440 AromaticContact CE2-CD2 3.2Å; F431-H440 WeakPolarHBondContact CE2-CD2 3.47Å; F431-H440 AromaticContact CE2-CG 3.71Å; F431-H440 AromaticContact CE2-NE2 3.87Å; F431-H440 HydrophobicContact CZ-CB 3.56Å; F431-H440 AromaticContact CZ-CD2 3.23Å; F431-H440 WeakPolarHBondContact CZ-CD2 3.49Å; F431-H440 AromaticContact CZ-CG 3.25Å; F431-H440 AromaticContact CZ-ND1 3.89Å; F431-H440 AromaticContact CZ-NE2 3.81Å
432	C	82.8	Confident	87.3	Confident	32 Å²	32	72.2 Å²	72.2	22%	0.216	36%	0.363	C	S	.	.	S	Bend	trans	-84.3	-15.4	-179.8	59.6	0	0	0	0	114	R414	R414-C432 HydrophobicContact CB-CB 4.08Å; R414-C432 PolarHBondContact NH1-O 2.58Å
433	D	83.5	Confident	87.2	Confident	20 Å²	20	74.1 Å²	74.1	11%	0.107	38%	0.377	C	S	.	.	S	Bend	trans	-138.8	152.3	172.3	78.7	31.9	0	0	0	114.1	R411 Y422 S435 T436 L437	R411-D433 WeakPolarHBondContact CD-OD2 3.33Å; R411-D433 IonicContact CZ-OD2 2.6Å; R411-D433 IonicContact NE-OD2 3.23Å; R411-D433 IonicContact NH1-OD2 3.68Å; R411-D433 PolarHBondContact NH1-OD2 2.98Å; Y422-D433 VanDerWaalsContact CD2-CA 3.47Å; D433-S435 PolarHBondContact O-N 2.88Å; D433-S435 PolarHBondContact OD1-N 3.21Å; D433-S435 PolarHBondContact OD1-OG 3.35Å; D433-S435 PolarHBondContact OD2-OG 3.06Å; D433-T436 PolarHBondContact O-N 3.31Å; D433-T436 PolarHBondContact O-OG1 3.4Å; D433-T436 WeakPolarHBondContact OD1-CB 3.47Å; D433-T436 WeakPolarHBondContact OD1-CG2 3.43Å; D433-T436 PolarHBondContact OD1-N 3.46Å; D433-T436 PolarHBondContact OD1-OG1 3.43Å; D433-L437 PolarHBondContact O-N 2.81Å
434	K	84.4	Confident	87.1	Confident	135 Å²	135	74.8 Å²	74.8	59%	0.587	38%	0.375	S	S	*	.	H	α-helix	trans	-65.3	-26.4	-178.6	-167.1	169.3	-176.9	169.8	0	112.9	Y422 R438	Y422-K434 HydrophobicContact CD1-CB 3.9Å; Y422-K434 HydrophobicContact CD1-CG 4.27Å; Y422-K434 HydrophobicContact CE1-CB 3.73Å; Y422-K434 HydrophobicContact CE1-CD 4.39Å; Y422-K434 HydrophobicContact CE1-CG 4.28Å; Y422-K434 HydrophobicContact CG-CB 4.42Å; K434-R438 WeakPolarHBondContact O-CB 3.45Å; K434-R438 PolarHBondContact O-N 3.11Å
435	S	85.1	Confident	86.9	Confident	64 Å²	64	78 Å²	78	45%	0.448	40%	0.398	S	S	.	.	H	α-helix	trans	-71.9	-37.3	179.7	37.6	0	0	0	0	113.2	D433 K439	D433-S435 PolarHBondContact O-N 2.88Å; D433-S435 PolarHBondContact OD1-N 3.21Å; D433-S435 PolarHBondContact OD1-OG 3.35Å; D433-S435 PolarHBondContact OD2-OG 3.06Å; S435-K439 VanDerWaalsContact O-CG 3.32Å; S435-K439 WeakPolarHBondContact O-CG 3.45Å; S435-K439 PolarHBondContact O-N 3.25Å
436	T	86.9	Confident	86.7	Confident	51 Å²	51	72 Å²	72	31%	0.313	38%	0.377	S	S	.	.	H	α-helix	trans	-73.8	-38.5	175.9	47.6	0	0	0	0	111.1	D433 K439 H440	D433-T436 PolarHBondContact O-N 3.31Å; D433-T436 PolarHBondContact O-OG1 3.4Å; D433-T436 WeakPolarHBondContact OD1-CB 3.47Å; D433-T436 WeakPolarHBondContact OD1-CG2 3.43Å; D433-T436 PolarHBondContact OD1-N 3.46Å; D433-T436 PolarHBondContact OD1-OG1 3.43Å; T436-K439 PolarHBondContact O-N 2.97Å; T436-H440 VanDerWaalsContact O-CB 3.32Å; T436-H440 WeakPolarHBondContact O-CB 3.42Å; T436-H440 PolarHBondContact O-N 2.87Å
437	L	90	Very high	86.8	Confident	19 Å²	19	71.3 Å²	71.3	10%	0.099	37%	0.374	C	S	.	.	H	α-helix	trans	-56.3	-52.4	167.7	174.4	59.7	0	0	0	111.4	C424 F431 D433 K439 H440 Q441	C424-L437 HydrophobicContact CB-CD1 3.59Å; F431-L437 HydrophobicContact CB-CB 4.3Å; F431-L437 HydrophobicContact CD2-CB 4.04Å; F431-L437 HydrophobicContact CD2-CD1 3.84Å; F431-L437 HydrophobicContact CE2-CD1 4.06Å; F431-L437 HydrophobicContact CG-CB 4.29Å; D433-L437 PolarHBondContact O-N 2.81Å; L437-K439 VanDerWaalsContact C-N 3.31Å; L437-K439 PolarHBondContact O-N 3.39Å; L437-H440 CarbonylContact O-C 3.52Å; L437-H440 WeakPolarHBondContact O-CA 3.45Å; L437-H440 WeakPolarHBondContact O-CB 3.25Å; L437-H440 PolarHBondContact O-N 3.39Å; L437-Q441 HydrophobicContact CD1-CG 4.08Å; L437-Q441 HydrophobicContact CG-CG 4.46Å; L437-Q441 WeakPolarHBondContact O-CG 3.48Å; L437-Q441 PolarHBondContact O-N 2.97Å
438	R	87.3	Confident	87	Confident	162 Å²	162	75 Å²	75	61%	0.611	38%	0.384	S	S	*	.	H	α-helix	trans	-60	-37.9	179	-175.1	-178.6	-74.9	175.9	-8.2	113	K434 H440	K434-R438 WeakPolarHBondContact O-CB 3.45Å; K434-R438 PolarHBondContact O-N 3.11Å; R438-H440 VanDerWaalsContact C-N 3.32Å
439	K	88.7	Confident	87.3	Confident	105 Å²	105	75.9 Å²	75.9	46%	0.457	38%	0.38	S	S	.	.	H	α-helix	trans	-66.2	-35.3	173.1	-75.4	176.7	177.6	-163.7	0	112.4	S435 T436 L437	S435-K439 VanDerWaalsContact O-CG 3.32Å; S435-K439 WeakPolarHBondContact O-CG 3.45Å; S435-K439 PolarHBondContact O-N 3.25Å; T436-K439 PolarHBondContact O-N 2.97Å; L437-K439 VanDerWaalsContact C-N 3.31Å; L437-K439 PolarHBondContact O-N 3.39Å
440	H	89.8	Confident	87.6	Confident	15 Å²	15	71.7 Å²	71.7	7%	0.069	37%	0.365	C	S	.	.	H	α-helix	trans	-71.7	-39.2	178.2	166.7	59.3	0	0	0	112.5	C427 F431 T436 L437 R438 R442 I443 H444	C427-H440 PolarHBondContact SG-NE2 3.24Å; F431-H440 HydrophobicContact CE1-CB 3.97Å; F431-H440 HydrophobicContact CE2-CB 4.06Å; F431-H440 AromaticContact CE2-CD2 3.2Å; F431-H440 WeakPolarHBondContact CE2-CD2 3.47Å; F431-H440 AromaticContact CE2-CG 3.71Å; F431-H440 AromaticContact CE2-NE2 3.87Å; F431-H440 HydrophobicContact CZ-CB 3.56Å; F431-H440 AromaticContact CZ-CD2 3.23Å; F431-H440 WeakPolarHBondContact CZ-CD2 3.49Å; F431-H440 AromaticContact CZ-CG 3.25Å; F431-H440 AromaticContact CZ-ND1 3.89Å; F431-H440 AromaticContact CZ-NE2 3.81Å; T436-H440 VanDerWaalsContact O-CB 3.32Å; T436-H440 WeakPolarHBondContact O-CB 3.42Å; T436-H440 PolarHBondContact O-N 2.87Å; L437-H440 CarbonylContact O-C 3.52Å; L437-H440 WeakPolarHBondContact O-CA 3.45Å; L437-H440 WeakPolarHBondContact O-CB 3.25Å; L437-H440 PolarHBondContact O-N 3.39Å; R438-H440 VanDerWaalsContact C-N 3.32Å; H440-R442 PolarHBondContact O-N 3.34Å; H440-R442 VanDerWaalsContact O-N 3.16Å; H440-I443 WeakPolarHBondContact O-CB 3.45Å; H440-I443 VanDerWaalsContact O-CG1 3.31Å; H440-I443 WeakPolarHBondContact O-CG1 3.37Å; H440-I443 PolarHBondContact O-N 3.13Å; H440-H444 AromaticContact CE1-NE2 3.94Å
441	Q	88.6	Confident	87.7	Confident	77 Å²	77	73.2 Å²	73.2	36%	0.36	37%	0.372	S	S	.	.	H	α-helix	trans	-56.6	-31.5	178	-72	174.6	-69.6	0	0	112.8	L437 I443 H444 S445	L437-Q441 HydrophobicContact CD1-CG 4.08Å; L437-Q441 HydrophobicContact CG-CG 4.46Å; L437-Q441 WeakPolarHBondContact O-CG 3.48Å; L437-Q441 PolarHBondContact O-N 2.97Å; Q441-I443 PolarHBondContact O-N 3.31Å; Q441-H444 PolarHBondContact O-N 3.02Å; Q441-S445 PolarHBondContact O-N 3.31Å; Q441-S445 VanDerWaalsContact O-N 3.09Å
442	R	90.1	Very high	87.9	Confident	48 Å²	48	71.2 Å²	71.2	18%	0.181	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.7	172.2	-61.7	-178.4	177	162.9	0.3	114.8	H440 G446 E447 S460	H440-R442 PolarHBondContact O-N 3.34Å; H440-R442 VanDerWaalsContact O-N 3.16Å; R442-G446 WeakPolarHBondContact O-CA 3.2Å; R442-G446 PolarHBondContact O-N 3.29Å; R442-E447 HydrophobicContact CB-CB 4.19Å; R442-E447 HydrophobicContact CG-CB 4.02Å; R442-E447 IonicContact NE-OE2 3.65Å; R442-E447 PolarHBondContact O-N 3.32Å; R442-S460 WeakPolarHBondContact CD-O 3.38Å; R442-S460 PolarHBondContact NH1-O 3.22Å
443	I	87	Confident	88.2	Confident	116 Å²	116	81.2 Å²	81.2	60%	0.595	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-33.3	173.7	-59.8	178.7	0	0	0	110.3	H440 Q441	H440-I443 WeakPolarHBondContact O-CB 3.45Å; H440-I443 VanDerWaalsContact O-CG1 3.31Å; H440-I443 WeakPolarHBondContact O-CG1 3.37Å; H440-I443 PolarHBondContact O-N 3.13Å; Q441-I443 PolarHBondContact O-N 3.31Å
444	H	86.5	Confident	88.4	Confident	86 Å²	86	85.4 Å²	85.4	40%	0.398	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-49.1	-179.8	-50.9	-56.9	0	0	0	111.7	E426 C427 H440 Q441 G446	E426-H444 IonicContact OE1-CD2 2.82Å; E426-H444 WeakPolarHBondContact OE2-CB 3.43Å; E426-H444 IonicContact OE2-CD2 3.74Å; E426-H444 IonicContact OE2-CG 2.86Å; C427-H444 WeakPolarHBondContact CB-NE2 3.23Å; C427-H444 PolarHBondContact SG-NE2 3.36Å; H440-H444 AromaticContact CE1-NE2 3.94Å; Q441-H444 PolarHBondContact O-N 3.02Å; H444-G446 PolarHBondContact O-N 2.83Å; H444-G446 VanDerWaalsContact O-N 3.14Å
445	S	87.7	Confident	88.6	Confident	68 Å²	68	81.7 Å²	81.7	48%	0.476	41%	0.406	S	S	.	.	S	Bend	trans	-68	-11.6	176.3	68.1	0	0	0	0	113.7	Q441 E447	Q441-S445 PolarHBondContact O-N 3.31Å; Q441-S445 VanDerWaalsContact O-N 3.09Å; S445-E447 PolarHBondContact O-N 3.08Å; S445-E447 VanDerWaalsContact O-N 3.12Å; S445-E447 WeakPolarHBondContact OG-CB 3.32Å; S445-E447 WeakPolarHBondContact OG-CG 3.38Å; S445-E447 PolarHBondContact OG-OE1 3.49Å
446	G	86.3	Confident	88.6	Confident	43 Å²	43	81.3 Å²	81.3	44%	0.443	41%	0.412	S	S	.	.			trans	69.7	2.2	-176.8	0	0	0	0	0	114.3	R442 H444 K448	R442-G446 WeakPolarHBondContact O-CA 3.2Å; R442-G446 PolarHBondContact O-N 3.29Å; H444-G446 PolarHBondContact O-N 2.83Å; H444-G446 VanDerWaalsContact O-N 3.14Å; G446-K448 PolarHBondContact O-N 3.17Å
447	E	87.6	Confident	88.7	Confident	103 Å²	103	86.1 Å²	86.1	48%	0.481	42%	0.424	S	S	.	.			trans	-50.8	124.5	-177.8	-89.8	175.3	-134.7	0	0	112.6	R442 S445	R442-E447 HydrophobicContact CB-CB 4.19Å; R442-E447 HydrophobicContact CG-CB 4.02Å; R442-E447 IonicContact NE-OE2 3.65Å; R442-E447 PolarHBondContact O-N 3.32Å; S445-E447 PolarHBondContact O-N 3.08Å; S445-E447 VanDerWaalsContact O-N 3.12Å; S445-E447 WeakPolarHBondContact OG-CB 3.32Å; S445-E447 WeakPolarHBondContact OG-CG 3.38Å; S445-E447 PolarHBondContact OG-OE1 3.49Å
448	K	90.8	Very high	88.7	Confident	126 Å²	126	86.2 Å²	86.2	55%	0.548	43%	0.43	S	S	.	.			trans	-126.5	72.2	176.5	-77	158.5	175.8	170.6	0	110.6	G446 Y450 G458 F459	G446-K448 PolarHBondContact O-N 3.17Å; K448-Y450 PolarHBondContact O-N 3.44Å; K448-G458 WeakPolarHBondContact CD-O 3.18Å; K448-F459 CarbonylContact C-O 3.54Å; K448-F459 VanDerWaalsContact C-O 3.25Å; K448-F459 VanDerWaalsContact CA-O 3.25Å; K448-F459 WeakPolarHBondContact CA-O 3.24Å
449	P	89.8	Confident	88.9	Confident	69 Å²	69	80 Å²	80	45%	0.448	41%	0.407	S	S	.	.			trans	-65.7	-13.8	-173.3	-20.5	34.2	0	0	0	114.3
450	Y	91.6	Very high	88.9	Confident	75 Å²	75	76.9 Å²	76.9	29%	0.294	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	96	-176	-52.6	-77.2	0	0	0	109	K448 F459 N462	K448-Y450 PolarHBondContact O-N 3.44Å; Y450-F459 PolarHBondContact N-O 2.89Å; Y450-F459 PolarHBondContact O-N 3.02Å; Y450-N462 HydrophobicContact CD1-CB 3.69Å; Y450-N462 WeakPolarHBondContact CD1-OD1 3.19Å; Y450-N462 HydrophobicContact CD2-CB 4.43Å; Y450-N462 VanDerWaalsContact CD2-N 3.29Å; Y450-N462 HydrophobicContact CE1-CB 3.66Å; Y450-N462 HydrophobicContact CE2-CB 4.38Å; Y450-N462 HydrophobicContact CG-CB 4.09Å
451	V	90.4	Very high	88.8	Confident	81 Å²	81	79 Å²	79	49%	0.491	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131.5	-177.8	-176.5	0	0	0	0	110.1	R453 G456	V451-R453 PolarHBondContact O-N 2.89Å; V451-G456 WeakPolarHBondContact CG1-O 3.36Å
452	C	91.6	Very high	88.8	Confident	0 Å²	0	79 Å²	79	0%	0	41%	0.411	C	S	.	.			trans	-71.8	123.6	170.4	-178.2	0	0	0	0	110	E454 C455 G456 R457 F459 L465	C452-E454 VanDerWaalsContact C-N 3.3Å; C452-E454 PolarHBondContact O-N 3.13Å; C452-C455 VanDerWaalsContact SG-SG 3.67Å; C452-G456 VanDerWaalsContact O-CA 3.24Å; C452-G456 WeakPolarHBondContact O-CA 3.41Å; C452-G456 PolarHBondContact O-N 3.37Å; C452-R457 PolarHBondContact N-O 2.97Å; C452-F459 HydrophobicContact CB-CE2 4.48Å; C452-L465 HydrophobicContact CB-CD1 3.58Å
453	R	88.7	Confident	88.5	Confident	243 Å²	243	79.2 Å²	79.2	92%	0.917	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-27.5	-179.6	-67.6	-172.7	175.1	-159.3	-2.3	113.3	V451	V451-R453 PolarHBondContact O-N 2.89Å
454	E	87.5	Confident	88.5	Confident	108 Å²	108	76.1 Å²	76.1	51%	0.505	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-31.1	-175.1	-66.8	146.1	-118.7	0	0	113.3	C452 H472	C452-E454 VanDerWaalsContact C-N 3.3Å; C452-E454 PolarHBondContact O-N 3.13Å; E454-H472 WeakPolarHBondContact OE2-CB 3.49Å; E454-H472 IonicContact OE2-CD2 3.62Å; E454-H472 PolarHBondContact OE2-CD2 3.41Å; E454-H472 IonicContact OE2-CG 2.72Å
455	C	88.2	Confident	88.7	Confident	57 Å²	57	72.8 Å²	72.8	39%	0.385	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.2	8	-176.7	70.4	0	0	0	0	114.9	C452 R457 H468 H472	C452-C455 VanDerWaalsContact SG-SG 3.67Å; C455-R457 PolarHBondContact O-N 3.41Å; C455-R457 WeakPolarHBondContact SG-CB 3.3Å; C455-H468 PolarHBondContact SG-NE2 3.3Å; C455-H472 WeakPolarHBondContact CB-NE2 3.3Å; C455-H472 PolarHBondContact SG-NE2 3.21Å
456	G	86.3	Confident	88.5	Confident	56 Å²	56	73.2 Å²	73.2	58%	0.577	39%	0.386	S	S	*	.			trans	66	2.3	-178.7	0	0	0	0	0	115.3	V451 C452 G458	V451-G456 WeakPolarHBondContact CG1-O 3.36Å; C452-G456 VanDerWaalsContact O-CA 3.24Å; C452-G456 WeakPolarHBondContact O-CA 3.41Å; C452-G456 PolarHBondContact O-N 3.37Å; G456-G458 PolarHBondContact O-N 2.96Å
457	R	89.3	Confident	88.4	Confident	152 Å²	152	75.3 Å²	75.3	57%	0.574	38%	0.383	S	S	*	.			trans	-74.5	121.1	-172.5	-170.4	173	-179.1	173.8	4.3	111.9	C452 C455 F459	C452-R457 PolarHBondContact N-O 2.97Å; C455-R457 PolarHBondContact O-N 3.41Å; C455-R457 WeakPolarHBondContact SG-CB 3.3Å; R457-F459 HydrophobicContact CB-CE2 3.97Å; R457-F459 HydrophobicContact CB-CZ 4.39Å; R457-F459 HydrophobicContact CG-CE2 3.75Å; R457-F459 HydrophobicContact CG-CZ 3.81Å; R457-F459 VanDerWaalsContact O-CD2 3.29Å; R457-F459 WeakPolarHBondContact O-CD2 3.31Å; R457-F459 WeakPolarHBondContact O-CE2 3.23Å
458	G	90.2	Very high	88.3	Confident	21 Å²	21	71.3 Å²	71.3	22%	0.216	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	140.9	176.6	0	0	0	0	0	115	K448 G456	K448-G458 WeakPolarHBondContact CD-O 3.18Å; G456-G458 PolarHBondContact O-N 2.96Å
459	F	90.2	Very high	88	Confident	31 Å²	31	68.4 Å²	68.4	14%	0.136	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.1	177.1	-61.8	-94.4	0	0	0	111.4	K448 Y450 C452 R457 Q461 D464 L465 H468	K448-F459 CarbonylContact C-O 3.54Å; K448-F459 VanDerWaalsContact C-O 3.25Å; K448-F459 VanDerWaalsContact CA-O 3.25Å; K448-F459 WeakPolarHBondContact CA-O 3.24Å; Y450-F459 PolarHBondContact N-O 2.89Å; Y450-F459 PolarHBondContact O-N 3.02Å; C452-F459 HydrophobicContact CB-CE2 4.48Å; R457-F459 HydrophobicContact CB-CE2 3.97Å; R457-F459 HydrophobicContact CB-CZ 4.39Å; R457-F459 HydrophobicContact CG-CE2 3.75Å; R457-F459 HydrophobicContact CG-CZ 3.81Å; R457-F459 VanDerWaalsContact O-CD2 3.29Å; R457-F459 WeakPolarHBondContact O-CD2 3.31Å; R457-F459 WeakPolarHBondContact O-CE2 3.23Å; F459-Q461 VanDerWaalsContact C-N 3.34Å; F459-D464 HydrophobicContact CB-CB 4.46Å; F459-D464 HydrophobicContact CD1-CB 3.89Å; F459-L465 HydrophobicContact CB-CB 4.28Å; F459-L465 HydrophobicContact CD2-CB 4.04Å; F459-L465 HydrophobicContact CD2-CD1 3.97Å; F459-L465 HydrophobicContact CE2-CD1 4.19Å; F459-L465 HydrophobicContact CG-CB 4.23Å; F459-H468 HydrophobicContact CE1-CB 3.94Å; F459-H468 HydrophobicContact CE2-CB 4.06Å; F459-H468 AromaticContact CE2-CD2 3.21Å; F459-H468 WeakPolarHBondContact CE2-CD2 3.49Å; F459-H468 AromaticContact CE2-CG 3.84Å; F459-H468 AromaticContact CE2-NE2 3.98Å; F459-H468 HydrophobicContact CZ-CB 3.48Å; F459-H468 VanDerWaalsContact CZ-CB 3.48Å; F459-H468 AromaticContact CZ-CD2 3.18Å; F459-H468 WeakPolarHBondContact CZ-CD2 3.33Å; F459-H468 AromaticContact CZ-CG 3.35Å; F459-H468 AromaticContact CZ-NE2 3.9Å
460	S	88.8	Confident	87.7	Confident	39 Å²	39	68.3 Å²	68.3	27%	0.273	34%	0.343	S	S	.	.	S	Bend	trans	-80.5	-12.8	178.1	57.9	0	0	0	0	113.6	R442	R442-S460 WeakPolarHBondContact CD-O 3.38Å; R442-S460 PolarHBondContact NH1-O 3.22Å
461	Q	88.3	Confident	87.2	Confident	60 Å²	60	68 Å²	68	28%	0.28	35%	0.349	S	S	.	.	S	Bend	trans	-138	141.3	176.1	-56.2	-175.1	93.4	0	0	112.1	F459 S463 D464 L465	F459-Q461 VanDerWaalsContact C-N 3.34Å; Q461-S463 VanDerWaalsContact C-N 3.28Å; Q461-S463 PolarHBondContact O-N 3.29Å; Q461-D464 PolarHBondContact NE2-OD2 3.35Å; Q461-D464 VanDerWaalsContact NE2-OD2 3.17Å; Q461-D464 PolarHBondContact O-N 3.33Å; Q461-D464 VanDerWaalsContact O-N 3.08Å; Q461-L465 PolarHBondContact O-N 2.85Å
462	N	87.3	Confident	86.7	Confident	76 Å²	76	68.6 Å²	68.6	41%	0.406	35%	0.346	S	S	.	.	H	α-helix	trans	-62.2	-32.5	179.4	-163.4	51	0	0	0	113.4	Y450 D464 L465 I466	Y450-N462 HydrophobicContact CD1-CB 3.69Å; Y450-N462 WeakPolarHBondContact CD1-OD1 3.19Å; Y450-N462 HydrophobicContact CD2-CB 4.43Å; Y450-N462 VanDerWaalsContact CD2-N 3.29Å; Y450-N462 HydrophobicContact CE1-CB 3.66Å; Y450-N462 HydrophobicContact CE2-CB 4.38Å; Y450-N462 HydrophobicContact CG-CB 4.09Å; N462-D464 PolarHBondContact O-N 2.89Å; N462-L465 PolarHBondContact O-N 2.8Å; N462-I466 WeakPolarHBondContact O-CG1 3.39Å; N462-I466 PolarHBondContact O-N 2.86Å
463	S	85	Confident	85.9	Confident	54 Å²	54	73.9 Å²	73.9	38%	0.378	37%	0.374	S	S	.	.	H	α-helix	trans	-59	-33.8	175.2	52.6	0	0	0	0	112.6	Q461 K467	Q461-S463 VanDerWaalsContact C-N 3.28Å; Q461-S463 PolarHBondContact O-N 3.29Å; S463-K467 VanDerWaalsContact O-CG 3.26Å; S463-K467 WeakPolarHBondContact O-CG 3.48Å; S463-K467 PolarHBondContact O-N 3.14Å; S463-K467 VanDerWaalsContact O-N 3.13Å
464	D	87.6	Confident	85	Confident	51 Å²	51	67.3 Å²	67.3	27%	0.273	36%	0.357	S	S	.	.	H	α-helix	trans	-84.2	-33.7	-173.9	-53.5	-20.1	0	0	0	109.5	F459 Q461 N462 H468	F459-D464 HydrophobicContact CB-CB 4.46Å; F459-D464 HydrophobicContact CD1-CB 3.89Å; Q461-D464 PolarHBondContact NE2-OD2 3.35Å; Q461-D464 VanDerWaalsContact NE2-OD2 3.17Å; Q461-D464 PolarHBondContact O-N 3.33Å; Q461-D464 VanDerWaalsContact O-N 3.08Å; N462-D464 PolarHBondContact O-N 2.89Å; D464-H468 WeakPolarHBondContact O-CB 3.49Å; D464-H468 PolarHBondContact O-N 3.39Å
465	L	89	Confident	84.5	Confident	15 Å²	15	67 Å²	67	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-60.1	-51.9	166.2	173.4	59.7	0	0	0	111.7	C452 F459 Q461 N462 K467 H468 Q469	C452-L465 HydrophobicContact CB-CD1 3.58Å; F459-L465 HydrophobicContact CB-CB 4.28Å; F459-L465 HydrophobicContact CD2-CB 4.04Å; F459-L465 HydrophobicContact CD2-CD1 3.97Å; F459-L465 HydrophobicContact CE2-CD1 4.19Å; F459-L465 HydrophobicContact CG-CB 4.23Å; Q461-L465 PolarHBondContact O-N 2.85Å; N462-L465 PolarHBondContact O-N 2.8Å; L465-K467 VanDerWaalsContact C-N 3.31Å; L465-K467 PolarHBondContact O-N 3.28Å; L465-H468 CarbonylContact O-C 3.53Å; L465-H468 WeakPolarHBondContact O-CA 3.49Å; L465-H468 WeakPolarHBondContact O-CB 3.45Å; L465-H468 PolarHBondContact O-N 3.17Å; L465-Q469 HydrophobicContact CD1-CG 4.04Å; L465-Q469 HydrophobicContact CG-CG 4.46Å; L465-Q469 PolarHBondContact O-N 3.12Å
466	I	85.1	Confident	84.1	Confident	78 Å²	78	68.6 Å²	68.6	40%	0.4	36%	0.356	S	S	.	.	H	α-helix	trans	-59.7	-42	-179.9	-68.6	167.4	0	0	0	111.2	N462 H468 Q469	N462-I466 WeakPolarHBondContact O-CG1 3.39Å; N462-I466 PolarHBondContact O-N 2.86Å; I466-H468 VanDerWaalsContact C-N 3.26Å; I466-H468 PolarHBondContact O-N 3.09Å; I466-Q469 PolarHBondContact O-N 3.38Å
467	K	83.3	Confident	84	Confident	86 Å²	86	69.4 Å²	69.4	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-32.9	174.2	-75.6	177.6	-176	-164	0	112.8	S463 L465 D489	S463-K467 VanDerWaalsContact O-CG 3.26Å; S463-K467 WeakPolarHBondContact O-CG 3.48Å; S463-K467 PolarHBondContact O-N 3.14Å; S463-K467 VanDerWaalsContact O-N 3.13Å; L465-K467 VanDerWaalsContact C-N 3.31Å; L465-K467 PolarHBondContact O-N 3.28Å; K467-D489 VanDerWaalsContact CE-OD2 3.24Å; K467-D489 WeakPolarHBondContact CE-OD2 3.49Å; K467-D489 IonicContact NZ-OD2 3.02Å; K467-D489 PolarHBondContact NZ-OD2 3.2Å
468	H	86.1	Confident	83.8	Confident	19 Å²	19	65.7 Å²	65.7	9%	0.088	34%	0.338	C	S	.	.	H	α-helix	trans	-76.3	-37.1	176.6	170.8	49.8	0	0	0	113	C455 F459 D464 L465 I466 R470 T471 H472	C455-H468 PolarHBondContact SG-NE2 3.3Å; F459-H468 HydrophobicContact CE1-CB 3.94Å; F459-H468 HydrophobicContact CE2-CB 4.06Å; F459-H468 AromaticContact CE2-CD2 3.21Å; F459-H468 WeakPolarHBondContact CE2-CD2 3.49Å; F459-H468 AromaticContact CE2-CG 3.84Å; F459-H468 AromaticContact CE2-NE2 3.98Å; F459-H468 HydrophobicContact CZ-CB 3.48Å; F459-H468 VanDerWaalsContact CZ-CB 3.48Å; F459-H468 AromaticContact CZ-CD2 3.18Å; F459-H468 WeakPolarHBondContact CZ-CD2 3.33Å; F459-H468 AromaticContact CZ-CG 3.35Å; F459-H468 AromaticContact CZ-NE2 3.9Å; D464-H468 WeakPolarHBondContact O-CB 3.49Å; D464-H468 PolarHBondContact O-N 3.39Å; L465-H468 CarbonylContact O-C 3.53Å; L465-H468 WeakPolarHBondContact O-CA 3.49Å; L465-H468 WeakPolarHBondContact O-CB 3.45Å; L465-H468 PolarHBondContact O-N 3.17Å; I466-H468 VanDerWaalsContact C-N 3.26Å; I466-H468 PolarHBondContact O-N 3.09Å; H468-R470 PolarHBondContact O-N 3Å; H468-T471 PolarHBondContact ND1-OG1 2.88Å; H468-T471 WeakPolarHBondContact O-CA 3.36Å; H468-T471 WeakPolarHBondContact O-CB 3.39Å; H468-T471 PolarHBondContact O-N 3.4Å; H468-T471 PolarHBondContact O-OG1 3.1Å; H468-H472 AromaticContact CE1-NE2 3.66Å; H468-H472 AromaticContact NE2-NE2 3.96Å
469	Q	83.8	Confident	83.7	Confident	65 Å²	65	68.5 Å²	68.5	30%	0.304	35%	0.35	S	S	.	.	H	α-helix	trans	-59	-33.7	177.8	-71.6	177.2	-74.4	0	0	112.4	L465 I466 T471 H472 L473	L465-Q469 HydrophobicContact CD1-CG 4.04Å; L465-Q469 HydrophobicContact CG-CG 4.46Å; L465-Q469 PolarHBondContact O-N 3.12Å; I466-Q469 PolarHBondContact O-N 3.38Å; Q469-T471 PolarHBondContact O-N 3.29Å; Q469-H472 PolarHBondContact O-N 2.87Å; Q469-L473 PolarHBondContact O-N 3.17Å
470	R	84	Confident	83.8	Confident	68 Å²	68	67 Å²	67	26%	0.257	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.4	169.9	-63.9	175.4	-177.9	178.5	-3.5	114.5	H468 D474 E475 C488	H468-R470 PolarHBondContact O-N 3Å; R470-D474 PolarHBondContact O-N 3.5Å; R470-E475 PolarHBondContact O-N 3.02Å; R470-C488 HydrophobicContact CB-CB 3.95Å; R470-C488 PolarHBondContact NH1-O 3.3Å
471	T	80.4	Confident	83.8	Confident	68 Å²	68	76.9 Å²	76.9	42%	0.417	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-12	176.4	68	0	0	0	0	113.7	H468 Q469	H468-T471 PolarHBondContact ND1-OG1 2.88Å; H468-T471 WeakPolarHBondContact O-CA 3.36Å; H468-T471 WeakPolarHBondContact O-CB 3.39Å; H468-T471 PolarHBondContact O-N 3.4Å; H468-T471 PolarHBondContact O-OG1 3.1Å; Q469-T471 PolarHBondContact O-N 3.29Å
472	H	80	Confident	83.8	Confident	93 Å²	93	80.1 Å²	80.1	43%	0.431	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-40.9	173.6	-61.6	-52.4	0	0	0	112	E454 C455 H468 Q469 D474	E454-H472 WeakPolarHBondContact OE2-CB 3.49Å; E454-H472 IonicContact OE2-CD2 3.62Å; E454-H472 PolarHBondContact OE2-CD2 3.41Å; E454-H472 IonicContact OE2-CG 2.72Å; C455-H472 WeakPolarHBondContact CB-NE2 3.3Å; C455-H472 PolarHBondContact SG-NE2 3.21Å; H468-H472 AromaticContact CE1-NE2 3.66Å; H468-H472 AromaticContact NE2-NE2 3.96Å; Q469-H472 PolarHBondContact O-N 2.87Å; H472-D474 PolarHBondContact O-N 3.03Å
473	L	75.1	Confident	83.9	Confident	111 Å²	111	79.4 Å²	79.4	58%	0.581	39%	0.391	S	S	*	.	S	Bend	trans	-71.6	-3.9	173.8	-57.1	176.3	0	0	0	113.3	Q469 E475	Q469-L473 PolarHBondContact O-N 3.17Å; L473-E475 HydrophobicContact CB-CB 4.29Å; L473-E475 HydrophobicContact CB-CG 3.83Å; L473-E475 PolarHBondContact O-N 3.42Å
474	D	70.4	Confident	83.9	Confident	106 Å²	106	79.6 Å²	79.6	57%	0.567	40%	0.401	S	S	*	.			trans	51.4	11.3	-170.3	-124.7	-8.7	0	0	0	115.8	R470 H472 K476	R470-D474 PolarHBondContact O-N 3.5Å; H472-D474 PolarHBondContact O-N 3.03Å; D474-K476 WeakPolarHBondContact O-CG 3.22Å; D474-K476 PolarHBondContact O-N 3.42Å; D474-K476 PolarHBondContact O-NZ 3.01Å; D474-K476 VanDerWaalsContact O-NZ 3.11Å; D474-K476 WeakPolarHBondContact OD1-CE 3.38Å; D474-K476 IonicContact OD1-NZ 2.9Å; D474-K476 PolarHBondContact OD1-NZ 2.99Å; D474-K476 IonicContact OD2-NZ 3.85Å; D474-K476 PolarHBondContact OD2-NZ 3.39Å
475	E	75.6	Confident	83.8	Confident	101 Å²	101	84.8 Å²	84.8	47%	0.472	42%	0.417	S	S	.	.			trans	-56.7	116.4	175.6	-79.3	-176.6	-174.4	0	0	110.7	R470 L473 P477	R470-E475 PolarHBondContact O-N 3.02Å; L473-E475 HydrophobicContact CB-CB 4.29Å; L473-E475 HydrophobicContact CB-CG 3.83Å; L473-E475 PolarHBondContact O-N 3.42Å; E475-P477 VanDerWaalsContact C-CD 3.49Å; E475-P477 WeakPolarHBondContact O-CD 3.19Å
476	K	81	Confident	83.6	Confident	90 Å²	90	84.9 Å²	84.9	39%	0.391	42%	0.422	S	S	.	.			trans	-121.6	74.3	177.2	-71.1	162	-163.4	109.8	0	109.7	D474 Y478 F487	D474-K476 WeakPolarHBondContact O-CG 3.22Å; D474-K476 PolarHBondContact O-N 3.42Å; D474-K476 PolarHBondContact O-NZ 3.01Å; D474-K476 VanDerWaalsContact O-NZ 3.11Å; D474-K476 WeakPolarHBondContact OD1-CE 3.38Å; D474-K476 IonicContact OD1-NZ 2.9Å; D474-K476 PolarHBondContact OD1-NZ 2.99Å; D474-K476 IonicContact OD2-NZ 3.85Å; D474-K476 PolarHBondContact OD2-NZ 3.39Å; K476-Y478 PolarHBondContact O-N 2.95Å; K476-F487 CarbonylContact C-O 3.55Å; K476-F487 WeakPolarHBondContact CA-O 3.5Å
477	P	83.3	Confident	83.6	Confident	73 Å²	73	82.5 Å²	82.5	47%	0.474	41%	0.408	S	S	.	.			trans	-62.1	-14.5	-175.3	-21.9	33.7	0	0	0	114.3	E475	E475-P477 VanDerWaalsContact C-CD 3.49Å; E475-P477 WeakPolarHBondContact O-CD 3.19Å
478	Y	86.6	Confident	83.5	Confident	75 Å²	75	80.2 Å²	80.2	29%	0.294	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	94.5	-177	-51	-70.5	0	0	0	109.3	K476 G486 F487 D489 K490	K476-Y478 PolarHBondContact O-N 2.95Å; Y478-G486 CarbonylContact O-C 3.13Å; Y478-F487 WeakPolarHBondContact CD2-O 3.38Å; Y478-F487 PolarHBondContact N-O 2.89Å; Y478-F487 PolarHBondContact O-N 2.67Å; Y478-D489 VanDerWaalsContact CD2-C 3.44Å; Y478-K490 HydrophobicContact CD1-CB 3.81Å; Y478-K490 HydrophobicContact CD1-CG 4.27Å; Y478-K490 HydrophobicContact CD2-CB 4.41Å; Y478-K490 HydrophobicContact CE1-CB 3.74Å; Y478-K490 HydrophobicContact CE1-CG 4.37Å; Y478-K490 HydrophobicContact CE2-CB 4.32Å; Y478-K490 HydrophobicContact CG-CB 4.15Å
479	V	87.3	Confident	83.3	Confident	80 Å²	80	80.7 Å²	80.7	49%	0.485	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	130.7	180	-176.9	0	0	0	0	110.3	R481 G484	V479-R481 PolarHBondContact O-N 2.8Å; V479-G484 WeakPolarHBondContact CG1-O 3.3Å
480	C	92	Very high	83.4	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	42%	0.418	C	S	.	.			trans	-72.2	123.7	171.9	-179.5	0	0	0	0	110.3	E482 C483 G484 R485 F487 L493 H500	C480-E482 VanDerWaalsContact C-N 3.31Å; C480-E482 PolarHBondContact O-N 2.88Å; C480-C483 VanDerWaalsContact SG-SG 3.63Å; C480-G484 VanDerWaalsContact O-CA 3.3Å; C480-G484 WeakPolarHBondContact O-CA 3.49Å; C480-G484 PolarHBondContact O-N 3.46Å; C480-R485 WeakPolarHBondContact CB-O 3.24Å; C480-R485 PolarHBondContact N-O 3.33Å; C480-F487 HydrophobicContact CB-CE2 4.25Å; C480-L493 HydrophobicContact CB-CD1 3.56Å; C480-H500 PolarHBondContact SG-NE2 3.01Å; C480-H500 VanDerWaalsContact SG-NE2 3.43Å
481	R	89.1	Confident	83.4	Confident	245 Å²	245	83 Å²	83	93%	0.925	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-27.4	-176.7	-66.1	-174.1	174.4	-156.8	-2.9	113.7	V479	V479-R481 PolarHBondContact O-N 2.8Å
482	E	88.9	Confident	83.7	Confident	129 Å²	129	82.7 Å²	82.7	60%	0.603	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-27.8	-174.2	-65.2	166.8	125.7	0	0	113.5	C480 H500	C480-E482 VanDerWaalsContact C-N 3.31Å; C480-E482 PolarHBondContact O-N 2.88Å; E482-H500 WeakPolarHBondContact OE2-CB 3.34Å; E482-H500 IonicContact OE2-CD2 3.32Å; E482-H500 PolarHBondContact OE2-CD2 3.12Å; E482-H500 IonicContact OE2-CG 2.64Å
483	C	89.3	Confident	84.2	Confident	61 Å²	61	79 Å²	79	41%	0.412	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	6	-175.8	72.8	0	0	0	0	114.6	C480 R485 H496 H500	C480-C483 VanDerWaalsContact SG-SG 3.63Å; C483-R485 PolarHBondContact O-N 3.43Å; C483-R485 WeakPolarHBondContact SG-CB 3.26Å; C483-H496 PolarHBondContact SG-NE2 3.21Å; C483-H500 PolarHBondContact SG-NE2 3.31Å
484	G	84.2	Confident	84.8	Confident	58 Å²	58	77 Å²	77	60%	0.598	40%	0.395	S	S	*	.			trans	66.4	1.2	-178.8	0	0	0	0	0	115.4	V479 C480 G486	V479-G484 WeakPolarHBondContact CG1-O 3.3Å; C480-G484 VanDerWaalsContact O-CA 3.3Å; C480-G484 WeakPolarHBondContact O-CA 3.49Å; C480-G484 PolarHBondContact O-N 3.46Å; G484-G486 PolarHBondContact O-N 3.15Å
485	R	85.5	Confident	85.6	Confident	159 Å²	159	74.3 Å²	74.3	60%	0.6	38%	0.38	S	S	*	.			trans	-74.3	124.1	-173.6	-170.7	171.9	-177.5	167.2	7.3	111.8	C480 C483 F487	C480-R485 WeakPolarHBondContact CB-O 3.24Å; C480-R485 PolarHBondContact N-O 3.33Å; C483-R485 PolarHBondContact O-N 3.43Å; C483-R485 WeakPolarHBondContact SG-CB 3.26Å; R485-F487 HydrophobicContact CB-CE2 4.04Å; R485-F487 HydrophobicContact CB-CZ 4.28Å; R485-F487 HydrophobicContact CG-CE2 3.9Å; R485-F487 HydrophobicContact CG-CZ 3.78Å; R485-F487 WeakPolarHBondContact O-CD2 3.47Å; R485-F487 WeakPolarHBondContact O-CE2 3.33Å
486	G	85.3	Confident	86.3	Confident	18 Å²	18	70.8 Å²	70.8	19%	0.186	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	147.8	176.3	0	0	0	0	0	114.9	Y478 G484	Y478-G486 CarbonylContact O-C 3.13Å; G484-G486 PolarHBondContact O-N 3.15Å
487	F	84.4	Confident	86.6	Confident	27 Å²	27	69.6 Å²	69.6	12%	0.118	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.7	177.2	-59.2	-89.3	0	0	0	111.7	K476 Y478 C480 R485 T492 L493 H496	K476-F487 CarbonylContact C-O 3.55Å; K476-F487 WeakPolarHBondContact CA-O 3.5Å; Y478-F487 WeakPolarHBondContact CD2-O 3.38Å; Y478-F487 PolarHBondContact N-O 2.89Å; Y478-F487 PolarHBondContact O-N 2.67Å; C480-F487 HydrophobicContact CB-CE2 4.25Å; R485-F487 HydrophobicContact CB-CE2 4.04Å; R485-F487 HydrophobicContact CB-CZ 4.28Å; R485-F487 HydrophobicContact CG-CE2 3.9Å; R485-F487 HydrophobicContact CG-CZ 3.78Å; R485-F487 WeakPolarHBondContact O-CD2 3.47Å; R485-F487 WeakPolarHBondContact O-CE2 3.33Å; F487-T492 HydrophobicContact CD1-CG2 3.63Å; F487-T492 HydrophobicContact CE1-CG2 4.11Å; F487-L493 HydrophobicContact CB-CB 4.36Å; F487-L493 HydrophobicContact CD2-CB 4.04Å; F487-L493 HydrophobicContact CD2-CD1 3.81Å; F487-L493 HydrophobicContact CE2-CD1 4Å; F487-L493 HydrophobicContact CG-CB 4.33Å; F487-H496 HydrophobicContact CE1-CB 4.11Å; F487-H496 HydrophobicContact CE2-CB 4.11Å; F487-H496 AromaticContact CE2-CD2 3.3Å; F487-H496 WeakPolarHBondContact CE2-CD2 3.46Å; F487-H496 AromaticContact CE2-CG 3.89Å; F487-H496 HydrophobicContact CZ-CB 3.6Å; F487-H496 AromaticContact CZ-CD2 3.22Å; F487-H496 WeakPolarHBondContact CZ-CD2 3.33Å; F487-H496 AromaticContact CZ-CG 3.39Å; F487-H496 AromaticContact CZ-NE2 3.94Å
488	C	81	Confident	87	Confident	38 Å²	38	68.4 Å²	68.4	26%	0.257	35%	0.345	S	S	.	.	S	Bend	trans	-83.8	-10.6	177.8	59.9	0	0	0	0	114.4	R470	R470-C488 HydrophobicContact CB-CB 3.95Å; R470-C488 PolarHBondContact NH1-O 3.3Å
489	D	82.6	Confident	87.1	Confident	29 Å²	29	68.9 Å²	68.9	16%	0.155	36%	0.356	C	S	.	.	S	Bend	trans	-139.8	126.9	-178.5	-171.9	-32.5	0	0	0	111.4	K467 Y478 S491 T492 L493	K467-D489 VanDerWaalsContact CE-OD2 3.24Å; K467-D489 WeakPolarHBondContact CE-OD2 3.49Å; K467-D489 IonicContact NZ-OD2 3.02Å; K467-D489 PolarHBondContact NZ-OD2 3.2Å; Y478-D489 VanDerWaalsContact CD2-C 3.44Å; D489-S491 PolarHBondContact O-N 2.84Å; D489-S491 WeakPolarHBondContact OD1-CB 3.38Å; D489-S491 PolarHBondContact OD1-N 2.94Å; D489-S491 PolarHBondContact OD1-OG 3.38Å; D489-S491 PolarHBondContact OD2-OG 3.18Å; D489-T492 WeakPolarHBondContact O-CB 3.32Å; D489-T492 PolarHBondContact O-N 3.41Å; D489-L493 PolarHBondContact O-N 2.66Å
490	K	84.7	Confident	87.1	Confident	127 Å²	127	68.6 Å²	68.6	55%	0.552	35%	0.349	S	S	*	.	H	α-helix	trans	-53.1	-36.5	177.4	-172.8	176.6	-179.9	177.3	0	112.9	Y478 T492 L493 I494	Y478-K490 HydrophobicContact CD1-CB 3.81Å; Y478-K490 HydrophobicContact CD1-CG 4.27Å; Y478-K490 HydrophobicContact CD2-CB 4.41Å; Y478-K490 HydrophobicContact CE1-CB 3.74Å; Y478-K490 HydrophobicContact CE1-CG 4.37Å; Y478-K490 HydrophobicContact CE2-CB 4.32Å; Y478-K490 HydrophobicContact CG-CB 4.15Å; K490-T492 VanDerWaalsContact C-N 3.26Å; K490-T492 PolarHBondContact O-N 3.22Å; K490-L493 PolarHBondContact O-N 3.31Å; K490-I494 HydrophobicContact CG-CD1 4.06Å; K490-I494 WeakPolarHBondContact O-CG1 3.3Å; K490-I494 PolarHBondContact O-N 2.85Å
491	S	85.1	Confident	87	Confident	56 Å²	56	71.8 Å²	71.8	39%	0.392	37%	0.372	S	S	.	.	H	α-helix	trans	-64.5	-32.1	177.9	62.9	0	0	0	0	112.4	D489 I495	D489-S491 PolarHBondContact O-N 2.84Å; D489-S491 WeakPolarHBondContact OD1-CB 3.38Å; D489-S491 PolarHBondContact OD1-N 2.94Å; D489-S491 PolarHBondContact OD1-OG 3.38Å; D489-S491 PolarHBondContact OD2-OG 3.18Å; S491-I495 WeakPolarHBondContact O-CB 3.17Å; S491-I495 VanDerWaalsContact O-CD1 3.3Å; S491-I495 WeakPolarHBondContact O-CD1 3.49Å; S491-I495 WeakPolarHBondContact O-CG1 3.44Å; S491-I495 PolarHBondContact O-N 3.02Å
492	T	86.4	Confident	86.9	Confident	60 Å²	60	62 Å²	62	37%	0.368	35%	0.347	S	S	.	.	H	α-helix	trans	-78.6	-35.1	178	-57.7	0	0	0	0	111	F487 D489 K490 I495 H496	F487-T492 HydrophobicContact CD1-CG2 3.63Å; F487-T492 HydrophobicContact CE1-CG2 4.11Å; D489-T492 WeakPolarHBondContact O-CB 3.32Å; D489-T492 PolarHBondContact O-N 3.41Å; K490-T492 VanDerWaalsContact C-N 3.26Å; K490-T492 PolarHBondContact O-N 3.22Å; T492-I495 PolarHBondContact O-N 2.84Å; T492-H496 WeakPolarHBondContact O-CB 3.35Å; T492-H496 PolarHBondContact O-N 2.73Å
493	L	90.4	Very high	86.9	Confident	16 Å²	16	61 Å²	61	8%	0.084	34%	0.342	C	S	.	.	H	α-helix	trans	-58.6	-54.2	169.3	172.2	60.7	0	0	0	111.2	C480 F487 D489 K490 I495 H496 E497	C480-L493 HydrophobicContact CB-CD1 3.56Å; F487-L493 HydrophobicContact CB-CB 4.36Å; F487-L493 HydrophobicContact CD2-CB 4.04Å; F487-L493 HydrophobicContact CD2-CD1 3.81Å; F487-L493 HydrophobicContact CE2-CD1 4Å; F487-L493 HydrophobicContact CG-CB 4.33Å; D489-L493 PolarHBondContact O-N 2.66Å; K490-L493 PolarHBondContact O-N 3.31Å; L493-I495 PolarHBondContact O-N 3.46Å; L493-H496 CarbonylContact O-C 3.55Å; L493-H496 WeakPolarHBondContact O-CA 3.47Å; L493-H496 WeakPolarHBondContact O-CB 3.46Å; L493-H496 PolarHBondContact O-N 3.43Å; L493-E497 HydrophobicContact CD1-CG 3.88Å; L493-E497 HydrophobicContact CG-CG 4.29Å; L493-E497 PolarHBondContact O-N 3.45Å
494	I	87.8	Confident	87	Confident	70 Å²	70	64 Å²	64	36%	0.359	35%	0.348	S	S	.	.	H	α-helix	trans	-56.9	-40.3	179.9	-66.9	164.3	0	0	0	111.6	K490 H496 E497 R498	K490-I494 HydrophobicContact CG-CD1 4.06Å; K490-I494 WeakPolarHBondContact O-CG1 3.3Å; K490-I494 PolarHBondContact O-N 2.85Å; I494-H496 VanDerWaalsContact C-N 3.25Å; I494-H496 PolarHBondContact O-N 3.19Å; I494-E497 WeakPolarHBondContact CA-OE2 3.44Å; I494-E497 PolarHBondContact O-N 3.31Å; I494-R498 PolarHBondContact O-N 3.11Å
495	I	87.9	Confident	87.3	Confident	49 Å²	49	64.6 Å²	64.6	25%	0.251	34%	0.342	S	S	.	.	H	α-helix	trans	-69.5	-24.6	177.3	-70.3	169	0	0	0	112.1	S491 T492 L493 R517	S491-I495 WeakPolarHBondContact O-CB 3.17Å; S491-I495 VanDerWaalsContact O-CD1 3.3Å; S491-I495 WeakPolarHBondContact O-CD1 3.49Å; S491-I495 WeakPolarHBondContact O-CG1 3.44Å; S491-I495 PolarHBondContact O-N 3.02Å; T492-I495 PolarHBondContact O-N 2.84Å; L493-I495 PolarHBondContact O-N 3.46Å; I495-R517 HydrophobicContact CG2-CG 3.92Å; I495-R517 VanDerWaalsContact CG2-CZ 3.43Å; I495-R517 VanDerWaalsContact CG2-NH2 3.33Å
496	H	88.8	Confident	87.6	Confident	26 Å²	26	60.8 Å²	60.8	12%	0.12	33%	0.328	C	S	.	.	H	α-helix	trans	-82.2	-37.6	172.9	171.6	51.8	0	0	0	112.8	C483 F487 T492 L493 I494 R498 T499 H500	C483-H496 PolarHBondContact SG-NE2 3.21Å; F487-H496 HydrophobicContact CE1-CB 4.11Å; F487-H496 HydrophobicContact CE2-CB 4.11Å; F487-H496 AromaticContact CE2-CD2 3.3Å; F487-H496 WeakPolarHBondContact CE2-CD2 3.46Å; F487-H496 AromaticContact CE2-CG 3.89Å; F487-H496 HydrophobicContact CZ-CB 3.6Å; F487-H496 AromaticContact CZ-CD2 3.22Å; F487-H496 WeakPolarHBondContact CZ-CD2 3.33Å; F487-H496 AromaticContact CZ-CG 3.39Å; F487-H496 AromaticContact CZ-NE2 3.94Å; T492-H496 WeakPolarHBondContact O-CB 3.35Å; T492-H496 PolarHBondContact O-N 2.73Å; L493-H496 CarbonylContact O-C 3.55Å; L493-H496 WeakPolarHBondContact O-CA 3.47Å; L493-H496 WeakPolarHBondContact O-CB 3.46Å; L493-H496 PolarHBondContact O-N 3.43Å; I494-H496 VanDerWaalsContact C-N 3.25Å; I494-H496 PolarHBondContact O-N 3.19Å; H496-R498 PolarHBondContact O-N 2.79Å; H496-T499 PolarHBondContact CE1-OG1 3.13Å; H496-T499 PolarHBondContact ND1-OG1 3.05Å; H496-T499 VanDerWaalsContact ND1-OG1 3.11Å; H496-T499 WeakPolarHBondContact O-CA 3.36Å; H496-T499 WeakPolarHBondContact O-CB 3.48Å; H496-T499 PolarHBondContact O-N 2.93Å; H496-T499 PolarHBondContact O-OG1 3.47Å; H496-H500 AromaticContact CD2-NE2 3.91Å; H496-H500 AromaticContact CE1-CE1 3.61Å; H496-H500 AromaticContact CE1-NE2 3.33Å; H496-H500 PolarHBondContact CE1-NE2 2.73Å; H496-H500 VanDerWaalsContact CE1-NE2 3.33Å; H496-H500 AromaticContact NE2-CE1 3.78Å; H496-H500 AromaticContact NE2-NE2 3.12Å; H496-H500 PolarHBondContact NE2-NE2 3.42Å; H496-H500 VanDerWaalsContact NE2-NE2 3.12Å
497	E	89.2	Confident	87.9	Confident	65 Å²	65	64 Å²	64	30%	0.304	34%	0.344	S	S	.	.	H	α-helix	trans	-57.6	-33.8	176.8	-70.6	166.4	153.6	0	0	111.1	L493 I494 T499 H500 S501	L493-E497 HydrophobicContact CD1-CG 3.88Å; L493-E497 HydrophobicContact CG-CG 4.29Å; L493-E497 PolarHBondContact O-N 3.45Å; I494-E497 WeakPolarHBondContact CA-OE2 3.44Å; I494-E497 PolarHBondContact O-N 3.31Å; E497-T499 PolarHBondContact O-N 3.03Å; E497-H500 PolarHBondContact O-N 3.49Å; E497-S501 PolarHBondContact O-N 3.34Å; E497-S501 VanDerWaalsContact O-N 3.1Å
498	R	91	Very high	88.3	Confident	49 Å²	49	62.7 Å²	62.7	19%	0.185	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-15.5	168.9	-64.9	179.4	-176.6	166.8	4	115.7	I494 H496 G502 E503 S516	I494-R498 PolarHBondContact O-N 3.11Å; H496-R498 PolarHBondContact O-N 2.79Å; R498-G502 PolarHBondContact O-N 3.3Å; R498-E503 HydrophobicContact CB-CB 4.3Å; R498-E503 HydrophobicContact CG-CB 4.04Å; R498-S516 PolarHBondContact NH1-O 2.65Å
499	T	87.9	Confident	88.8	Confident	85 Å²	85	64.8 Å²	64.8	52%	0.521	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.5	173.3	66.9	0	0	0	0	112.8	H496 E497	H496-T499 PolarHBondContact CE1-OG1 3.13Å; H496-T499 PolarHBondContact ND1-OG1 3.05Å; H496-T499 VanDerWaalsContact ND1-OG1 3.11Å; H496-T499 WeakPolarHBondContact O-CA 3.36Å; H496-T499 WeakPolarHBondContact O-CB 3.48Å; H496-T499 PolarHBondContact O-N 2.93Å; H496-T499 PolarHBondContact O-OG1 3.47Å; E497-T499 PolarHBondContact O-N 3.03Å
500	H	88.6	Confident	89.1	Confident	73 Å²	73	69.4 Å²	69.4	34%	0.338	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-50.4	176.3	-54.1	-50.8	0	0	0	110.7	C480 E482 C483 H496 E497 G502	C480-H500 PolarHBondContact SG-NE2 3.01Å; C480-H500 VanDerWaalsContact SG-NE2 3.43Å; E482-H500 WeakPolarHBondContact OE2-CB 3.34Å; E482-H500 IonicContact OE2-CD2 3.32Å; E482-H500 PolarHBondContact OE2-CD2 3.12Å; E482-H500 IonicContact OE2-CG 2.64Å; C483-H500 PolarHBondContact SG-NE2 3.31Å; H496-H500 AromaticContact CD2-NE2 3.91Å; H496-H500 AromaticContact CE1-CE1 3.61Å; H496-H500 AromaticContact CE1-NE2 3.33Å; H496-H500 PolarHBondContact CE1-NE2 2.73Å; H496-H500 VanDerWaalsContact CE1-NE2 3.33Å; H496-H500 AromaticContact NE2-CE1 3.78Å; H496-H500 AromaticContact NE2-NE2 3.12Å; H496-H500 PolarHBondContact NE2-NE2 3.42Å; H496-H500 VanDerWaalsContact NE2-NE2 3.12Å; E497-H500 PolarHBondContact O-N 3.49Å; H500-G502 PolarHBondContact O-N 3.44Å; H500-G502 VanDerWaalsContact O-N 3.17Å
501	S	88.3	Confident	89.4	Confident	68 Å²	68	66.3 Å²	66.3	48%	0.476	38%	0.38	S	S	.	.	S	Bend	trans	-67.9	-13.8	176	69.1	0	0	0	0	114.1	E497 E503	E497-S501 PolarHBondContact O-N 3.34Å; E497-S501 VanDerWaalsContact O-N 3.1Å; S501-E503 PolarHBondContact O-N 2.81Å; S501-E503 WeakPolarHBondContact OG-CG 3.45Å; S501-E503 PolarHBondContact OG-N 3.3Å
502	G	86.9	Confident	89.5	Confident	40 Å²	40	66.3 Å²	66.3	41%	0.412	39%	0.389	S	S	.	.			trans	71.6	2	-177.2	0	0	0	0	0	114.7	R498 H500 K504	R498-G502 PolarHBondContact O-N 3.3Å; H500-G502 PolarHBondContact O-N 3.44Å; H500-G502 VanDerWaalsContact O-N 3.17Å; G502-K504 WeakPolarHBondContact O-CG 3.48Å; G502-K504 PolarHBondContact O-N 2.91Å
503	E	89.1	Confident	89.6	Confident	107 Å²	107	70.9 Å²	70.9	50%	0.5	40%	0.4	S	S	.	.			trans	-52.5	128	-178.2	-86.3	-178.5	-159.5	0	0	113	R498 S501	R498-E503 HydrophobicContact CB-CB 4.3Å; R498-E503 HydrophobicContact CG-CB 4.04Å; S501-E503 PolarHBondContact O-N 2.81Å; S501-E503 WeakPolarHBondContact OG-CG 3.45Å; S501-E503 PolarHBondContact OG-N 3.3Å
504	K	91.1	Very high	89.6	Confident	124 Å²	124	71 Å²	71	54%	0.539	41%	0.405	S	S	.	.			trans	-129.4	71.3	-179.5	-76.1	155.7	-174.5	160.6	0	111.1	G502 Y506 F515	G502-K504 WeakPolarHBondContact O-CG 3.48Å; G502-K504 PolarHBondContact O-N 2.91Å; K504-Y506 PolarHBondContact O-N 3.47Å; K504-F515 CarbonylContact C-O 3.35Å; K504-F515 VanDerWaalsContact C-O 3.31Å; K504-F515 WeakPolarHBondContact CA-O 3.34Å
505	P	90.8	Very high	89.7	Confident	71 Å²	71	69.1 Å²	69.1	46%	0.461	39%	0.394	S	S	.	.			trans	-64.9	-10.7	-173.9	-21.3	34.4	0	0	0	114.9
506	Y	92.6	Very high	89.8	Confident	78 Å²	78	68 Å²	68	31%	0.306	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	93.7	-177.1	-53	-73.3	0	0	0	109.8	K504 F515 K518	K504-Y506 PolarHBondContact O-N 3.47Å; Y506-F515 WeakPolarHBondContact CD2-O 3.31Å; Y506-F515 PolarHBondContact N-O 3.38Å; Y506-F515 VanDerWaalsContact N-O 3.13Å; Y506-F515 PolarHBondContact O-N 3.3Å; Y506-K518 HydrophobicContact CD1-CB 3.82Å; Y506-K518 HydrophobicContact CD1-CG 4.27Å; Y506-K518 HydrophobicContact CD2-CB 4.4Å; Y506-K518 HydrophobicContact CE1-CB 3.79Å; Y506-K518 HydrophobicContact CE1-CD 4.5Å; Y506-K518 HydrophobicContact CE1-CG 4.43Å; Y506-K518 HydrophobicContact CE2-CB 4.35Å; Y506-K518 HydrophobicContact CG-CB 4.13Å
507	V	91.8	Very high	89.8	Confident	86 Å²	86	72 Å²	72	52%	0.521	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.1	179.7	-176.8	0	0	0	0	110.7	G512	V507-G512 WeakPolarHBondContact CG1-O 3.4Å
508	C	93.3	Very high	89.7	Confident	0 Å²	0	75 Å²	75	0%	0	42%	0.417	C	S	.	.			trans	-82.6	118.7	171.4	-177.7	0	0	0	0	110.4	E510 C511 G512 R513 F515 L521	C508-E510 PolarHBondContact O-N 3.41Å; C508-C511 PolarHBondContact O-N 2.8Å; C508-C511 VanDerWaalsContact SG-SG 3.65Å; C508-G512 VanDerWaalsContact O-CA 3.31Å; C508-G512 WeakPolarHBondContact O-CA 3.45Å; C508-G512 PolarHBondContact O-N 3.08Å; C508-R513 WeakPolarHBondContact CB-O 3.29Å; C508-R513 PolarHBondContact N-O 2.86Å; C508-F515 HydrophobicContact CB-CE2 4.41Å; C508-L521 HydrophobicContact CB-CD1 3.54Å
509	G	91	Very high	89.5	Confident	82 Å²	82	76.2 Å²	76.2	85%	0.845	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-27.1	179.3	0	0	0	0	0	114.4
510	E	88.9	Confident	89.6	Confident	125 Å²	125	76 Å²	76	58%	0.584	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-20.5	-175.8	-64.4	161	137.8	0	0	113.6	C508 H528	C508-E510 PolarHBondContact O-N 3.41Å; E510-H528 IonicContact OE2-CD2 3.69Å; E510-H528 PolarHBondContact OE2-CD2 3.13Å; E510-H528 IonicContact OE2-CG 3.92Å
511	C	89.9	Confident	89.7	Confident	62 Å²	62	73.5 Å²	73.5	42%	0.419	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.1	10.3	-175.2	72.2	0	0	0	0	115.1	C508 R513 H524 H528	C508-C511 PolarHBondContact O-N 2.8Å; C508-C511 VanDerWaalsContact SG-SG 3.65Å; C511-R513 PolarHBondContact O-N 2.97Å; C511-R513 VanDerWaalsContact SG-CB 3.51Å; C511-H524 PolarHBondContact SG-NE2 2.99Å; C511-H528 PolarHBondContact SG-NE2 3.47Å; C511-H528 VanDerWaalsContact SG-NE2 3.39Å
512	G	87.1	Confident	89.8	Confident	56 Å²	56	74.4 Å²	74.4	58%	0.577	42%	0.416	S	S	*	.			trans	64.9	0.1	-178.7	0	0	0	0	0	115.7	V507 C508 G514	V507-G512 WeakPolarHBondContact CG1-O 3.4Å; C508-G512 VanDerWaalsContact O-CA 3.31Å; C508-G512 WeakPolarHBondContact O-CA 3.45Å; C508-G512 PolarHBondContact O-N 3.08Å; G512-G514 PolarHBondContact O-N 3.44Å
513	R	89.6	Confident	89.8	Confident	156 Å²	156	74.5 Å²	74.5	59%	0.589	41%	0.409	S	S	*	.			trans	-73.8	120.7	-172.1	-169.4	171.3	-177.7	166	5	111.9	C508 C511 F515	C508-R513 WeakPolarHBondContact CB-O 3.29Å; C508-R513 PolarHBondContact N-O 2.86Å; C511-R513 PolarHBondContact O-N 2.97Å; C511-R513 VanDerWaalsContact SG-CB 3.51Å; R513-F515 HydrophobicContact CB-CE2 4.02Å; R513-F515 HydrophobicContact CB-CZ 4.36Å; R513-F515 HydrophobicContact CG-CE2 3.85Å; R513-F515 HydrophobicContact CG-CZ 3.82Å; R513-F515 VanDerWaalsContact O-CD2 3.3Å; R513-F515 WeakPolarHBondContact O-CD2 3.4Å; R513-F515 WeakPolarHBondContact O-CE2 3.28Å
514	G	90.3	Very high	89.8	Confident	20 Å²	20	70.5 Å²	70.5	21%	0.206	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	143.9	176.7	0	0	0	0	0	115	G512	G512-G514 PolarHBondContact O-N 3.44Å
515	F	90.7	Very high	89.6	Confident	29 Å²	29	67.9 Å²	67.9	13%	0.127	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.8	176.2	-61.1	-91.6	0	0	0	111.9	K504 Y506 C508 R513 R517 L520 L521 H524	K504-F515 CarbonylContact C-O 3.35Å; K504-F515 VanDerWaalsContact C-O 3.31Å; K504-F515 WeakPolarHBondContact CA-O 3.34Å; Y506-F515 WeakPolarHBondContact CD2-O 3.31Å; Y506-F515 PolarHBondContact N-O 3.38Å; Y506-F515 VanDerWaalsContact N-O 3.13Å; Y506-F515 PolarHBondContact O-N 3.3Å; C508-F515 HydrophobicContact CB-CE2 4.41Å; R513-F515 HydrophobicContact CB-CE2 4.02Å; R513-F515 HydrophobicContact CB-CZ 4.36Å; R513-F515 HydrophobicContact CG-CE2 3.85Å; R513-F515 HydrophobicContact CG-CZ 3.82Å; R513-F515 VanDerWaalsContact O-CD2 3.3Å; R513-F515 WeakPolarHBondContact O-CD2 3.4Å; R513-F515 WeakPolarHBondContact O-CE2 3.28Å; F515-R517 VanDerWaalsContact C-N 3.32Å; F515-R517 PolarHBondContact O-N 2.87Å; F515-L520 HydrophobicContact CB-CB 4.24Å; F515-L520 HydrophobicContact CD1-CB 3.76Å; F515-L520 HydrophobicContact CG-CB 4.29Å; F515-L521 HydrophobicContact CB-CB 4.33Å; F515-L521 HydrophobicContact CD2-CB 4Å; F515-L521 HydrophobicContact CD2-CD1 3.96Å; F515-L521 HydrophobicContact CE2-CD1 4.16Å; F515-L521 HydrophobicContact CG-CB 4.28Å; F515-H524 HydrophobicContact CE1-CB 3.96Å; F515-H524 HydrophobicContact CE2-CB 4Å; F515-H524 AromaticContact CE2-CD2 3.24Å; F515-H524 WeakPolarHBondContact CE2-CD2 3.29Å; F515-H524 AromaticContact CE2-CG 3.8Å; F515-H524 HydrophobicContact CZ-CB 3.47Å; F515-H524 VanDerWaalsContact CZ-CB 3.47Å; F515-H524 AromaticContact CZ-CD2 3.23Å; F515-H524 WeakPolarHBondContact CZ-CD2 3.23Å; F515-H524 AromaticContact CZ-CG 3.33Å; F515-H524 AromaticContact CZ-NE2 3.97Å
516	S	89	Confident	89.5	Confident	25 Å²	25	67.5 Å²	67.5	18%	0.175	37%	0.369	C	S	.	.	S	Bend	trans	-77.9	-12.8	178	57.6	0	0	0	0	114.2	R498	R498-S516 PolarHBondContact NH1-O 2.65Å
517	R	88.6	Confident	89.2	Confident	111 Å²	111	68.1 Å²	68.1	42%	0.419	38%	0.381	S	S	.	.	S	Bend	trans	-138.2	135	-179.7	-55	179.3	-172.6	-165	-4.7	111.4	I495 F515 S519 L520 L521	I495-R517 HydrophobicContact CG2-CG 3.92Å; I495-R517 VanDerWaalsContact CG2-CZ 3.43Å; I495-R517 VanDerWaalsContact CG2-NH2 3.33Å; F515-R517 VanDerWaalsContact C-N 3.32Å; F515-R517 PolarHBondContact O-N 2.87Å; R517-S519 PolarHBondContact O-N 2.88Å; R517-L520 HydrophobicContact CB-CD1 4.12Å; R517-L520 HydrophobicContact CB-CG 4.14Å; R517-L520 HydrophobicContact CG-CD1 4.31Å; R517-L520 WeakPolarHBondContact O-CB 3.14Å; R517-L520 PolarHBondContact O-N 3.33Å; R517-L521 PolarHBondContact O-N 3.5Å
518	K	87.8	Confident	88.9	Confident	129 Å²	129	67.7 Å²	67.7	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-56.8	-34.5	176.6	-171.6	170.7	-177.4	170.6	0	113.4	Y506 L520 L521 L522	Y506-K518 HydrophobicContact CD1-CB 3.82Å; Y506-K518 HydrophobicContact CD1-CG 4.27Å; Y506-K518 HydrophobicContact CD2-CB 4.4Å; Y506-K518 HydrophobicContact CE1-CB 3.79Å; Y506-K518 HydrophobicContact CE1-CD 4.5Å; Y506-K518 HydrophobicContact CE1-CG 4.43Å; Y506-K518 HydrophobicContact CE2-CB 4.35Å; Y506-K518 HydrophobicContact CG-CB 4.13Å; K518-L520 VanDerWaalsContact C-N 3.3Å; K518-L520 PolarHBondContact O-N 3.32Å; K518-L521 PolarHBondContact O-N 2.83Å; K518-L522 HydrophobicContact CG-CD1 4.3Å; K518-L522 HydrophobicContact CG-CG 4.43Å; K518-L522 WeakPolarHBondContact O-CG 3.27Å; K518-L522 PolarHBondContact O-N 3.41Å
519	S	86.7	Confident	88.5	Confident	73 Å²	73	70.7 Å²	70.7	51%	0.51	39%	0.394	S	S	.	.	H	α-helix	trans	-64.4	-32.2	176.8	52.5	0	0	0	0	113.4	R517 V523	R517-S519 PolarHBondContact O-N 2.88Å; S519-V523 WeakPolarHBondContact O-CB 3.21Å; S519-V523 VanDerWaalsContact O-CG2 3.28Å; S519-V523 WeakPolarHBondContact O-CG2 3.38Å; S519-V523 PolarHBondContact O-N 3.34Å; S519-V523 VanDerWaalsContact O-N 3.13Å
520	L	89.4	Confident	88.1	Confident	82 Å²	82	68.7 Å²	68.7	43%	0.429	37%	0.374	S	S	.	.	H	α-helix	trans	-73.3	-39.3	175.4	-63.4	174.4	0	0	0	111	F515 R517 K518 V523 H524	F515-L520 HydrophobicContact CB-CB 4.24Å; F515-L520 HydrophobicContact CD1-CB 3.76Å; F515-L520 HydrophobicContact CG-CB 4.29Å; R517-L520 HydrophobicContact CB-CD1 4.12Å; R517-L520 HydrophobicContact CB-CG 4.14Å; R517-L520 HydrophobicContact CG-CD1 4.31Å; R517-L520 WeakPolarHBondContact O-CB 3.14Å; R517-L520 PolarHBondContact O-N 3.33Å; K518-L520 VanDerWaalsContact C-N 3.3Å; K518-L520 PolarHBondContact O-N 3.32Å; L520-V523 PolarHBondContact O-N 2.89Å; L520-H524 WeakPolarHBondContact O-CB 3.35Å; L520-H524 PolarHBondContact O-N 3.22Å
521	L	91.9	Very high	87.8	Confident	19 Å²	19	67.4 Å²	67.4	10%	0.099	37%	0.367	C	S	.	.	H	α-helix	trans	-59.3	-50.3	171.7	172.7	60.4	0	0	0	111.4	C508 F515 R517 K518 V523 H524 Q525	C508-L521 HydrophobicContact CB-CD1 3.54Å; F515-L521 HydrophobicContact CB-CB 4.33Å; F515-L521 HydrophobicContact CD2-CB 4Å; F515-L521 HydrophobicContact CD2-CD1 3.96Å; F515-L521 HydrophobicContact CE2-CD1 4.16Å; F515-L521 HydrophobicContact CG-CB 4.28Å; R517-L521 PolarHBondContact O-N 3.5Å; K518-L521 PolarHBondContact O-N 2.83Å; L521-V523 VanDerWaalsContact C-N 3.27Å; L521-V523 PolarHBondContact O-N 3.13Å; L521-H524 CarbonylContact O-C 3.26Å; L521-H524 WeakPolarHBondContact O-CA 3.43Å; L521-H524 WeakPolarHBondContact O-CB 3.41Å; L521-H524 PolarHBondContact O-N 3.04Å; L521-Q525 HydrophobicContact CD1-CG 4.08Å; L521-Q525 WeakPolarHBondContact O-CG 3.13Å; L521-Q525 PolarHBondContact O-N 3.05Å
522	L	88.4	Confident	87.6	Confident	87 Å²	87	70.7 Å²	70.7	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-61.1	-34.4	178.9	-70.1	171.1	0	0	0	113.1	K518	K518-L522 HydrophobicContact CG-CD1 4.3Å; K518-L522 HydrophobicContact CG-CG 4.43Å; K518-L522 WeakPolarHBondContact O-CG 3.27Å; K518-L522 PolarHBondContact O-N 3.41Å
523	V	87.4	Confident	87.4	Confident	42 Å²	42	73.6 Å²	73.6	26%	0.255	37%	0.373	S	S	.	.	H	α-helix	trans	-74.4	-32.1	174.7	167.7	0	0	0	0	111.5	S519 L520 L521 Q545	S519-V523 WeakPolarHBondContact O-CB 3.21Å; S519-V523 VanDerWaalsContact O-CG2 3.28Å; S519-V523 WeakPolarHBondContact O-CG2 3.38Å; S519-V523 PolarHBondContact O-N 3.34Å; S519-V523 VanDerWaalsContact O-N 3.13Å; L520-V523 PolarHBondContact O-N 2.89Å; L521-V523 VanDerWaalsContact C-N 3.27Å; L521-V523 PolarHBondContact O-N 3.13Å; V523-Q545 HydrophobicContact CG1-CG 3.99Å
524	H	88.8	Confident	87.4	Confident	24 Å²	24	70 Å²	70	11%	0.111	36%	0.36	C	S	.	.	H	α-helix	trans	-71.3	-40.1	174.3	170.8	47.2	0	0	0	112.7	C511 F515 L520 L521 R526 T527 H528	C511-H524 PolarHBondContact SG-NE2 2.99Å; F515-H524 HydrophobicContact CE1-CB 3.96Å; F515-H524 HydrophobicContact CE2-CB 4Å; F515-H524 AromaticContact CE2-CD2 3.24Å; F515-H524 WeakPolarHBondContact CE2-CD2 3.29Å; F515-H524 AromaticContact CE2-CG 3.8Å; F515-H524 HydrophobicContact CZ-CB 3.47Å; F515-H524 VanDerWaalsContact CZ-CB 3.47Å; F515-H524 AromaticContact CZ-CD2 3.23Å; F515-H524 WeakPolarHBondContact CZ-CD2 3.23Å; F515-H524 AromaticContact CZ-CG 3.33Å; F515-H524 AromaticContact CZ-NE2 3.97Å; L520-H524 WeakPolarHBondContact O-CB 3.35Å; L520-H524 PolarHBondContact O-N 3.22Å; L521-H524 CarbonylContact O-C 3.26Å; L521-H524 WeakPolarHBondContact O-CA 3.43Å; L521-H524 WeakPolarHBondContact O-CB 3.41Å; L521-H524 PolarHBondContact O-N 3.04Å; H524-R526 PolarHBondContact O-N 3.1Å; H524-T527 PolarHBondContact CE1-OG1 3.21Å; H524-T527 PolarHBondContact ND1-OG1 3.48Å; H524-T527 VanDerWaalsContact ND1-OG1 3.14Å; H524-T527 WeakPolarHBondContact O-CB 3.41Å; H524-T527 PolarHBondContact O-N 3.17Å; H524-T527 PolarHBondContact O-OG1 3.35Å; H524-H528 AromaticContact CD2-NE2 3.99Å; H524-H528 AromaticContact CE1-CE1 3.62Å; H524-H528 AromaticContact CE1-NE2 3.28Å; H524-H528 PolarHBondContact CE1-NE2 3.18Å; H524-H528 VanDerWaalsContact CE1-NE2 3.28Å; H524-H528 AromaticContact NE2-CE1 3.85Å; H524-H528 AromaticContact NE2-NE2 3.14Å; H524-H528 PolarHBondContact NE2-NE2 2.91Å; H524-H528 VanDerWaalsContact NE2-NE2 3.14Å
525	Q	88.3	Confident	87.4	Confident	68 Å²	68	72.9 Å²	72.9	32%	0.318	37%	0.373	S	S	.	.	H	α-helix	trans	-56.5	-28.8	179	-73.6	173.2	-62	0	0	112.6	L521 T527 H528 S529	L521-Q525 HydrophobicContact CD1-CG 4.08Å; L521-Q525 WeakPolarHBondContact O-CG 3.13Å; L521-Q525 PolarHBondContact O-N 3.05Å; Q525-T527 PolarHBondContact O-N 2.95Å; Q525-T527 VanDerWaalsContact O-N 3.14Å; Q525-H528 PolarHBondContact O-N 3.45Å; Q525-S529 PolarHBondContact O-N 3.32Å; Q525-S529 VanDerWaalsContact O-N 3.07Å; Q525-S529 PolarHBondContact O-OG 2.69Å
526	R	88.8	Confident	87.4	Confident	64 Å²	64	71.5 Å²	71.5	24%	0.242	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.7	171.5	-58.8	-180	-169.4	157	6.9	115.1	H524 S529 G530 S544	H524-R526 PolarHBondContact O-N 3.1Å; R526-S529 WeakPolarHBondContact CA-OG 3.35Å; R526-G530 PolarHBondContact O-N 3.39Å; R526-S544 PolarHBondContact NH1-O 3.03Å
527	T	85.7	Confident	87.4	Confident	90 Å²	90	81.6 Å²	81.6	55%	0.552	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-23	171.8	67	0	0	0	0	112.2	H524 Q525	H524-T527 PolarHBondContact CE1-OG1 3.21Å; H524-T527 PolarHBondContact ND1-OG1 3.48Å; H524-T527 VanDerWaalsContact ND1-OG1 3.14Å; H524-T527 WeakPolarHBondContact O-CB 3.41Å; H524-T527 PolarHBondContact O-N 3.17Å; H524-T527 PolarHBondContact O-OG1 3.35Å; Q525-T527 PolarHBondContact O-N 2.95Å; Q525-T527 VanDerWaalsContact O-N 3.14Å
528	H	85.8	Confident	87.5	Confident	78 Å²	78	82.1 Å²	82.1	36%	0.361	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-48.2	176.9	-55.2	-49.6	0	0	0	110.7	E510 C511 H524 Q525 G530	E510-H528 IonicContact OE2-CD2 3.69Å; E510-H528 PolarHBondContact OE2-CD2 3.13Å; E510-H528 IonicContact OE2-CG 3.92Å; C511-H528 PolarHBondContact SG-NE2 3.47Å; C511-H528 VanDerWaalsContact SG-NE2 3.39Å; H524-H528 AromaticContact CD2-NE2 3.99Å; H524-H528 AromaticContact CE1-CE1 3.62Å; H524-H528 AromaticContact CE1-NE2 3.28Å; H524-H528 PolarHBondContact CE1-NE2 3.18Å; H524-H528 VanDerWaalsContact CE1-NE2 3.28Å; H524-H528 AromaticContact NE2-CE1 3.85Å; H524-H528 AromaticContact NE2-NE2 3.14Å; H524-H528 PolarHBondContact NE2-NE2 2.91Å; H524-H528 VanDerWaalsContact NE2-NE2 3.14Å; Q525-H528 PolarHBondContact O-N 3.45Å; H528-G530 PolarHBondContact O-N 3.21Å
529	S	84.5	Confident	87.6	Confident	62 Å²	62	78.5 Å²	78.5	43%	0.434	40%	0.399	S	S	.	.	S	Bend	trans	-70	-15.2	175.6	68	0	0	0	0	114.2	Q525 R526 E531	Q525-S529 PolarHBondContact O-N 3.32Å; Q525-S529 VanDerWaalsContact O-N 3.07Å; Q525-S529 PolarHBondContact O-OG 2.69Å; R526-S529 WeakPolarHBondContact CA-OG 3.35Å; S529-E531 PolarHBondContact O-N 3.31Å; S529-E531 VanDerWaalsContact O-N 3.13Å; S529-E531 VanDerWaalsContact OG-CG 3.26Å; S529-E531 WeakPolarHBondContact OG-CG 3.23Å; S529-E531 PolarHBondContact OG-OE2 2.76Å; S529-E531 VanDerWaalsContact OG-OE2 3.12Å
530	G	82.1	Confident	87.7	Confident	41 Å²	41	85.2 Å²	85.2	42%	0.423	41%	0.414	S	S	.	.			trans	68.8	2.9	-176.9	0	0	0	0	0	115.2	R526 H528 K532	R526-G530 PolarHBondContact O-N 3.39Å; H528-G530 PolarHBondContact O-N 3.21Å; G530-K532 WeakPolarHBondContact O-CG 3.41Å; G530-K532 PolarHBondContact O-N 2.92Å
531	E	82.9	Confident	87.7	Confident	97 Å²	97	89 Å²	89	45%	0.453	42%	0.422	S	S	.	.			trans	-61.8	113.6	-170.8	-73.1	171.1	152.3	0	0	113.9	S529 H533	S529-E531 PolarHBondContact O-N 3.31Å; S529-E531 VanDerWaalsContact O-N 3.13Å; S529-E531 VanDerWaalsContact OG-CG 3.26Å; S529-E531 WeakPolarHBondContact OG-CG 3.23Å; S529-E531 PolarHBondContact OG-OE2 2.76Å; S529-E531 VanDerWaalsContact OG-OE2 3.12Å; E531-H533 IonicContact OE2-CE1 3.08Å
532	K	84.8	Confident	87.5	Confident	132 Å²	132	89 Å²	89	57%	0.574	43%	0.427	S	S	*	.			trans	-109.7	66.7	-176.6	-75.8	159.3	-179.9	167.9	0	112.4	G530 Y534 G542 F543	G530-K532 WeakPolarHBondContact O-CG 3.41Å; G530-K532 PolarHBondContact O-N 2.92Å; K532-Y534 PolarHBondContact O-N 3Å; K532-G542 WeakPolarHBondContact CD-O 3.17Å; K532-F543 CarbonylContact C-O 3.52Å; K532-F543 WeakPolarHBondContact CA-O 3.37Å
533	H	84.8	Confident	87.5	Confident	117 Å²	117	86.5 Å²	86.5	54%	0.542	41%	0.412	S	S	.	.			trans	-55.4	-21.7	179.2	-63.1	85.8	0	0	0	115.5	E531 F543	E531-H533 IonicContact OE2-CE1 3.08Å; H533-F543 PolarHBondContact N-O 3.1Å
534	Y	89	Confident	87.4	Confident	79 Å²	79	85.9 Å²	85.9	31%	0.31	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	95.9	-175.6	-59.7	-80.6	0	0	0	110.2	K532 F543 Q545 K546	K532-Y534 PolarHBondContact O-N 3Å; Y534-F543 WeakPolarHBondContact CB-O 3.49Å; Y534-F543 PolarHBondContact N-O 2.98Å; Y534-F543 PolarHBondContact O-N 2.79Å; Y534-Q545 VanDerWaalsContact CD2-C 3.46Å; Y534-K546 HydrophobicContact CD1-CB 3.78Å; Y534-K546 HydrophobicContact CD1-CG 4.03Å; Y534-K546 HydrophobicContact CE1-CB 3.55Å; Y534-K546 HydrophobicContact CE1-CD 4.27Å; Y534-K546 HydrophobicContact CE1-CG 3.96Å; Y534-K546 HydrophobicContact CE2-CB 4.45Å; Y534-K546 HydrophobicContact CG-CB 4.31Å
535	V	89.6	Confident	87.3	Confident	81 Å²	81	87.9 Å²	87.9	49%	0.491	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	131.9	-177.7	-176.6	0	0	0	0	110.6
536	C	92.1	Very high	87.3	Confident	1 Å²	1	90.8 Å²	90.8	1%	0.007	43%	0.431	C	S	.	.			trans	-70.3	128.5	170.2	-174.2	0	0	0	0	110.2	E538 R540 R541 L549	C536-E538 VanDerWaalsContact C-N 3.34Å; C536-E538 PolarHBondContact O-N 3.14Å; C536-R540 WeakPolarHBondContact O-CA 3.21Å; C536-R540 PolarHBondContact O-N 2.92Å; C536-R541 PolarHBondContact N-O 3.25Å; C536-L549 HydrophobicContact CB-CD1 3.67Å
537	R	88.9	Confident	87.1	Confident	236 Å²	236	91 Å²	91	89%	0.891	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-33.7	-178.6	-71.1	-173.3	172.9	-167.4	-3.4	112.7
538	E	89.4	Confident	87.3	Confident	123 Å²	123	88.5 Å²	88.5	58%	0.575	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-52	-174.4	-66.1	146.7	-113.1	0	0	112.4	C536 H556	C536-E538 VanDerWaalsContact C-N 3.34Å; C536-E538 PolarHBondContact O-N 3.14Å; E538-H556 WeakPolarHBondContact OE2-CB 2.95Å; E538-H556 IonicContact OE2-CD2 3.64Å; E538-H556 PolarHBondContact OE2-CD2 3.45Å; E538-H556 IonicContact OE2-CG 2.67Å
539	C	91.1	Very high	87.4	Confident	53 Å²	53	85.7 Å²	85.7	36%	0.358	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	6.7	-176.7	71.4	0	0	0	0	114.7	R541 H552 H556	C539-R541 PolarHBondContact O-N 3.08Å; C539-R541 WeakPolarHBondContact SG-CB 3.46Å; C539-H552 PolarHBondContact SG-NE2 3.29Å; C539-H556 VanDerWaalsContact CB-NE2 3.33Å; C539-H556 WeakPolarHBondContact CB-NE2 3.45Å; C539-H556 PolarHBondContact SG-NE2 2.98Å; C539-H556 VanDerWaalsContact SG-NE2 3.44Å
540	R	88.4	Confident	87.5	Confident	214 Å²	214	86.3 Å²	86.3	81%	0.808	41%	0.411	S	S	*	.			trans	54.7	11.1	-176.3	-59	-171.9	-179.4	-169	1.3	115.9	C536 G542	C536-R540 WeakPolarHBondContact O-CA 3.21Å; C536-R540 PolarHBondContact O-N 2.92Å; R540-G542 PolarHBondContact O-N 2.92Å
541	R	89.4	Confident	87.7	Confident	161 Å²	161	89.4 Å²	89.4	61%	0.608	41%	0.41	S	S	*	.			trans	-69.7	124.1	179.6	-169.8	170.5	-177	149.4	3.4	111.1	C536 C539 F543	C536-R541 PolarHBondContact N-O 3.25Å; C539-R541 PolarHBondContact O-N 3.08Å; C539-R541 WeakPolarHBondContact SG-CB 3.46Å; R541-F543 HydrophobicContact CB-CE2 3.98Å; R541-F543 HydrophobicContact CB-CZ 4.32Å; R541-F543 HydrophobicContact CG-CE2 3.83Å; R541-F543 HydrophobicContact CG-CZ 3.79Å; R541-F543 WeakPolarHBondContact O-CD2 3.36Å; R541-F543 VanDerWaalsContact O-CE2 3.23Å; R541-F543 WeakPolarHBondContact O-CE2 3.35Å
542	G	87.8	Confident	87.9	Confident	20 Å²	20	85.9 Å²	85.9	21%	0.206	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	141.2	179.4	0	0	0	0	0	114.4	K532 R540	K532-G542 WeakPolarHBondContact CD-O 3.17Å; R540-G542 PolarHBondContact O-N 2.92Å
543	F	87.7	Confident	88.1	Confident	33 Å²	33	82.9 Å²	82.9	15%	0.145	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	146.9	178.9	-60.3	-92.2	0	0	0	111.6	K532 H533 Y534 R541 Q545 N548 L549 H552	K532-F543 CarbonylContact C-O 3.52Å; K532-F543 WeakPolarHBondContact CA-O 3.37Å; H533-F543 PolarHBondContact N-O 3.1Å; Y534-F543 WeakPolarHBondContact CB-O 3.49Å; Y534-F543 PolarHBondContact N-O 2.98Å; Y534-F543 PolarHBondContact O-N 2.79Å; R541-F543 HydrophobicContact CB-CE2 3.98Å; R541-F543 HydrophobicContact CB-CZ 4.32Å; R541-F543 HydrophobicContact CG-CE2 3.83Å; R541-F543 HydrophobicContact CG-CZ 3.79Å; R541-F543 WeakPolarHBondContact O-CD2 3.36Å; R541-F543 VanDerWaalsContact O-CE2 3.23Å; R541-F543 WeakPolarHBondContact O-CE2 3.35Å; F543-Q545 VanDerWaalsContact C-N 3.34Å; F543-N548 HydrophobicContact CB-CB 4.3Å; F543-N548 HydrophobicContact CD1-CB 3.81Å; F543-N548 HydrophobicContact CG-CB 4.34Å; F543-L549 HydrophobicContact CB-CB 4.38Å; F543-L549 HydrophobicContact CD2-CB 4.1Å; F543-L549 HydrophobicContact CD2-CD1 4.01Å; F543-L549 HydrophobicContact CE2-CD1 4.22Å; F543-L549 HydrophobicContact CG-CB 4.37Å; F543-H552 HydrophobicContact CE1-CB 4.03Å; F543-H552 HydrophobicContact CE2-CB 4.02Å; F543-H552 AromaticContact CE2-CD2 3.24Å; F543-H552 WeakPolarHBondContact CE2-CD2 3.33Å; F543-H552 AromaticContact CE2-CG 3.81Å; F543-H552 HydrophobicContact CZ-CB 3.5Å; F543-H552 VanDerWaalsContact CZ-CB 3.5Å; F543-H552 AromaticContact CZ-CD2 3.25Å; F543-H552 WeakPolarHBondContact CZ-CD2 3.28Å; F543-H552 AromaticContact CZ-CG 3.35Å; F543-H552 AromaticContact CZ-NE2 3.96Å
544	S	85.8	Confident	88.1	Confident	29 Å²	29	80.1 Å²	80.1	20%	0.203	37%	0.366	C	S	.	.	S	Bend	trans	-82.2	-8.8	177.6	57.1	0	0	0	0	114.3	R526	R526-S544 PolarHBondContact NH1-O 3.03Å
545	Q	87.4	Confident	87.9	Confident	67 Å²	67	79.7 Å²	79.7	31%	0.313	37%	0.372	S	S	.	.	S	Bend	trans	-141.3	139.1	-178.5	-57.4	178.1	17.2	0	0	111.6	V523 Y534 F543 S547 N548 L549	V523-Q545 HydrophobicContact CG1-CG 3.99Å; Y534-Q545 VanDerWaalsContact CD2-C 3.46Å; F543-Q545 VanDerWaalsContact C-N 3.34Å; Q545-S547 VanDerWaalsContact C-N 3.33Å; Q545-S547 PolarHBondContact O-N 3.05Å; Q545-S547 PolarHBondContact OE1-OG 2.66Å; Q545-N548 PolarHBondContact O-N 3.49Å; Q545-N548 VanDerWaalsContact O-N 3.17Å; Q545-L549 PolarHBondContact O-N 2.83Å
546	K	86.8	Confident	87.7	Confident	128 Å²	128	79.7 Å²	79.7	56%	0.557	37%	0.366	S	S	*	.	H	α-helix	trans	-59.9	-38	178.7	-165.7	176.3	179.1	177.2	0	113.4	Y534 N548 L549 I550	Y534-K546 HydrophobicContact CD1-CB 3.78Å; Y534-K546 HydrophobicContact CD1-CG 4.03Å; Y534-K546 HydrophobicContact CE1-CB 3.55Å; Y534-K546 HydrophobicContact CE1-CD 4.27Å; Y534-K546 HydrophobicContact CE1-CG 3.96Å; Y534-K546 HydrophobicContact CE2-CB 4.45Å; Y534-K546 HydrophobicContact CG-CB 4.31Å; K546-N548 VanDerWaalsContact C-N 3.3Å; K546-N548 PolarHBondContact O-N 2.78Å; K546-L549 PolarHBondContact O-N 3.34Å; K546-I550 HydrophobicContact CD-CD1 4.49Å; K546-I550 HydrophobicContact CG-CD1 4.02Å; K546-I550 HydrophobicContact CG-CG1 4.46Å; K546-I550 WeakPolarHBondContact O-CG1 3.41Å; K546-I550 PolarHBondContact O-N 3.47Å
547	S	86	Confident	87.2	Confident	68 Å²	68	82.8 Å²	82.8	48%	0.476	39%	0.388	S	S	.	.	H	α-helix	trans	-58.9	-39.5	176.3	46.4	0	0	0	0	112.7	Q545 R551	Q545-S547 VanDerWaalsContact C-N 3.33Å; Q545-S547 PolarHBondContact O-N 3.05Å; Q545-S547 PolarHBondContact OE1-OG 2.66Å; S547-R551 WeakPolarHBondContact O-CB 3.27Å; S547-R551 PolarHBondContact O-N 2.9Å
548	N	88.1	Confident	86.6	Confident	39 Å²	39	76.8 Å²	76.8	21%	0.209	37%	0.373	C	S	.	.	H	α-helix	trans	-70.9	-37.4	177	-70.6	-34.1	0	0	0	111.9	F543 Q545 K546 R551 H552	F543-N548 HydrophobicContact CB-CB 4.3Å; F543-N548 HydrophobicContact CD1-CB 3.81Å; F543-N548 HydrophobicContact CG-CB 4.34Å; Q545-N548 PolarHBondContact O-N 3.49Å; Q545-N548 VanDerWaalsContact O-N 3.17Å; K546-N548 VanDerWaalsContact C-N 3.3Å; K546-N548 PolarHBondContact O-N 2.78Å; N548-R551 PolarHBondContact OD1-NH2 3Å; N548-H552 WeakPolarHBondContact O-CB 3.47Å; N548-H552 PolarHBondContact O-N 2.87Å
549	L	89.8	Confident	86.2	Confident	19 Å²	19	76.2 Å²	76.2	10%	0.099	37%	0.371	C	S	.	.	H	α-helix	trans	-61.9	-51.2	171.8	172.4	60	0	0	0	111.1	C536 F543 Q545 K546 R551 H552 Q553	C536-L549 HydrophobicContact CB-CD1 3.67Å; F543-L549 HydrophobicContact CB-CB 4.38Å; F543-L549 HydrophobicContact CD2-CB 4.1Å; F543-L549 HydrophobicContact CD2-CD1 4.01Å; F543-L549 HydrophobicContact CE2-CD1 4.22Å; F543-L549 HydrophobicContact CG-CB 4.37Å; Q545-L549 PolarHBondContact O-N 2.83Å; K546-L549 PolarHBondContact O-N 3.34Å; L549-R551 VanDerWaalsContact C-N 3.34Å; L549-R551 PolarHBondContact O-N 2.83Å; L549-H552 CarbonylContact O-C 3.55Å; L549-H552 WeakPolarHBondContact O-CA 3.32Å; L549-H552 WeakPolarHBondContact O-CB 3.42Å; L549-H552 PolarHBondContact O-N 3.42Å; L549-Q553 HydrophobicContact CD1-CG 4.02Å; L549-Q553 HydrophobicContact CG-CG 4.43Å; L549-Q553 WeakPolarHBondContact O-CG 3.41Å; L549-Q553 PolarHBondContact O-N 3.48Å
550	I	86.6	Confident	85.8	Confident	74 Å²	74	78.9 Å²	78.9	38%	0.379	38%	0.376	S	S	.	.	H	α-helix	trans	-59	-44.9	179.7	-66.8	165.3	0	0	0	111.1	K546 H552 Q553 R554	K546-I550 HydrophobicContact CD-CD1 4.49Å; K546-I550 HydrophobicContact CG-CD1 4.02Å; K546-I550 HydrophobicContact CG-CG1 4.46Å; K546-I550 WeakPolarHBondContact O-CG1 3.41Å; K546-I550 PolarHBondContact O-N 3.47Å; I550-H552 PolarHBondContact O-N 3.19Å; I550-Q553 PolarHBondContact O-N 3.36Å; I550-R554 PolarHBondContact O-N 3.07Å
551	R	85.5	Confident	85.8	Confident	106 Å²	106	72 Å²	72	40%	0.4	36%	0.359	S	S	.	.	H	α-helix	trans	-61.4	-33.5	175.3	177.1	169.2	57.9	174.4	-2	112.4	S547 N548 L549 D573	S547-R551 WeakPolarHBondContact O-CB 3.27Å; S547-R551 PolarHBondContact O-N 2.9Å; N548-R551 PolarHBondContact OD1-NH2 3Å; L549-R551 VanDerWaalsContact C-N 3.34Å; L549-R551 PolarHBondContact O-N 2.83Å; R551-D573 WeakPolarHBondContact CD-OD2 3.33Å; R551-D573 IonicContact CZ-OD2 3.04Å; R551-D573 IonicContact NE-OD2 3.96Å; R551-D573 IonicContact NH1-OD2 3.41Å; R551-D573 PolarHBondContact NH1-OD2 3.12Å
552	H	87.8	Confident	85.8	Confident	23 Å²	23	67.9 Å²	67.9	11%	0.106	34%	0.344	C	S	.	.	H	α-helix	trans	-75.1	-37.2	175.5	171	52.1	0	0	0	112.8	C539 F543 N548 L549 I550 R554 T555 H556	C539-H552 PolarHBondContact SG-NE2 3.29Å; F543-H552 HydrophobicContact CE1-CB 4.03Å; F543-H552 HydrophobicContact CE2-CB 4.02Å; F543-H552 AromaticContact CE2-CD2 3.24Å; F543-H552 WeakPolarHBondContact CE2-CD2 3.33Å; F543-H552 AromaticContact CE2-CG 3.81Å; F543-H552 HydrophobicContact CZ-CB 3.5Å; F543-H552 VanDerWaalsContact CZ-CB 3.5Å; F543-H552 AromaticContact CZ-CD2 3.25Å; F543-H552 WeakPolarHBondContact CZ-CD2 3.28Å; F543-H552 AromaticContact CZ-CG 3.35Å; F543-H552 AromaticContact CZ-NE2 3.96Å; N548-H552 WeakPolarHBondContact O-CB 3.47Å; N548-H552 PolarHBondContact O-N 2.87Å; L549-H552 CarbonylContact O-C 3.55Å; L549-H552 WeakPolarHBondContact O-CA 3.32Å; L549-H552 WeakPolarHBondContact O-CB 3.42Å; L549-H552 PolarHBondContact O-N 3.42Å; I550-H552 PolarHBondContact O-N 3.19Å; H552-R554 PolarHBondContact O-N 2.8Å; H552-T555 PolarHBondContact ND1-OG1 3.32Å; H552-T555 VanDerWaalsContact ND1-OG1 3.12Å; H552-T555 WeakPolarHBondContact O-CA 3.31Å; H552-T555 WeakPolarHBondContact O-CB 3.21Å; H552-T555 PolarHBondContact O-N 3.35Å; H552-T555 PolarHBondContact O-OG1 3.02Å; H552-H556 AromaticContact CE1-NE2 3.49Å; H552-H556 PolarHBondContact CE1-NE2 2.63Å; H552-H556 AromaticContact NE2-NE2 3.84Å
553	Q	87.3	Confident	85.8	Confident	69 Å²	69	71.4 Å²	71.4	32%	0.322	36%	0.357	S	S	.	.	H	α-helix	trans	-58.5	-33.8	176.7	-70.4	175.5	-76.7	0	0	112.2	L549 I550 T555 H556 S557	L549-Q553 HydrophobicContact CD1-CG 4.02Å; L549-Q553 HydrophobicContact CG-CG 4.43Å; L549-Q553 WeakPolarHBondContact O-CG 3.41Å; L549-Q553 PolarHBondContact O-N 3.48Å; I550-Q553 PolarHBondContact O-N 3.36Å; Q553-T555 PolarHBondContact O-N 3.23Å; Q553-T555 VanDerWaalsContact O-N 3.1Å; Q553-H556 PolarHBondContact O-N 3.32Å; Q553-S557 PolarHBondContact O-N 3.12Å; Q553-S557 VanDerWaalsContact O-N 3.17Å
554	R	86.7	Confident	86	Confident	59 Å²	59	69.8 Å²	69.8	22%	0.223	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-18.9	170.5	-64.8	178	-178.7	167.4	-1.5	114.9	I550 H552 H556 N558 E559 C572	I550-R554 PolarHBondContact O-N 3.07Å; H552-R554 PolarHBondContact O-N 2.8Å; R554-H556 VanDerWaalsContact C-N 3.32Å; R554-N558 WeakPolarHBondContact O-CA 3.43Å; R554-N558 PolarHBondContact O-N 3.49Å; R554-E559 HydrophobicContact CB-CB 4.49Å; R554-E559 HydrophobicContact CG-CB 4.32Å; R554-C572 HydrophobicContact CB-CB 3.96Å; R554-C572 WeakPolarHBondContact CD-O 3.25Å; R554-C572 PolarHBondContact NH1-O 2.88Å
555	T	83.8	Confident	86.3	Confident	70 Å²	70	80.3 Å²	80.3	43%	0.429	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-15.6	174	67.8	0	0	0	0	112.9	H552 Q553	H552-T555 PolarHBondContact ND1-OG1 3.32Å; H552-T555 VanDerWaalsContact ND1-OG1 3.12Å; H552-T555 WeakPolarHBondContact O-CA 3.31Å; H552-T555 WeakPolarHBondContact O-CB 3.21Å; H552-T555 PolarHBondContact O-N 3.35Å; H552-T555 PolarHBondContact O-OG1 3.02Å; Q553-T555 PolarHBondContact O-N 3.23Å; Q553-T555 VanDerWaalsContact O-N 3.1Å
556	H	84.7	Confident	86.4	Confident	82 Å²	82	83.3 Å²	83.3	38%	0.38	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-46.8	173.9	-55.4	-47.7	0	0	0	111.5	E538 C539 H552 Q553 R554 N558	E538-H556 WeakPolarHBondContact OE2-CB 2.95Å; E538-H556 IonicContact OE2-CD2 3.64Å; E538-H556 PolarHBondContact OE2-CD2 3.45Å; E538-H556 IonicContact OE2-CG 2.67Å; C539-H556 VanDerWaalsContact CB-NE2 3.33Å; C539-H556 WeakPolarHBondContact CB-NE2 3.45Å; C539-H556 PolarHBondContact SG-NE2 2.98Å; C539-H556 VanDerWaalsContact SG-NE2 3.44Å; H552-H556 AromaticContact CE1-NE2 3.49Å; H552-H556 PolarHBondContact CE1-NE2 2.63Å; H552-H556 AromaticContact NE2-NE2 3.84Å; Q553-H556 PolarHBondContact O-N 3.32Å; R554-H556 VanDerWaalsContact C-N 3.32Å; H556-N558 PolarHBondContact O-N 3.21Å
557	S	82.1	Confident	86.5	Confident	65 Å²	65	79.8 Å²	79.8	46%	0.455	39%	0.391	S	S	.	.	S	Bend	trans	-72.1	-6.5	176.9	62.5	0	0	0	0	114.3	Q553 E559	Q553-S557 PolarHBondContact O-N 3.12Å; Q553-S557 VanDerWaalsContact O-N 3.17Å; S557-E559 PolarHBondContact O-N 3.03Å; S557-E559 WeakPolarHBondContact OG-CB 3.44Å; S557-E559 WeakPolarHBondContact OG-CG 3.08Å
558	N	76.1	Confident	86.5	Confident	111 Å²	111	79.1 Å²	79.1	59%	0.594	40%	0.395	S	S	*	.			trans	54.8	11.6	-170.7	-77.1	-65.7	0	0	0	115.2	R554 H556 K560	R554-N558 WeakPolarHBondContact O-CA 3.43Å; R554-N558 PolarHBondContact O-N 3.49Å; H556-N558 PolarHBondContact O-N 3.21Å; N558-K560 WeakPolarHBondContact O-CG 3.5Å; N558-K560 PolarHBondContact O-N 3.15Å
559	E	80.5	Confident	86.5	Confident	111 Å²	111	85 Å²	85	52%	0.519	41%	0.414	S	S	.	.			trans	-55.9	121.4	174.8	-80.6	174	-152.6	0	0	110.9	R554 S557 P561	R554-E559 HydrophobicContact CB-CB 4.49Å; R554-E559 HydrophobicContact CG-CB 4.32Å; S557-E559 PolarHBondContact O-N 3.03Å; S557-E559 WeakPolarHBondContact OG-CB 3.44Å; S557-E559 WeakPolarHBondContact OG-CG 3.08Å; E559-P561 WeakPolarHBondContact O-CD 3.24Å
560	K	84.6	Confident	86.4	Confident	108 Å²	108	84.8 Å²	84.8	47%	0.47	42%	0.417	S	S	.	.			trans	-122.4	74.8	178.8	-75.7	157.5	179.4	167.3	0	109.9	N558 Y562 I563 G570 F571	N558-K560 WeakPolarHBondContact O-CG 3.5Å; N558-K560 PolarHBondContact O-N 3.15Å; K560-Y562 PolarHBondContact O-N 3.18Å; K560-I563 HydrophobicContact CB-CD1 4.47Å; K560-I563 WeakPolarHBondContact O-CD1 3.5Å; K560-G570 WeakPolarHBondContact CD-O 3.2Å; K560-F571 CarbonylContact C-O 3.31Å; K560-F571 VanDerWaalsContact CA-O 3.29Å; K560-F571 WeakPolarHBondContact CA-O 3.49Å
561	P	87.4	Confident	86.4	Confident	70 Å²	70	82.8 Å²	82.8	46%	0.455	41%	0.405	S	S	.	.			trans	-66.3	-10.7	-175	-20	33.6	0	0	0	114.4	E559	E559-P561 WeakPolarHBondContact O-CD 3.24Å
562	Y	88.8	Confident	86.3	Confident	74 Å²	74	79.5 Å²	79.5	29%	0.29	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	94.1	-176.4	-52.8	-71.7	0	0	0	109.2	K560 F571 K574	K560-Y562 PolarHBondContact O-N 3.18Å; Y562-F571 PolarHBondContact N-O 2.84Å; Y562-F571 PolarHBondContact O-N 2.9Å; Y562-K574 HydrophobicContact CD1-CB 3.93Å; Y562-K574 HydrophobicContact CD1-CG 4.36Å; Y562-K574 VanDerWaalsContact CD2-N 3.35Å; Y562-K574 HydrophobicContact CE1-CB 3.82Å; Y562-K574 HydrophobicContact CE1-CG 4.45Å; Y562-K574 HydrophobicContact CE2-CB 4.4Å; Y562-K574 HydrophobicContact CG-CB 4.28Å
563	I	88.8	Confident	86.1	Confident	94 Å²	94	79.8 Å²	79.8	48%	0.482	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131.1	178.4	-52.1	-55.7	0	0	0	109.7	K560	K560-I563 HydrophobicContact CB-CD1 4.47Å; K560-I563 WeakPolarHBondContact O-CD1 3.5Å
564	C	92.7	Very high	86.1	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	41%	0.412	C	S	.	.			trans	-72.2	125.1	168.3	-178.2	0	0	0	0	109.8	E566 C567 G568 R569 F571 L577	C564-E566 VanDerWaalsContact C-N 3.32Å; C564-E566 PolarHBondContact O-N 3.11Å; C564-C567 VanDerWaalsContact SG-SG 3.66Å; C564-G568 VanDerWaalsContact O-CA 3.25Å; C564-G568 WeakPolarHBondContact O-CA 3.36Å; C564-G568 PolarHBondContact O-N 3.33Å; C564-R569 PolarHBondContact N-O 3.23Å; C564-F571 HydrophobicContact CB-CE2 4.38Å; C564-L577 HydrophobicContact CB-CD1 3.56Å
565	R	90.3	Very high	86.1	Confident	249 Å²	249	82.7 Å²	82.7	94%	0.94	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-26.6	-177.8	-68.2	-176.3	172.7	-168.4	-4.8	113.5
566	E	89.4	Confident	86.2	Confident	131 Å²	131	82.2 Å²	82.2	61%	0.612	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-28.6	-174.4	-64.1	168.7	142	0	0	113.1	C564 H584	C564-E566 VanDerWaalsContact C-N 3.32Å; C564-E566 PolarHBondContact O-N 3.11Å; E566-H584 WeakPolarHBondContact OE2-CB 3.5Å; E566-H584 IonicContact OE2-CD2 2.83Å; E566-H584 PolarHBondContact OE2-CD2 3.26Å; E566-H584 IonicContact OE2-CG 3.94Å; E566-H584 VanDerWaalsContact OE2-CG 3.31Å
567	C	90.6	Very high	86.5	Confident	54 Å²	54	79 Å²	79	37%	0.365	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	6.9	-177	71.4	0	0	0	0	114.9	C564 R569 H580 H584	C564-C567 VanDerWaalsContact SG-SG 3.66Å; C567-R569 PolarHBondContact O-N 3.26Å; C567-R569 VanDerWaalsContact SG-CB 3.52Å; C567-H580 PolarHBondContact SG-NE2 3.06Å; C567-H584 VanDerWaalsContact CB-NE2 3.34Å; C567-H584 WeakPolarHBondContact CB-NE2 3.45Å
568	G	85.6	Confident	86.8	Confident	54 Å²	54	79.1 Å²	79.1	56%	0.557	40%	0.399	S	S	*	.			trans	66.5	-0.9	-178.9	0	0	0	0	0	115.6	C564 G570	C564-G568 VanDerWaalsContact O-CA 3.25Å; C564-G568 WeakPolarHBondContact O-CA 3.36Å; C564-G568 PolarHBondContact O-N 3.33Å; G568-G570 PolarHBondContact O-N 2.88Å
569	R	88.5	Confident	87.4	Confident	161 Å²	161	75.3 Å²	75.3	61%	0.608	38%	0.379	S	S	*	.			trans	-73	125.6	-172.5	-168.4	172.3	-174	169.6	7.6	111.8	C564 C567 F571	C564-R569 PolarHBondContact N-O 3.23Å; C567-R569 PolarHBondContact O-N 3.26Å; C567-R569 VanDerWaalsContact SG-CB 3.52Å; R569-F571 HydrophobicContact CB-CE2 3.97Å; R569-F571 HydrophobicContact CB-CZ 4.33Å; R569-F571 HydrophobicContact CG-CE2 3.86Å; R569-F571 HydrophobicContact CG-CZ 3.86Å; R569-F571 VanDerWaalsContact O-CD2 3.29Å; R569-F571 WeakPolarHBondContact O-CD2 3.46Å; R569-F571 WeakPolarHBondContact O-CE2 3.3Å
570	G	86.8	Confident	87.7	Confident	16 Å²	16	71.1 Å²	71.1	17%	0.165	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	142.7	178.8	0	0	0	0	0	115.5	K560 G568	K560-G570 WeakPolarHBondContact CD-O 3.2Å; G568-G570 PolarHBondContact O-N 2.88Å
571	F	86.4	Confident	87.9	Confident	31 Å²	31	69.2 Å²	69.2	14%	0.136	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.4	179.7	-61.2	-92.4	0	0	0	112.1	K560 Y562 C564 R569 L577 H580	K560-F571 CarbonylContact C-O 3.31Å; K560-F571 VanDerWaalsContact CA-O 3.29Å; K560-F571 WeakPolarHBondContact CA-O 3.49Å; Y562-F571 PolarHBondContact N-O 2.84Å; Y562-F571 PolarHBondContact O-N 2.9Å; C564-F571 HydrophobicContact CB-CE2 4.38Å; R569-F571 HydrophobicContact CB-CE2 3.97Å; R569-F571 HydrophobicContact CB-CZ 4.33Å; R569-F571 HydrophobicContact CG-CE2 3.86Å; R569-F571 HydrophobicContact CG-CZ 3.86Å; R569-F571 VanDerWaalsContact O-CD2 3.29Å; R569-F571 WeakPolarHBondContact O-CD2 3.46Å; R569-F571 WeakPolarHBondContact O-CE2 3.3Å; F571-L577 HydrophobicContact CB-CB 4.29Å; F571-L577 HydrophobicContact CD2-CB 4.12Å; F571-L577 HydrophobicContact CD2-CD1 3.87Å; F571-L577 HydrophobicContact CE2-CD1 4.13Å; F571-L577 HydrophobicContact CG-CB 4.29Å; F571-H580 HydrophobicContact CE1-CB 4.07Å; F571-H580 HydrophobicContact CE2-CB 4.18Å; F571-H580 AromaticContact CE2-CD2 3.21Å; F571-H580 WeakPolarHBondContact CE2-CD2 3.38Å; F571-H580 AromaticContact CE2-CG 3.91Å; F571-H580 AromaticContact CE2-NE2 3.93Å; F571-H580 HydrophobicContact CZ-CB 3.63Å; F571-H580 AromaticContact CZ-CD2 3.15Å; F571-H580 WeakPolarHBondContact CZ-CD2 3.48Å; F571-H580 AromaticContact CZ-CG 3.41Å; F571-H580 VanDerWaalsContact CZ-CG 3.41Å; F571-H580 AromaticContact CZ-NE2 3.82Å
572	C	83.3	Confident	88.1	Confident	37 Å²	37	68 Å²	68	25%	0.25	34%	0.339	C	S	.	.	S	Bend	trans	-83.8	-9.7	178.8	59.5	0	0	0	0	114.3	R554	R554-C572 HydrophobicContact CB-CB 3.96Å; R554-C572 WeakPolarHBondContact CD-O 3.25Å; R554-C572 PolarHBondContact NH1-O 2.88Å
573	D	84.2	Confident	88	Confident	30 Å²	30	68.6 Å²	68.6	16%	0.16	35%	0.35	C	S	.	.	S	Bend	trans	-140.2	137.3	-177	-169.7	-37.3	0	0	0	110.3	R551 S575 T576 L577	R551-D573 WeakPolarHBondContact CD-OD2 3.33Å; R551-D573 IonicContact CZ-OD2 3.04Å; R551-D573 IonicContact NE-OD2 3.96Å; R551-D573 IonicContact NH1-OD2 3.41Å; R551-D573 PolarHBondContact NH1-OD2 3.12Å; D573-S575 PolarHBondContact O-N 3.29Å; D573-S575 WeakPolarHBondContact OD1-CB 3.43Å; D573-S575 PolarHBondContact OD1-N 3.23Å; D573-S575 PolarHBondContact OD1-OG 3.12Å; D573-S575 PolarHBondContact OD2-OG 2.75Å; D573-T576 HydrophobicContact CB-CG2 4.5Å; D573-T576 PolarHBondContact O-N 3Å; D573-T576 PolarHBondContact O-OG1 3.29Å; D573-L577 PolarHBondContact O-N 3.43Å
574	K	86.9	Confident	87.9	Confident	128 Å²	128	68.9 Å²	68.9	56%	0.557	35%	0.349	S	S	*	.	H	α-helix	trans	-62.8	-32	177.6	-172.9	174.5	-178.5	175.5	0	111.9	Y562 T576 L577 I578	Y562-K574 HydrophobicContact CD1-CB 3.93Å; Y562-K574 HydrophobicContact CD1-CG 4.36Å; Y562-K574 VanDerWaalsContact CD2-N 3.35Å; Y562-K574 HydrophobicContact CE1-CB 3.82Å; Y562-K574 HydrophobicContact CE1-CG 4.45Å; Y562-K574 HydrophobicContact CE2-CB 4.4Å; Y562-K574 HydrophobicContact CG-CB 4.28Å; K574-T576 VanDerWaalsContact C-N 3.34Å; K574-L577 PolarHBondContact O-N 3Å; K574-I578 HydrophobicContact CG-CD1 4.02Å; K574-I578 HydrophobicContact CG-CG1 4.44Å; K574-I578 WeakPolarHBondContact O-CG1 3.36Å; K574-I578 PolarHBondContact O-N 3.35Å
575	S	86.2	Confident	87.7	Confident	60 Å²	60	72.2 Å²	72.2	42%	0.42	37%	0.372	S	S	.	.	H	α-helix	trans	-69.4	-30.4	179.9	62.5	0	0	0	0	113.1	D573 V579	D573-S575 PolarHBondContact O-N 3.29Å; D573-S575 WeakPolarHBondContact OD1-CB 3.43Å; D573-S575 PolarHBondContact OD1-N 3.23Å; D573-S575 PolarHBondContact OD1-OG 3.12Å; D573-S575 PolarHBondContact OD2-OG 2.75Å; S575-V579 WeakPolarHBondContact O-CB 3.24Å; S575-V579 VanDerWaalsContact O-CG2 3.24Å; S575-V579 WeakPolarHBondContact O-CG2 3.28Å; S575-V579 PolarHBondContact O-N 2.92Å
576	T	87	Confident	87.4	Confident	60 Å²	60	62.4 Å²	62.4	37%	0.368	35%	0.349	S	S	.	.	H	α-helix	trans	-78.9	-33	174.4	52.6	0	0	0	0	111.8	D573 K574 H580	D573-T576 HydrophobicContact CB-CG2 4.5Å; D573-T576 PolarHBondContact O-N 3Å; D573-T576 PolarHBondContact O-OG1 3.29Å; K574-T576 VanDerWaalsContact C-N 3.34Å; T576-H580 WeakPolarHBondContact O-CB 3.3Å; T576-H580 PolarHBondContact O-N 2.64Å
577	L	90.6	Very high	87.3	Confident	15 Å²	15	61.4 Å²	61.4	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-55.2	168.7	173.4	60.3	0	0	0	111.6	C564 F571 D573 K574 V579 H580 E581	C564-L577 HydrophobicContact CB-CD1 3.56Å; F571-L577 HydrophobicContact CB-CB 4.29Å; F571-L577 HydrophobicContact CD2-CB 4.12Å; F571-L577 HydrophobicContact CD2-CD1 3.87Å; F571-L577 HydrophobicContact CE2-CD1 4.13Å; F571-L577 HydrophobicContact CG-CB 4.29Å; D573-L577 PolarHBondContact O-N 3.43Å; K574-L577 PolarHBondContact O-N 3Å; L577-V579 PolarHBondContact O-N 3.04Å; L577-V579 VanDerWaalsContact O-N 3.16Å; L577-H580 CarbonylContact O-C 3.49Å; L577-H580 WeakPolarHBondContact O-CA 3.33Å; L577-H580 WeakPolarHBondContact O-CB 3.29Å; L577-H580 PolarHBondContact O-N 3.4Å; L577-E581 HydrophobicContact CD1-CG 3.9Å; L577-E581 HydrophobicContact CG-CG 4.27Å; L577-E581 WeakPolarHBondContact CG-OE1 3.4Å; L577-E581 PolarHBondContact O-N 3.43Å
578	I	88.2	Confident	87.1	Confident	68 Å²	68	65 Å²	65	35%	0.349	35%	0.354	S	S	.	.	H	α-helix	trans	-56.1	-38.5	-179.7	-67.9	164.7	0	0	0	111.9	K574 H580 E581 R582	K574-I578 HydrophobicContact CG-CD1 4.02Å; K574-I578 HydrophobicContact CG-CG1 4.44Å; K574-I578 WeakPolarHBondContact O-CG1 3.36Å; K574-I578 PolarHBondContact O-N 3.35Å; I578-H580 VanDerWaalsContact C-N 3.28Å; I578-H580 PolarHBondContact O-N 2.87Å; I578-E581 WeakPolarHBondContact CA-OE2 3.22Å; I578-R582 PolarHBondContact O-N 3.12Å
579	V	87.9	Confident	87.3	Confident	30 Å²	30	65.8 Å²	65.8	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-74.8	-19.4	178.8	170.4	0	0	0	0	112.5	S575 L577 R601	S575-V579 WeakPolarHBondContact O-CB 3.24Å; S575-V579 VanDerWaalsContact O-CG2 3.24Å; S575-V579 WeakPolarHBondContact O-CG2 3.28Å; S575-V579 PolarHBondContact O-N 2.92Å; L577-V579 PolarHBondContact O-N 3.04Å; L577-V579 VanDerWaalsContact O-N 3.16Å; V579-R601 HydrophobicContact CG1-CG 3.77Å
580	H	88.6	Confident	87.4	Confident	23 Å²	23	61.8 Å²	61.8	11%	0.106	33%	0.334	C	S	.	.	H	α-helix	trans	-85.1	-37.8	170.7	169.9	51.3	0	0	0	112.6	C567 F571 T576 L577 I578 R582 T583 H584	C567-H580 PolarHBondContact SG-NE2 3.06Å; F571-H580 HydrophobicContact CE1-CB 4.07Å; F571-H580 HydrophobicContact CE2-CB 4.18Å; F571-H580 AromaticContact CE2-CD2 3.21Å; F571-H580 WeakPolarHBondContact CE2-CD2 3.38Å; F571-H580 AromaticContact CE2-CG 3.91Å; F571-H580 AromaticContact CE2-NE2 3.93Å; F571-H580 HydrophobicContact CZ-CB 3.63Å; F571-H580 AromaticContact CZ-CD2 3.15Å; F571-H580 WeakPolarHBondContact CZ-CD2 3.48Å; F571-H580 AromaticContact CZ-CG 3.41Å; F571-H580 VanDerWaalsContact CZ-CG 3.41Å; F571-H580 AromaticContact CZ-NE2 3.82Å; T576-H580 WeakPolarHBondContact O-CB 3.3Å; T576-H580 PolarHBondContact O-N 2.64Å; L577-H580 CarbonylContact O-C 3.49Å; L577-H580 WeakPolarHBondContact O-CA 3.33Å; L577-H580 WeakPolarHBondContact O-CB 3.29Å; L577-H580 PolarHBondContact O-N 3.4Å; I578-H580 VanDerWaalsContact C-N 3.28Å; I578-H580 PolarHBondContact O-N 2.87Å; H580-R582 PolarHBondContact O-N 2.85Å; H580-R582 VanDerWaalsContact O-N 3.16Å; H580-T583 PolarHBondContact ND1-OG1 2.89Å; H580-T583 VanDerWaalsContact ND1-OG1 3.1Å; H580-T583 WeakPolarHBondContact O-CA 3.11Å; H580-T583 VanDerWaalsContact O-CB 3.31Å; H580-T583 WeakPolarHBondContact O-CB 3.25Å; H580-T583 PolarHBondContact O-N 3.09Å; H580-T583 PolarHBondContact O-OG1 3.31Å; H580-H584 AromaticContact CE1-NE2 3.83Å
581	E	88.6	Confident	87.5	Confident	68 Å²	68	65.2 Å²	65.2	32%	0.318	35%	0.352	S	S	.	.	H	α-helix	trans	-55.6	-34	175.2	-70.1	166.4	157	0	0	111.3	L577 I578 T583 H584 S585	L577-E581 HydrophobicContact CD1-CG 3.9Å; L577-E581 HydrophobicContact CG-CG 4.27Å; L577-E581 WeakPolarHBondContact CG-OE1 3.4Å; L577-E581 PolarHBondContact O-N 3.43Å; I578-E581 WeakPolarHBondContact CA-OE2 3.22Å; E581-T583 PolarHBondContact O-N 3.14Å; E581-H584 PolarHBondContact O-N 3.37Å; E581-S585 PolarHBondContact O-N 2.93Å; E581-S585 VanDerWaalsContact O-N 3.08Å
582	R	90.3	Very high	87.7	Confident	45 Å²	45	63.8 Å²	63.8	17%	0.17	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-15	170.1	-65.1	-178.7	-172.8	157.7	6.7	115.9	I578 H580 G586 E587 S600	I578-R582 PolarHBondContact O-N 3.12Å; H580-R582 PolarHBondContact O-N 2.85Å; H580-R582 VanDerWaalsContact O-N 3.16Å; R582-G586 WeakPolarHBondContact O-CA 3Å; R582-G586 PolarHBondContact O-N 2.87Å; R582-E587 HydrophobicContact CB-CB 4.37Å; R582-E587 HydrophobicContact CG-CB 4.05Å; R582-E587 PolarHBondContact O-N 3.2Å; R582-S600 PolarHBondContact NH1-O 2.85Å
583	T	86.9	Confident	87.9	Confident	86 Å²	86	67 Å²	67	53%	0.528	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-21.8	173.5	64.8	0	0	0	0	112.4	H580 E581	H580-T583 PolarHBondContact ND1-OG1 2.89Å; H580-T583 VanDerWaalsContact ND1-OG1 3.1Å; H580-T583 WeakPolarHBondContact O-CA 3.11Å; H580-T583 VanDerWaalsContact O-CB 3.31Å; H580-T583 WeakPolarHBondContact O-CB 3.25Å; H580-T583 PolarHBondContact O-N 3.09Å; H580-T583 PolarHBondContact O-OG1 3.31Å; E581-T583 PolarHBondContact O-N 3.14Å
584	H	87.8	Confident	88	Confident	100 Å²	100	71.4 Å²	71.4	46%	0.463	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-49.7	174.3	-56.2	-53.7	0	0	0	110.8	E566 C567 H580 E581 G586	E566-H584 WeakPolarHBondContact OE2-CB 3.5Å; E566-H584 IonicContact OE2-CD2 2.83Å; E566-H584 PolarHBondContact OE2-CD2 3.26Å; E566-H584 IonicContact OE2-CG 3.94Å; E566-H584 VanDerWaalsContact OE2-CG 3.31Å; C567-H584 VanDerWaalsContact CB-NE2 3.34Å; C567-H584 WeakPolarHBondContact CB-NE2 3.45Å; H580-H584 AromaticContact CE1-NE2 3.83Å; E581-H584 PolarHBondContact O-N 3.37Å; H584-G586 PolarHBondContact O-N 3.49Å
585	S	87.1	Confident	88.1	Confident	70 Å²	70	67.9 Å²	67.9	49%	0.49	38%	0.379	S	S	.	.	S	Bend	trans	-71.9	-11.4	177.8	68.3	0	0	0	0	114.5	E581 E587	E581-S585 PolarHBondContact O-N 2.93Å; E581-S585 VanDerWaalsContact O-N 3.08Å; S585-E587 PolarHBondContact O-N 3.05Å; S585-E587 VanDerWaalsContact O-N 3.13Å; S585-E587 WeakPolarHBondContact OG-CG 3.38Å; S585-E587 PolarHBondContact OG-N 3.41Å
586	G	84.4	Confident	88	Confident	44 Å²	44	67.5 Å²	67.5	45%	0.454	39%	0.385	S	S	.	.			trans	68.7	3.3	-176.1	0	0	0	0	0	114.9	R582 H584 K588	R582-G586 WeakPolarHBondContact O-CA 3Å; R582-G586 PolarHBondContact O-N 2.87Å; H584-G586 PolarHBondContact O-N 3.49Å; G586-K588 PolarHBondContact O-N 3.17Å
587	E	86.4	Confident	88	Confident	109 Å²	109	72.2 Å²	72.2	51%	0.509	40%	0.396	S	S	.	.			trans	-55.7	127.3	-175.7	-84.7	-172.9	-179.4	0	0	113.1	R582 S585 P589	R582-E587 HydrophobicContact CB-CB 4.37Å; R582-E587 HydrophobicContact CG-CB 4.05Å; R582-E587 PolarHBondContact O-N 3.2Å; S585-E587 PolarHBondContact O-N 3.05Å; S585-E587 VanDerWaalsContact O-N 3.13Å; S585-E587 WeakPolarHBondContact OG-CG 3.38Å; S585-E587 PolarHBondContact OG-N 3.41Å; E587-P589 WeakPolarHBondContact O-CD 3.49Å
588	K	88.3	Confident	87.8	Confident	130 Å²	130	72.4 Å²	72.4	57%	0.565	40%	0.402	S	S	*	.			trans	-125.2	72.9	179.3	-76.3	159.6	179.1	169.5	0	111	G586 Y590 G598 F599	G586-K588 PolarHBondContact O-N 3.17Å; K588-Y590 PolarHBondContact O-N 3.02Å; K588-Y590 VanDerWaalsContact O-N 3.08Å; K588-G598 WeakPolarHBondContact CD-O 3.17Å; K588-F599 CarbonylContact C-O 3.59Å; K588-F599 WeakPolarHBondContact CA-O 3.34Å
589	P	89.3	Confident	87.8	Confident	70 Å²	70	70.7 Å²	70.7	46%	0.455	39%	0.392	S	S	.	.			trans	-66.7	-12.5	-173.3	-20.6	33.9	0	0	0	114.8	E587	E587-P589 WeakPolarHBondContact O-CD 3.49Å
590	Y	89.9	Confident	87.7	Confident	77 Å²	77	70.6 Å²	70.6	30%	0.302	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	95	-176.3	-53.5	-72.7	0	0	0	109.6	K588 F599 K602	K588-Y590 PolarHBondContact O-N 3.02Å; K588-Y590 VanDerWaalsContact O-N 3.08Å; Y590-F599 WeakPolarHBondContact CD2-O 3.38Å; Y590-F599 PolarHBondContact N-O 2.8Å; Y590-F599 PolarHBondContact O-N 3.11Å; Y590-K602 HydrophobicContact CD1-CB 3.84Å; Y590-K602 HydrophobicContact CD1-CG 4.32Å; Y590-K602 HydrophobicContact CD2-CB 4.4Å; Y590-K602 HydrophobicContact CE1-CB 3.78Å; Y590-K602 HydrophobicContact CE1-CG 4.46Å; Y590-K602 HydrophobicContact CE2-CB 4.32Å; Y590-K602 VanDerWaalsContact CE2-N 3.35Å; Y590-K602 HydrophobicContact CG-CB 4.15Å
591	V	88.9	Confident	87.6	Confident	88 Å²	88	75.7 Å²	75.7	53%	0.533	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	137.6	-179.7	-177.1	0	0	0	0	110.1	G596	V591-G596 WeakPolarHBondContact CG1-O 3.21Å
592	C	90.4	Very high	87.5	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.007	42%	0.422	C	S	.	.			trans	-75.7	126.8	170.2	-176	0	0	0	0	110.4	E594 C595 G596 R597 L605	C592-E594 VanDerWaalsContact C-N 3.3Å; C592-E594 PolarHBondContact O-N 3.37Å; C592-C595 VanDerWaalsContact SG-SG 3.65Å; C592-G596 VanDerWaalsContact O-CA 3.23Å; C592-G596 WeakPolarHBondContact O-CA 3.31Å; C592-G596 PolarHBondContact O-N 3.49Å; C592-R597 PolarHBondContact N-O 3.43Å; C592-L605 HydrophobicContact CB-CD1 3.61Å
593	S	88.2	Confident	87.3	Confident	105 Å²	105	79.8 Å²	79.8	73%	0.734	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-29	178	42.4	0	0	0	0	113.7
594	E	86	Confident	87.2	Confident	122 Å²	122	79.5 Å²	79.5	57%	0.57	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-32.6	-173.2	-69.4	152	-136.7	0	0	113.1	C592 H612	C592-E594 VanDerWaalsContact C-N 3.3Å; C592-E594 PolarHBondContact O-N 3.37Å; E594-H612 WeakPolarHBondContact OE2-CB 3.44Å; E594-H612 IonicContact OE2-CD2 3.05Å; E594-H612 PolarHBondContact OE2-CD2 2.97Å; E594-H612 IonicContact OE2-CG 3.31Å
595	C	88.4	Confident	87.2	Confident	54 Å²	54	75.6 Å²	75.6	37%	0.365	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.2	6.3	-175.6	71.1	0	0	0	0	114.7	C592 R597 H608 H612	C592-C595 VanDerWaalsContact SG-SG 3.65Å; C595-R597 PolarHBondContact O-N 3.1Å; C595-R597 VanDerWaalsContact SG-CB 3.53Å; C595-H608 PolarHBondContact SG-NE2 3.19Å; C595-H612 VanDerWaalsContact CB-NE2 3.26Å; C595-H612 WeakPolarHBondContact CB-NE2 3.41Å
596	G	84.4	Confident	87.1	Confident	53 Å²	53	76.2 Å²	76.2	55%	0.546	41%	0.413	S	S	.	.			trans	66.9	1	-179.3	0	0	0	0	0	115.7	V591 C592 G598	V591-G596 WeakPolarHBondContact CG1-O 3.21Å; C592-G596 VanDerWaalsContact O-CA 3.23Å; C592-G596 WeakPolarHBondContact O-CA 3.31Å; C592-G596 PolarHBondContact O-N 3.49Å; G596-G598 PolarHBondContact O-N 2.97Å
597	R	87.5	Confident	87	Confident	158 Å²	158	75.7 Å²	75.7	60%	0.596	40%	0.401	S	S	*	.			trans	-72.1	123	-173.7	-166.3	170.1	-174.9	169	5.3	111.8	C592 C595 F599	C592-R597 PolarHBondContact N-O 3.43Å; C595-R597 PolarHBondContact O-N 3.1Å; C595-R597 VanDerWaalsContact SG-CB 3.53Å; R597-F599 HydrophobicContact CB-CE2 3.97Å; R597-F599 HydrophobicContact CB-CZ 4.28Å; R597-F599 HydrophobicContact CG-CE2 3.88Å; R597-F599 HydrophobicContact CG-CZ 3.8Å; R597-F599 WeakPolarHBondContact O-CD2 3.47Å; R597-F599 WeakPolarHBondContact O-CE2 3.41Å
598	G	87.3	Confident	86.9	Confident	20 Å²	20	71.5 Å²	71.5	21%	0.206	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	141.3	179	0	0	0	0	0	114.7	K588 G596	K588-G598 WeakPolarHBondContact CD-O 3.17Å; G596-G598 PolarHBondContact O-N 2.97Å
599	F	87.6	Confident	86.6	Confident	31 Å²	31	68.1 Å²	68.1	14%	0.136	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.1	178.3	-60.3	-91.1	0	0	0	112.1	K588 Y590 R597 R601 L604 L605 H608	K588-F599 CarbonylContact C-O 3.59Å; K588-F599 WeakPolarHBondContact CA-O 3.34Å; Y590-F599 WeakPolarHBondContact CD2-O 3.38Å; Y590-F599 PolarHBondContact N-O 2.8Å; Y590-F599 PolarHBondContact O-N 3.11Å; R597-F599 HydrophobicContact CB-CE2 3.97Å; R597-F599 HydrophobicContact CB-CZ 4.28Å; R597-F599 HydrophobicContact CG-CE2 3.88Å; R597-F599 HydrophobicContact CG-CZ 3.8Å; R597-F599 WeakPolarHBondContact O-CD2 3.47Å; R597-F599 WeakPolarHBondContact O-CE2 3.41Å; F599-R601 VanDerWaalsContact C-N 3.34Å; F599-L604 HydrophobicContact CB-CB 4.19Å; F599-L604 HydrophobicContact CD1-CB 3.71Å; F599-L604 HydrophobicContact CG-CB 4.21Å; F599-L605 HydrophobicContact CB-CB 4.42Å; F599-L605 HydrophobicContact CD2-CB 4.03Å; F599-L605 HydrophobicContact CD2-CD1 4.01Å; F599-L605 HydrophobicContact CE2-CD1 4.18Å; F599-L605 HydrophobicContact CG-CB 4.37Å; F599-H608 HydrophobicContact CE1-CB 4.08Å; F599-H608 HydrophobicContact CE2-CB 4.01Å; F599-H608 AromaticContact CE2-CD2 3.26Å; F599-H608 WeakPolarHBondContact CE2-CD2 3.4Å; F599-H608 AromaticContact CE2-CG 3.85Å; F599-H608 HydrophobicContact CZ-CB 3.52Å; F599-H608 AromaticContact CZ-CD2 3.24Å; F599-H608 WeakPolarHBondContact CZ-CD2 3.48Å; F599-H608 AromaticContact CZ-CG 3.4Å; F599-H608 AromaticContact CZ-NE2 3.98Å
600	S	86.3	Confident	86.3	Confident	28 Å²	28	67.5 Å²	67.5	20%	0.196	36%	0.356	C	S	.	.	S	Bend	trans	-78.3	-14.7	177.9	58.3	0	0	0	0	114.2	R582	R582-S600 PolarHBondContact NH1-O 2.85Å
601	R	86.2	Confident	85.7	Confident	131 Å²	131	67.4 Å²	67.4	49%	0.494	36%	0.364	S	S	.	.	S	Bend	trans	-136.3	135.1	-179.7	-57.3	179.3	-174.5	-166.2	-4.2	111.4	V579 F599 S603 L604 L605	V579-R601 HydrophobicContact CG1-CG 3.77Å; F599-R601 VanDerWaalsContact C-N 3.34Å; R601-S603 PolarHBondContact O-N 2.99Å; R601-L604 HydrophobicContact CB-CD1 4.16Å; R601-L604 HydrophobicContact CB-CG 4.18Å; R601-L604 HydrophobicContact CG-CD1 4.42Å; R601-L604 WeakPolarHBondContact O-CB 3.48Å; R601-L604 PolarHBondContact O-N 3.01Å; R601-L605 PolarHBondContact O-N 2.8Å
602	K	86.6	Confident	85.3	Confident	126 Å²	126	68 Å²	68	55%	0.548	36%	0.36	S	S	.	.	H	α-helix	trans	-57	-33.5	176.4	-173.7	169.9	-178.9	171.4	0	113.2	Y590 L604 L605 L606	Y590-K602 HydrophobicContact CD1-CB 3.84Å; Y590-K602 HydrophobicContact CD1-CG 4.32Å; Y590-K602 HydrophobicContact CD2-CB 4.4Å; Y590-K602 HydrophobicContact CE1-CB 3.78Å; Y590-K602 HydrophobicContact CE1-CG 4.46Å; Y590-K602 HydrophobicContact CE2-CB 4.32Å; Y590-K602 VanDerWaalsContact CE2-N 3.35Å; Y590-K602 HydrophobicContact CG-CB 4.15Å; K602-L604 VanDerWaalsContact C-N 3.28Å; K602-L604 PolarHBondContact O-N 3.23Å; K602-L605 PolarHBondContact O-N 3.25Å; K602-L606 HydrophobicContact CG-CD1 4.11Å; K602-L606 HydrophobicContact CG-CG 4.26Å; K602-L606 WeakPolarHBondContact O-CG 3.4Å; K602-L606 PolarHBondContact O-N 3.08Å
603	S	85.3	Confident	84.5	Confident	72 Å²	72	71 Å²	71	50%	0.503	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-31.6	176.8	54.6	0	0	0	0	113.3	R601 V607	R601-S603 PolarHBondContact O-N 2.99Å; S603-V607 WeakPolarHBondContact O-CB 3.49Å; S603-V607 WeakPolarHBondContact O-CG2 3.24Å; S603-V607 PolarHBondContact O-N 3.31Å
604	L	85.6	Confident	83.6	Confident	81 Å²	81	68.2 Å²	68.2	42%	0.424	37%	0.37	S	S	.	.	H	α-helix	trans	-74.2	-39.9	176	-63	173.8	0	0	0	110.8	F599 R601 K602 V607 H608	F599-L604 HydrophobicContact CB-CB 4.19Å; F599-L604 HydrophobicContact CD1-CB 3.71Å; F599-L604 HydrophobicContact CG-CB 4.21Å; R601-L604 HydrophobicContact CB-CD1 4.16Å; R601-L604 HydrophobicContact CB-CG 4.18Å; R601-L604 HydrophobicContact CG-CD1 4.42Å; R601-L604 WeakPolarHBondContact O-CB 3.48Å; R601-L604 PolarHBondContact O-N 3.01Å; K602-L604 VanDerWaalsContact C-N 3.28Å; K602-L604 PolarHBondContact O-N 3.23Å; L604-V607 PolarHBondContact O-N 3.23Å; L604-H608 WeakPolarHBondContact O-CB 3.36Å; L604-H608 PolarHBondContact O-N 2.91Å
605	L	87.6	Confident	82.7	Confident	18 Å²	18	67.1 Å²	67.1	9%	0.094	37%	0.365	C	S	.	.	H	α-helix	trans	-59.4	-49.4	171.9	174.8	60.3	0	0	0	111.7	C592 F599 R601 K602 V607 H608 Q609	C592-L605 HydrophobicContact CB-CD1 3.61Å; F599-L605 HydrophobicContact CB-CB 4.42Å; F599-L605 HydrophobicContact CD2-CB 4.03Å; F599-L605 HydrophobicContact CD2-CD1 4.01Å; F599-L605 HydrophobicContact CE2-CD1 4.18Å; F599-L605 HydrophobicContact CG-CB 4.37Å; R601-L605 PolarHBondContact O-N 2.8Å; K602-L605 PolarHBondContact O-N 3.25Å; L605-V607 PolarHBondContact O-N 3.29Å; L605-H608 CarbonylContact O-C 3.48Å; L605-H608 PolarHBondContact O-N 3.16Å; L605-H608 VanDerWaalsContact O-N 3.08Å; L605-Q609 HydrophobicContact CD1-CG 4.02Å; L605-Q609 HydrophobicContact CG-CG 4.45Å; L605-Q609 WeakPolarHBondContact O-CG 3.4Å; L605-Q609 PolarHBondContact O-N 2.9Å
606	L	85.2	Confident	81.9	Confident	82 Å²	82	71.1 Å²	71.1	43%	0.429	38%	0.376	S	S	.	.	H	α-helix	trans	-65	-19.2	178.2	-69.8	172.2	0	0	0	114.3	K602 R610	K602-L606 HydrophobicContact CG-CD1 4.11Å; K602-L606 HydrophobicContact CG-CG 4.26Å; K602-L606 WeakPolarHBondContact O-CG 3.4Å; K602-L606 PolarHBondContact O-N 3.08Å; L606-R610 PolarHBondContact O-NE 2.92Å
607	V	81.3	Confident	81.4	Confident	34 Å²	34	73.7 Å²	73.7	21%	0.206	37%	0.373	C	S	.	.	H	α-helix	trans	-87.3	-36.5	173.3	165.7	0	0	0	0	110.3	S603 L604 L605 R610 H629	S603-V607 WeakPolarHBondContact O-CB 3.49Å; S603-V607 WeakPolarHBondContact O-CG2 3.24Å; S603-V607 PolarHBondContact O-N 3.31Å; L604-V607 PolarHBondContact O-N 3.23Å; L605-V607 PolarHBondContact O-N 3.29Å; V607-R610 WeakPolarHBondContact O-CB 3.41Å; V607-R610 PolarHBondContact O-N 2.84Å; V607-H629 WeakPolarHBondContact CG1-CE1 3.19Å; V607-H629 VanDerWaalsContact CG1-NE2 3.3Å; V607-H629 WeakPolarHBondContact CG1-NE2 3.24Å
608	H	83.9	Confident	80.8	Confident	21 Å²	21	70 Å²	70	10%	0.097	36%	0.36	C	S	.	.	H	α-helix	trans	-69	-38.1	173.5	174.6	46.2	0	0	0	113.3	C595 F599 L604 L605 R610 T611 H612	C595-H608 PolarHBondContact SG-NE2 3.19Å; F599-H608 HydrophobicContact CE1-CB 4.08Å; F599-H608 HydrophobicContact CE2-CB 4.01Å; F599-H608 AromaticContact CE2-CD2 3.26Å; F599-H608 WeakPolarHBondContact CE2-CD2 3.4Å; F599-H608 AromaticContact CE2-CG 3.85Å; F599-H608 HydrophobicContact CZ-CB 3.52Å; F599-H608 AromaticContact CZ-CD2 3.24Å; F599-H608 WeakPolarHBondContact CZ-CD2 3.48Å; F599-H608 AromaticContact CZ-CG 3.4Å; F599-H608 AromaticContact CZ-NE2 3.98Å; L604-H608 WeakPolarHBondContact O-CB 3.36Å; L604-H608 PolarHBondContact O-N 2.91Å; L605-H608 CarbonylContact O-C 3.48Å; L605-H608 PolarHBondContact O-N 3.16Å; L605-H608 VanDerWaalsContact O-N 3.08Å; H608-R610 PolarHBondContact O-N 3.47Å; H608-R610 VanDerWaalsContact O-N 3.14Å; H608-T611 PolarHBondContact ND1-OG1 3.35Å; H608-T611 VanDerWaalsContact ND1-OG1 3.12Å; H608-T611 WeakPolarHBondContact O-CB 3.5Å; H608-T611 PolarHBondContact O-N 2.85Å; H608-T611 PolarHBondContact O-OG1 2.69Å; H608-H612 AromaticContact CE1-NE2 3.84Å
609	Q	83.1	Confident	80.5	Confident	58 Å²	58	73 Å²	73	27%	0.271	37%	0.374	S	S	.	.	H	α-helix	trans	-58.7	-29.6	175.9	-72.6	175.7	-67.4	0	0	112.1	L605 T611 H612 S613	L605-Q609 HydrophobicContact CD1-CG 4.02Å; L605-Q609 HydrophobicContact CG-CG 4.45Å; L605-Q609 WeakPolarHBondContact O-CG 3.4Å; L605-Q609 PolarHBondContact O-N 2.9Å; Q609-T611 PolarHBondContact O-N 3.26Å; Q609-H612 PolarHBondContact O-N 3.36Å; Q609-S613 PolarHBondContact O-N 3.34Å; Q609-S613 VanDerWaalsContact O-N 3.13Å
610	R	82.1	Confident	80.6	Confident	57 Å²	57	71.5 Å²	71.5	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-67.6	-13.2	171.6	-73.2	179	-94.6	-178.4	-14.3	114.9	L606 V607 H608 S613 G614	L606-R610 PolarHBondContact O-NE 2.92Å; V607-R610 WeakPolarHBondContact O-CB 3.41Å; V607-R610 PolarHBondContact O-N 2.84Å; H608-R610 PolarHBondContact O-N 3.47Å; H608-R610 VanDerWaalsContact O-N 3.14Å; R610-S613 WeakPolarHBondContact CA-OG 3.48Å; R610-G614 PolarHBondContact O-N 3.29Å
611	T	78.6	Confident	80.5	Confident	76 Å²	76	81.9 Å²	81.9	47%	0.466	40%	0.402	S	S	.	.	H	α-helix	trans	-81.1	-21.9	170.2	66.9	0	0	0	0	112.3	H608 Q609	H608-T611 PolarHBondContact ND1-OG1 3.35Å; H608-T611 VanDerWaalsContact ND1-OG1 3.12Å; H608-T611 WeakPolarHBondContact O-CB 3.5Å; H608-T611 PolarHBondContact O-N 2.85Å; H608-T611 PolarHBondContact O-OG1 2.69Å; Q609-T611 PolarHBondContact O-N 3.26Å
612	H	79.6	Confident	80.4	Confident	100 Å²	100	81.8 Å²	81.8	46%	0.463	41%	0.408	S	S	.	.	H	α-helix	trans	-85.1	-42.5	173.2	-58.9	-52.8	0	0	0	111.5	E594 C595 H608 Q609 G614	E594-H612 WeakPolarHBondContact OE2-CB 3.44Å; E594-H612 IonicContact OE2-CD2 3.05Å; E594-H612 PolarHBondContact OE2-CD2 2.97Å; E594-H612 IonicContact OE2-CG 3.31Å; C595-H612 VanDerWaalsContact CB-NE2 3.26Å; C595-H612 WeakPolarHBondContact CB-NE2 3.41Å; H608-H612 AromaticContact CE1-NE2 3.84Å; Q609-H612 PolarHBondContact O-N 3.36Å; H612-G614 VanDerWaalsContact C-N 3.27Å; H612-G614 PolarHBondContact O-N 3.13Å
613	S	74.1	Confident	80.5	Confident	63 Å²	63	78.7 Å²	78.7	44%	0.441	40%	0.401	S	S	.	.	S	Bend	trans	-72.8	-15.5	175.5	68.5	0	0	0	0	114.3	Q609 R610 E615	Q609-S613 PolarHBondContact O-N 3.34Å; Q609-S613 VanDerWaalsContact O-N 3.13Å; R610-S613 WeakPolarHBondContact CA-OG 3.48Å; S613-E615 WeakPolarHBondContact CB-OE2 3.18Å; S613-E615 PolarHBondContact O-N 3.29Å; S613-E615 VanDerWaalsContact O-N 3.15Å; S613-E615 VanDerWaalsContact OG-CD 3.31Å; S613-E615 VanDerWaalsContact OG-CG 3.32Å; S613-E615 WeakPolarHBondContact OG-CG 3.27Å; S613-E615 PolarHBondContact OG-OE2 2.97Å
614	G	68.2	Low	80.2	Confident	48 Å²	48	77.9 Å²	77.9	50%	0.495	40%	0.404	S	S	.	.			trans	69.7	2.2	-177.5	0	0	0	0	0	115.2	R610 H612 K616	R610-G614 PolarHBondContact O-N 3.29Å; H612-G614 VanDerWaalsContact C-N 3.27Å; H612-G614 PolarHBondContact O-N 3.13Å; G614-K616 PolarHBondContact O-N 3.29Å
615	E	68.3	Low	80.1	Confident	99 Å²	99	81.9 Å²	81.9	46%	0.463	41%	0.413	S	S	.	.			trans	-69.1	102	-168.6	-65.3	167.3	123.5	0	0	113.6	S613 H617	S613-E615 WeakPolarHBondContact CB-OE2 3.18Å; S613-E615 PolarHBondContact O-N 3.29Å; S613-E615 VanDerWaalsContact O-N 3.15Å; S613-E615 VanDerWaalsContact OG-CD 3.31Å; S613-E615 VanDerWaalsContact OG-CG 3.32Å; S613-E615 WeakPolarHBondContact OG-CG 3.27Å; S613-E615 PolarHBondContact OG-OE2 2.97Å; E615-H617 WeakPolarHBondContact CB-CE1 3.2Å; E615-H617 WeakPolarHBondContact CB-ND1 3.23Å; E615-H617 PolarHBondContact O-N 2.78Å; E615-H617 VanDerWaalsContact O-N 3.08Å; E615-H617 PolarHBondContact O-ND1 2.76Å; E615-H617 IonicContact OE2-CE1 3.29Å
616	K	72.1	Confident	79.6	Confident	137 Å²	137	82 Å²	82	60%	0.596	42%	0.418	S	S	*	.			trans	-84.7	72.8	178.6	-74.4	162.7	175.5	172.5	0	112.4	G614 Y618 G626 F627	G614-K616 PolarHBondContact O-N 3.29Å; K616-Y618 PolarHBondContact O-N 3.5Å; K616-G626 WeakPolarHBondContact CD-O 3.21Å; K616-F627 CarbonylContact C-O 3.32Å
617	H	72.3	Confident	79.3	Confident	108 Å²	108	79.7 Å²	79.7	50%	0.5	41%	0.405	S	S	.	.			trans	-63.2	-19	-178.3	-66.4	79.3	0	0	0	115.6	E615 F627	E615-H617 WeakPolarHBondContact CB-CE1 3.2Å; E615-H617 WeakPolarHBondContact CB-ND1 3.23Å; E615-H617 PolarHBondContact O-N 2.78Å; E615-H617 VanDerWaalsContact O-N 3.08Å; E615-H617 PolarHBondContact O-ND1 2.76Å; E615-H617 IonicContact OE2-CE1 3.29Å; H617-F627 PolarHBondContact N-O 3.08Å
618	Y	75.6	Confident	78.9	Confident	79 Å²	79	79.6 Å²	79.6	31%	0.31	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	92.8	-175.4	-60.2	-70.4	0	0	0	110.3	K616 F627 H629 K630	K616-Y618 PolarHBondContact O-N 3.5Å; Y618-F627 WeakPolarHBondContact CB-O 3.39Å; Y618-F627 PolarHBondContact N-O 3Å; Y618-F627 PolarHBondContact O-N 3.33Å; Y618-H629 VanDerWaalsContact CD2-C 3.47Å; Y618-K630 HydrophobicContact CD1-CB 4.06Å; Y618-K630 HydrophobicContact CD1-CG 4.34Å; Y618-K630 HydrophobicContact CD2-CB 4.35Å; Y618-K630 VanDerWaalsContact CD2-N 3.31Å; Y618-K630 HydrophobicContact CE1-CB 3.89Å; Y618-K630 HydrophobicContact CE1-CG 4.31Å; Y618-K630 HydrophobicContact CE2-CB 4.17Å; Y618-K630 HydrophobicContact CG-CB 4.3Å
619	V	81.9	Confident	78.4	Confident	83 Å²	83	81.7 Å²	81.7	50%	0.503	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	132	-179.1	-175.6	0	0	0	0	110.6	G624	V619-G624 WeakPolarHBondContact CG1-O 3.46Å
620	C	88.1	Confident	78.2	Confident	1 Å²	1	84.9 Å²	84.9	1%	0.007	43%	0.429	C	S	.	.			trans	-71.9	128.1	169.2	179	0	0	0	0	109.9	G624 R625 F627 L633 H640	C620-G624 VanDerWaalsContact O-CA 3.23Å; C620-G624 WeakPolarHBondContact O-CA 3.28Å; C620-G624 PolarHBondContact O-N 3.03Å; C620-R625 PolarHBondContact N-O 2.92Å; C620-F627 HydrophobicContact CB-CE2 4.41Å; C620-L633 HydrophobicContact CB-CD1 3.62Å; C620-H640 PolarHBondContact SG-NE2 3.4Å
621	R	84.7	Confident	78.2	Confident	245 Å²	245	85.6 Å²	85.6	93%	0.925	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-27.5	-178.9	-71.8	-170.3	173.1	-152.8	-3	113.5
622	E	84.1	Confident	78.4	Confident	130 Å²	130	84.3 Å²	84.3	61%	0.607	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-32.3	-179.1	-69.3	123.3	179	0	0	113.4	H640	E622-H640 IonicContact OE2-CD2 3.2Å; E622-H640 PolarHBondContact OE2-CD2 3.22Å; E622-H640 VanDerWaalsContact OE2-CD2 3.29Å
623	C	88.8	Confident	78.6	Confident	61 Å²	61	80.3 Å²	80.3	41%	0.412	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	5.8	-173.8	74	0	0	0	0	115.1	R625 H636	C623-R625 PolarHBondContact O-N 3.41Å; C623-R625 VanDerWaalsContact SG-CB 3.51Å; C623-H636 PolarHBondContact SG-NE2 2.68Å
624	G	79.6	Confident	79.1	Confident	54 Å²	54	80.8 Å²	80.8	56%	0.557	41%	0.411	S	S	*	.			trans	67.4	-0.8	-179.1	0	0	0	0	0	115.9	V619 C620 G626	V619-G624 WeakPolarHBondContact CG1-O 3.46Å; C620-G624 VanDerWaalsContact O-CA 3.23Å; C620-G624 WeakPolarHBondContact O-CA 3.28Å; C620-G624 PolarHBondContact O-N 3.03Å; G624-G626 PolarHBondContact O-N 2.84Å
625	R	82.5	Confident	80	Confident	166 Å²	166	86.6 Å²	86.6	63%	0.626	42%	0.418	S	S	*	.			trans	-70.7	122.3	-173.5	-160.3	170.7	-166.8	179	5.8	111.5	C620 C623 F627	C620-R625 PolarHBondContact N-O 2.92Å; C623-R625 PolarHBondContact O-N 3.41Å; C623-R625 VanDerWaalsContact SG-CB 3.51Å; R625-F627 HydrophobicContact CB-CE2 3.95Å; R625-F627 HydrophobicContact CB-CZ 4.24Å; R625-F627 HydrophobicContact CG-CE2 4.06Å; R625-F627 HydrophobicContact CG-CZ 3.96Å; R625-F627 VanDerWaalsContact O-CD2 3.26Å; R625-F627 WeakPolarHBondContact O-CD2 3.32Å; R625-F627 WeakPolarHBondContact O-CE2 3.44Å
626	G	78.1	Confident	80.8	Confident	19 Å²	19	83.1 Å²	83.1	20%	0.196	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	136.5	179.9	0	0	0	0	0	114.2	K616 G624	K616-G626 WeakPolarHBondContact CD-O 3.21Å; G624-G626 PolarHBondContact O-N 2.84Å
627	F	78.3	Confident	81.5	Confident	34 Å²	34	80.5 Å²	80.5	15%	0.149	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	145.6	178.8	-60.3	-91.8	0	0	0	111.8	K616 H617 Y618 C620 R625 N632 L633 H636	K616-F627 CarbonylContact C-O 3.32Å; H617-F627 PolarHBondContact N-O 3.08Å; Y618-F627 WeakPolarHBondContact CB-O 3.39Å; Y618-F627 PolarHBondContact N-O 3Å; Y618-F627 PolarHBondContact O-N 3.33Å; C620-F627 HydrophobicContact CB-CE2 4.41Å; R625-F627 HydrophobicContact CB-CE2 3.95Å; R625-F627 HydrophobicContact CB-CZ 4.24Å; R625-F627 HydrophobicContact CG-CE2 4.06Å; R625-F627 HydrophobicContact CG-CZ 3.96Å; R625-F627 VanDerWaalsContact O-CD2 3.26Å; R625-F627 WeakPolarHBondContact O-CD2 3.32Å; R625-F627 WeakPolarHBondContact O-CE2 3.44Å; F627-N632 HydrophobicContact CB-CB 4.43Å; F627-N632 HydrophobicContact CD1-CB 3.85Å; F627-N632 HydrophobicContact CG-CB 4.43Å; F627-L633 HydrophobicContact CB-CB 4.31Å; F627-L633 HydrophobicContact CD2-CB 4.03Å; F627-L633 HydrophobicContact CD2-CD1 3.92Å; F627-L633 HydrophobicContact CE2-CD1 4.14Å; F627-L633 HydrophobicContact CG-CB 4.29Å; F627-H636 HydrophobicContact CE1-CB 4.06Å; F627-H636 HydrophobicContact CE2-CB 4.05Å; F627-H636 AromaticContact CE2-CD2 3.29Å; F627-H636 WeakPolarHBondContact CE2-CD2 3.48Å; F627-H636 AromaticContact CE2-CG 3.86Å; F627-H636 HydrophobicContact CZ-CB 3.52Å; F627-H636 AromaticContact CZ-CD2 3.29Å; F627-H636 WeakPolarHBondContact CZ-CD2 3.5Å; F627-H636 AromaticContact CZ-CG 3.4Å; F627-H636 VanDerWaalsContact CZ-CG 3.4Å
628	S	73.1	Confident	82.4	Confident	32 Å²	32	84.7 Å²	84.7	22%	0.224	40%	0.403	C	S	.	.	S	Bend	trans	-79.3	-18.2	173.9	45.5	0	0	0	0	113.6
629	H	73.4	Confident	82.9	Confident	65 Å²	65	85.8 Å²	85.8	30%	0.301	42%	0.418	S	S	.	.	S	Bend	trans	-126.2	135.3	179.9	-67.8	-130.8	0	0	0	112.2	V607 Y618 S631 N632 L633	V607-H629 WeakPolarHBondContact CG1-CE1 3.19Å; V607-H629 VanDerWaalsContact CG1-NE2 3.3Å; V607-H629 WeakPolarHBondContact CG1-NE2 3.24Å; Y618-H629 VanDerWaalsContact CD2-C 3.47Å; H629-S631 VanDerWaalsContact C-N 3.28Å; H629-S631 PolarHBondContact O-N 3.5Å; H629-N632 HydrophobicContact CB-CB 4.19Å; H629-N632 PolarHBondContact O-N 2.96Å; H629-N632 VanDerWaalsContact O-N 3.09Å; H629-L633 PolarHBondContact O-N 2.91Å; H629-L633 VanDerWaalsContact O-N 3.14Å
630	K	79.7	Confident	82.9	Confident	126 Å²	126	88 Å²	88	55%	0.548	42%	0.423	S	S	.	.	H	α-helix	trans	-59.7	-34.7	173.4	-169.7	177.4	-178	178.8	0	113	Y618 N632 L633 I634	Y618-K630 HydrophobicContact CD1-CB 4.06Å; Y618-K630 HydrophobicContact CD1-CG 4.34Å; Y618-K630 HydrophobicContact CD2-CB 4.35Å; Y618-K630 VanDerWaalsContact CD2-N 3.31Å; Y618-K630 HydrophobicContact CE1-CB 3.89Å; Y618-K630 HydrophobicContact CE1-CG 4.31Å; Y618-K630 HydrophobicContact CE2-CB 4.17Å; Y618-K630 HydrophobicContact CG-CB 4.3Å; K630-N632 VanDerWaalsContact C-N 3.3Å; K630-N632 PolarHBondContact O-N 2.83Å; K630-L633 PolarHBondContact O-N 3.47Å; K630-I634 HydrophobicContact CD-CD1 4.44Å; K630-I634 HydrophobicContact CG-CD1 3.96Å; K630-I634 HydrophobicContact CG-CG1 4.39Å; K630-I634 VanDerWaalsContact O-CG1 3.31Å; K630-I634 WeakPolarHBondContact O-CG1 3.12Å; K630-I634 PolarHBondContact O-N 3.21Å
631	S	81.8	Confident	82.6	Confident	71 Å²	71	92.4 Å²	92.4	50%	0.497	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-35.8	175.6	53.6	0	0	0	0	112.7	H629 R635	H629-S631 VanDerWaalsContact C-N 3.28Å; H629-S631 PolarHBondContact O-N 3.5Å; S631-R635 WeakPolarHBondContact O-CB 3.36Å; S631-R635 PolarHBondContact O-N 3Å
632	N	82.8	Confident	82.5	Confident	50 Å²	50	84.4 Å²	84.4	27%	0.267	42%	0.419	S	S	.	.	H	α-helix	trans	-74.5	-38.5	178.9	-64.5	-5.8	0	0	0	110.6	F627 H629 K630 R635 H636	F627-N632 HydrophobicContact CB-CB 4.43Å; F627-N632 HydrophobicContact CD1-CB 3.85Å; F627-N632 HydrophobicContact CG-CB 4.43Å; H629-N632 HydrophobicContact CB-CB 4.19Å; H629-N632 PolarHBondContact O-N 2.96Å; H629-N632 VanDerWaalsContact O-N 3.09Å; K630-N632 VanDerWaalsContact C-N 3.3Å; K630-N632 PolarHBondContact O-N 2.83Å; N632-R635 PolarHBondContact O-N 3.09Å; N632-H636 WeakPolarHBondContact O-CB 3.26Å; N632-H636 PolarHBondContact O-N 3Å
633	L	84.3	Confident	82.4	Confident	16 Å²	16	81.8 Å²	81.8	8%	0.084	41%	0.408	C	S	.	.	H	α-helix	trans	-59.2	-52.2	169.2	173.9	61.4	0	0	0	111.1	C620 F627 H629 K630 R635 H636 Q637	C620-L633 HydrophobicContact CB-CD1 3.62Å; F627-L633 HydrophobicContact CB-CB 4.31Å; F627-L633 HydrophobicContact CD2-CB 4.03Å; F627-L633 HydrophobicContact CD2-CD1 3.92Å; F627-L633 HydrophobicContact CE2-CD1 4.14Å; F627-L633 HydrophobicContact CG-CB 4.29Å; H629-L633 PolarHBondContact O-N 2.91Å; H629-L633 VanDerWaalsContact O-N 3.14Å; K630-L633 PolarHBondContact O-N 3.47Å; L633-R635 VanDerWaalsContact C-N 3.28Å; L633-R635 PolarHBondContact O-N 3.1Å; L633-H636 CarbonylContact O-C 3.21Å; L633-H636 WeakPolarHBondContact O-CA 3.22Å; L633-H636 WeakPolarHBondContact O-CB 3.49Å; L633-H636 PolarHBondContact O-N 2.81Å; L633-Q637 HydrophobicContact CD1-CG 3.83Å; L633-Q637 HydrophobicContact CG-CG 4.24Å; L633-Q637 WeakPolarHBondContact O-CG 3.37Å; L633-Q637 PolarHBondContact O-N 3.14Å
634	I	84.2	Confident	82	Confident	73 Å²	73	83.1 Å²	83.1	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-59.1	-38.7	179.9	-69.3	165.2	0	0	0	111.7	K630 R638	K630-I634 HydrophobicContact CD-CD1 4.44Å; K630-I634 HydrophobicContact CG-CD1 3.96Å; K630-I634 HydrophobicContact CG-CG1 4.39Å; K630-I634 VanDerWaalsContact O-CG1 3.31Å; K630-I634 WeakPolarHBondContact O-CG1 3.12Å; K630-I634 PolarHBondContact O-N 3.21Å; I634-R638 WeakPolarHBondContact O-CG 3.22Å
635	R	86	Confident	82.2	Confident	170 Å²	170	84.9 Å²	84.9	64%	0.642	40%	0.399	S	S	*	.	H	α-helix	trans	-66.5	-38.1	175.4	-179	173.6	61.5	-177.2	-0.9	111.9	S631 N632 L633 R638	S631-R635 WeakPolarHBondContact O-CB 3.36Å; S631-R635 PolarHBondContact O-N 3Å; N632-R635 PolarHBondContact O-N 3.09Å; L633-R635 VanDerWaalsContact C-N 3.28Å; L633-R635 PolarHBondContact O-N 3.1Å; R635-R638 PolarHBondContact O-N 3.25Å
636	H	86.5	Confident	82.2	Confident	25 Å²	25	79.5 Å²	79.5	12%	0.116	38%	0.383	C	S	.	.	H	α-helix	trans	-72.3	-34.3	176.5	171.7	49.1	0	0	0	113	C623 F627 N632 L633 R638 T639 H640	C623-H636 PolarHBondContact SG-NE2 2.68Å; F627-H636 HydrophobicContact CE1-CB 4.06Å; F627-H636 HydrophobicContact CE2-CB 4.05Å; F627-H636 AromaticContact CE2-CD2 3.29Å; F627-H636 WeakPolarHBondContact CE2-CD2 3.48Å; F627-H636 AromaticContact CE2-CG 3.86Å; F627-H636 HydrophobicContact CZ-CB 3.52Å; F627-H636 AromaticContact CZ-CD2 3.29Å; F627-H636 WeakPolarHBondContact CZ-CD2 3.5Å; F627-H636 AromaticContact CZ-CG 3.4Å; F627-H636 VanDerWaalsContact CZ-CG 3.4Å; N632-H636 WeakPolarHBondContact O-CB 3.26Å; N632-H636 PolarHBondContact O-N 3Å; L633-H636 CarbonylContact O-C 3.21Å; L633-H636 WeakPolarHBondContact O-CA 3.22Å; L633-H636 WeakPolarHBondContact O-CB 3.49Å; L633-H636 PolarHBondContact O-N 2.81Å; H636-R638 PolarHBondContact O-N 3.18Å; H636-T639 PolarHBondContact ND1-OG1 3.4Å; H636-T639 VanDerWaalsContact ND1-OG1 3.1Å; H636-T639 PolarHBondContact O-N 3.21Å; H636-T639 PolarHBondContact O-OG1 2.91Å; H636-H640 AromaticContact CE1-CE1 3.65Å; H636-H640 AromaticContact CE1-NE2 3.37Å; H636-H640 PolarHBondContact CE1-NE2 3.13Å; H636-H640 AromaticContact NE2-CE1 3.9Å; H636-H640 AromaticContact NE2-NE2 3.26Å; H636-H640 PolarHBondContact NE2-NE2 3.47Å
637	Q	86.7	Confident	82.4	Confident	83 Å²	83	83.8 Å²	83.8	39%	0.388	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	2.6	172.2	-68.7	-178.4	-70	0	0	113.9	L633	L633-Q637 HydrophobicContact CD1-CG 3.83Å; L633-Q637 HydrophobicContact CG-CG 4.24Å; L633-Q637 WeakPolarHBondContact O-CG 3.37Å; L633-Q637 PolarHBondContact O-N 3.14Å
638	R	89.4	Confident	82.8	Confident	196 Å²	196	87.6 Å²	87.6	74%	0.74	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	3.1	169.3	-60.3	170.5	-179.5	-169.7	-4.6	112.7	I634 R635 H636	I634-R638 WeakPolarHBondContact O-CG 3.22Å; R635-R638 PolarHBondContact O-N 3.25Å; H636-R638 PolarHBondContact O-N 3.18Å
639	T	87.2	Confident	83.6	Confident	102 Å²	102	92.3 Å²	92.3	63%	0.626	43%	0.432	S	S	*	.			trans	-103	-5.7	173	69.2	0	0	0	0	112.2	H636	H636-T639 PolarHBondContact ND1-OG1 3.4Å; H636-T639 VanDerWaalsContact ND1-OG1 3.1Å; H636-T639 PolarHBondContact O-N 3.21Å; H636-T639 PolarHBondContact O-OG1 2.91Å
640	H	81.1	Confident	84.5	Confident	130 Å²	130	94.7 Å²	94.7	60%	0.602	44%	0.444	S	S	*	.			trans	-97.5	0	155.9	-47.4	-57	0	0	0	106.9	C620 E622 H636	C620-H640 PolarHBondContact SG-NE2 3.4Å; E622-H640 IonicContact OE2-CD2 3.2Å; E622-H640 PolarHBondContact OE2-CD2 3.22Å; E622-H640 VanDerWaalsContact OE2-CD2 3.29Å; H636-H640 AromaticContact CE1-CE1 3.65Å; H636-H640 AromaticContact CE1-NE2 3.37Å; H636-H640 PolarHBondContact CE1-NE2 3.13Å; H636-H640 AromaticContact NE2-CE1 3.9Å; H636-H640 AromaticContact NE2-NE2 3.26Å; H636-H640 PolarHBondContact NE2-NE2 3.47Å

Retrieved 640 of 640 residues in 188.2 ms (Link to these results)

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