A0A077Z140_TRITR Loading...

Zinc finger protein

AlphaFold DB , UniProt , Accession A0A077Z140, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 565 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	36.5	Very low	244 Å²	244	137 Å²	137	100%	1.202	81%	0.806	S	S	*	*				0	130.4	0	-75.8	171.9	160.1	0	0	107.3
2	A	36.8	Very low	36.4	Very low	96 Å²	96	141.7 Å²	141.7	79%	0.793	81%	0.814	S	S	*	*			trans	43.7	106.8	172.3	0	0	0	0	0	116.7
3	L	34.7	Very low	36.3	Very low	168 Å²	168	136.6 Å²	136.6	88%	0.88	80%	0.799	S	S	*	*			cis	53.5	128.5	44.7	-67.9	178.9	0	0	0	115.5
4	Q	39.9	Very low	36.3	Very low	182 Å²	182	135.9 Å²	135.9	85%	0.85	80%	0.798	S	S	*	*			trans	148	132.3	154.5	-84.4	-175	-33.5	0	0	107.6
5	T	39.5	Very low	36.4	Very low	99 Å²	99	135.3 Å²	135.3	61%	0.607	80%	0.796	S	S	*	*			cis	-162.2	136.8	-4.8	29.4	0	0	0	0	109
6	D	38.9	Very low	36.8	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	79%	0.794	S	S	*	*				53	130	126.6	-34.8	-22.2	0	0	0	119.8
7	S	36.7	Very low	36.7	Very low	90 Å²	90	135.8 Å²	135.8	63%	0.629	80%	0.796	S	S	*	*			cis	88.1	119.6	21.8	89.4	0	0	0	0	118.1
8	N	33.1	Very low	36.6	Very low	166 Å²	166	132.8 Å²	132.8	89%	0.888	79%	0.79	S	S	*	*			trans	85.9	148.5	151.2	-55.9	-21.7	0	0	0	121.5
9	G	36.7	Very low	36.5	Very low	67 Å²	67	131.8 Å²	131.8	69%	0.691	79%	0.785	S	S	*	*			trans	136	83.3	176.6	0	0	0	0	0	111
10	L	31.5	Very low	36.7	Very low	177 Å²	177	133.2 Å²	133.2	93%	0.927	79%	0.788	S	S	*	*				45.9	139.2	92.3	-92.6	68.5	0	0	0	113.8
11	A	33.8	Very low	36.7	Very low	79 Å²	79	129.8 Å²	129.8	65%	0.653	78%	0.781	S	S	*	*			cis	175.1	-174.6	-11.1	0	0	0	0	0	106.3
12	E	36.2	Very low	36.4	Very low	193 Å²	193	126.5 Å²	126.5	90%	0.902	77%	0.768	S	S	*	*			trans	74.6	152.2	167.6	-51.8	-172.3	135.1	0	0	118.2
13	A	34.4	Very low	36.3	Very low	76 Å²	76	125.3 Å²	125.3	63%	0.628	77%	0.766	S	S	*	*			cis	-172.2	157.3	-34.8	0	0	0	0	0	108.7
14	T	36.1	Very low	36.6	Very low	127 Å²	127	123.5 Å²	123.5	78%	0.779	76%	0.764	S	S	*	*			trans	65.3	130.5	141.6	-57.6	0	0	0	0	118.2
15	T	37.5	Very low	36.9	Very low	126 Å²	126	120.6 Å²	120.6	77%	0.773	76%	0.761	S	S	*	*			cis	-165.1	173.2	5.7	16.1	0	0	0	0	111.1
16	P	43.3	Very low	36.7	Very low	117 Å²	117	123.6 Å²	123.6	76%	0.76	77%	0.768	S	S	*	*			trans	-108.2	164.9	-175.4	41.2	-33.3	0	0	0	115.8
17	I	35.6	Very low	36.7	Very low	162 Å²	162	124.5 Å²	124.5	83%	0.831	77%	0.765	S	S	*	*			trans	-149.5	115.4	166.9	-52.8	-176.8	0	0	0	105.7
18	A	35.1	Very low	36.4	Very low	82 Å²	82	124.9 Å²	124.9	68%	0.678	77%	0.768	S	S	*	*				65	144.9	70.6	0	0	0	0	0	114.3
19	T	34.3	Very low	36.5	Very low	115 Å²	115	123.6 Å²	123.6	71%	0.706	77%	0.766	S	S	*	*			cis	-163.9	-174.6	-21.2	31.1	0	0	0	0	106.8
20	N	40	Very low	36.1	Very low	159 Å²	159	124.9 Å²	124.9	85%	0.85	77%	0.771	S	S	*	*			trans	84.5	137.1	168.5	-34.8	-24.2	0	0	0	114.5
21	G	37.9	Very low	36.4	Very low	61 Å²	61	123 Å²	123	63%	0.629	77%	0.766	S	S	*	*			cis	-172.2	145.9	-7.1	0	0	0	0	0	112.6
22	D	31.4	Very low	36.2	Very low	175 Å²	175	128.1 Å²	128.1	94%	0.936	78%	0.776	S	S	*	*			trans	53.9	121.7	133.2	-57.3	-69	0	0	0	123.1
23	G	34.8	Very low	36.2	Very low	72 Å²	72	126.4 Å²	126.4	74%	0.742	77%	0.774	S	S	*	*			trans	169.8	135.4	163.8	0	0	0	0	0	111.9
24	P	41.2	Very low	36.1	Very low	129 Å²	129	131.1 Å²	131.1	84%	0.838	78%	0.783	S	S	*	*			trans	-115.6	170.9	-134.5	21.6	-1.4	0	0	0	117
25	P	46.8	Very low	36.2	Very low	121 Å²	121	133.4 Å²	133.4	79%	0.786	79%	0.789	S	S	*	*			trans	-103.6	158.9	-170.4	39.6	-34.4	0	0	0	114.8
26	E	34.9	Very low	36.1	Very low	162 Å²	162	133.6 Å²	133.6	76%	0.757	78%	0.781	S	S	*	*			trans	-174.3	153.4	154.6	-97.4	-161.8	-179	0	0	107.1
27	K	38.6	Very low	35.8	Very low	158 Å²	158	133.4 Å²	133.4	69%	0.687	78%	0.78	S	S	*	*			cis	-152.9	170.4	1.2	-134.9	177.9	-169.5	95.3	0	109.5
28	S	31.4	Very low	35.6	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	78%	0.776	S	S	*	*			trans	-57.2	154.5	175.5	46.1	0	0	0	0	114
29	T	35.2	Very low	35.6	Very low	139 Å²	139	135 Å²	135	85%	0.853	78%	0.777	S	S	*	*				-165.7	146.3	82.4	27.7	0	0	0	0	112.5
30	A	28.7	Very low	35.9	Very low	94 Å²	94	138.1 Å²	138.1	78%	0.777	78%	0.781	S	S	*	*			trans	-90.6	139.3	172.3	0	0	0	0	0	110.6
31	V	36.5	Very low	35.5	Very low	137 Å²	137	137.4 Å²	137.4	83%	0.83	78%	0.782	S	S	*	*			trans	-138.3	114.4	151.1	-177.5	0	0	0	0	106.3
32	E	30.5	Very low	35.1	Very low	187 Å²	187	139.4 Å²	139.4	87%	0.874	79%	0.793	S	S	*	*			trans	-80	131.1	166.7	-61.3	176.8	126.1	0	0	107.9
33	D	36.5	Very low	35.2	Very low	157 Å²	157	140.4 Å²	140.4	84%	0.84	79%	0.789	S	S	*	*			trans	-148.7	109.2	158	-132.5	-27.8	0	0	0	109.3
34	E	32.3	Very low	34.9	Very low	175 Å²	175	143.3 Å²	143.3	82%	0.818	79%	0.793	S	S	*	*			trans	-75.9	131	176	-100.1	-161.8	91.8	0	0	110.5
35	L	37.6	Very low	34.5	Very low	175 Å²	175	143.7 Å²	143.7	92%	0.916	79%	0.787	S	S	*	*			trans	-147.5	118	153.6	-144.5	65.8	0	0	0	112.5
36	E	36.5	Very low	33.9	Very low	129 Å²	129	144.7 Å²	144.7	60%	0.603	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-58.7	144.3	-170.9	-66.5	-172.1	135.5	0	0	115.2	K39	E36-K39 IonicContact OE1-NZ 2.74Å; E36-K39 PolarHBondContact OE1-NZ 3.35Å; E36-K39 IonicContact OE2-NZ 3.5Å; E36-K39 PolarHBondContact OE2-NZ 3.18Å
37	P	35.8	Very low	33.9	Very low	114 Å²	114	148.7 Å²	148.7	74%	0.74	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-77.3	152.5	160.9	32.6	-32.6	0	0	0	112.2
38	P	32	Very low	34	Very low	115 Å²	115	144 Å²	144	75%	0.747	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.5	132.1	-150.2	29.9	-37	0	0	0	116.7	K40	P38-K40 PolarHBondContact O-N 3.32Å
39	K	35	Very low	34.4	Very low	161 Å²	161	146.4 Å²	146.4	70%	0.7	78%	0.784	S	S	*	*			trans	-66.9	107.7	169.5	-64.8	166.2	176.9	122.5	0	111.6	E36	E36-K39 IonicContact OE1-NZ 2.74Å; E36-K39 PolarHBondContact OE1-NZ 3.35Å; E36-K39 IonicContact OE2-NZ 3.5Å; E36-K39 PolarHBondContact OE2-NZ 3.18Å
40	K	39.6	Very low	34.5	Very low	182 Å²	182	142.7 Å²	142.7	79%	0.791	77%	0.774	S	S	*	*			trans	-131.8	123.3	166.6	-72.2	-171.8	179.4	175.7	0	114.2	P38	P38-K40 PolarHBondContact O-N 3.32Å
41	T	31.6	Very low	34.8	Very low	143 Å²	143	143.9 Å²	143.9	88%	0.877	77%	0.767	S	S	*	*			trans	60.5	64.4	160.2	58.7	0	0	0	0	119.4
42	A	29.6	Very low	35.3	Very low	103 Å²	103	140.9 Å²	140.9	85%	0.851	75%	0.748	S	S	*	*			trans	-93.8	104.9	153.7	0	0	0	0	0	110.8
43	K	34.5	Very low	35.7	Very low	197 Å²	197	137.1 Å²	137.1	86%	0.857	73%	0.734	S	S	*	*			trans	-136.5	143.6	162.9	-73.8	-177	179	172.6	0	108.5
44	T	28.6	Very low	35.8	Very low	133 Å²	133	134.7 Å²	134.7	82%	0.816	73%	0.725	S	S	*	*	S	Bend	trans	78.6	67.2	-178.7	-38.2	0	0	0	0	116
45	L	33.3	Very low	36.2	Very low	137 Å²	137	131.8 Å²	131.8	72%	0.717	72%	0.715	S	S	*	*			trans	176.2	72.2	144.8	-98.3	160.6	0	0	0	110.2
46	T	33.5	Very low	36.6	Very low	142 Å²	142	129.8 Å²	129.8	87%	0.871	70%	0.704	S	S	*	*			trans	-103.9	8.5	-172.2	40.3	0	0	0	0	115.2
47	R	34.5	Very low	37	Very low	246 Å²	246	128.6 Å²	128.6	93%	0.928	71%	0.71	S	S	*	*	S	Bend	trans	-108.3	-9.3	-176.8	-168.3	167.7	170.4	179.2	-3.6	115.1
48	S	41	Very low	37.3	Very low	60 Å²	60	128.2 Å²	128.2	42%	0.42	71%	0.706	S	S	.	*	S	Bend	trans	-104	-4.1	-176.7	49	0	0	0	0	115.3	V52	S48-V52 WeakPolarHBondContact O-CG2 3.4Å
49	K	40.6	Very low	37.9	Very low	148 Å²	148	130.7 Å²	130.7	64%	0.643	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-75.2	-48.3	-178.1	-70.9	-169.4	171.5	-168.8	0	113.3	L51 V52 D53	K49-L51 PolarHBondContact O-N 3.07Å; K49-V52 PolarHBondContact O-N 3.26Å; K49-D53 PolarHBondContact O-N 3.09Å
50	G	35.9	Very low	38.2	Very low	61 Å²	61	128.2 Å²	128.2	63%	0.629	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-67.9	1.2	-178.5	0	0	0	0	0	116.5	T54	G50-T54 PolarHBondContact O-OG1 3.18Å
51	L	34.3	Very low	38.2	Very low	120 Å²	120	123.2 Å²	123.2	63%	0.628	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-106.9	-14.2	172.6	-139.4	167.3	0	0	0	111.5	K49 L55	K49-L51 PolarHBondContact O-N 3.07Å; L51-L55 HydrophobicContact CD2-CD1 4Å; L51-L55 VanDerWaalsContact O-CD1 3.31Å; L51-L55 WeakPolarHBondContact O-CD1 3.39Å; L51-L55 WeakPolarHBondContact O-CG 3.44Å
52	V	48	Very low	39.4	Very low	74 Å²	74	121.8 Å²	121.8	45%	0.448	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.3	-39.5	177	175.8	0	0	0	0	110	S48 K49 T54 L55 L56	S48-V52 WeakPolarHBondContact O-CG2 3.4Å; K49-V52 PolarHBondContact O-N 3.26Å; V52-T54 VanDerWaalsContact C-N 3.27Å; V52-T54 PolarHBondContact O-N 3.36Å; V52-L55 PolarHBondContact O-N 2.99Å; V52-L56 HydrophobicContact CG1-CD1 3.98Å; V52-L56 PolarHBondContact O-N 3.25Å
53	D	39.2	Very low	41	Very low	108 Å²	108	119 Å²	119	58%	0.578	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-65.3	-29.4	180	-57.2	-33	0	0	0	112.3	K49 L55	K49-D53 PolarHBondContact O-N 3.09Å; D53-L55 VanDerWaalsContact C-N 3.34Å
54	T	38.5	Very low	42.5	Very low	106 Å²	106	115.9 Å²	115.9	65%	0.65	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-78.7	-14.4	174	-23.9	0	0	0	0	113.8	G50 V52	G50-T54 PolarHBondContact O-OG1 3.18Å; V52-T54 VanDerWaalsContact C-N 3.27Å; V52-T54 PolarHBondContact O-N 3.36Å
55	L	40.5	Very low	44.4	Very low	114 Å²	114	113.9 Å²	113.9	60%	0.597	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-100.9	-3.2	178.8	-68.7	175.6	0	0	0	113	L51 V52 D53	L51-L55 HydrophobicContact CD2-CD1 4Å; L51-L55 VanDerWaalsContact O-CD1 3.31Å; L51-L55 WeakPolarHBondContact O-CD1 3.39Å; L51-L55 WeakPolarHBondContact O-CG 3.44Å; V52-L55 PolarHBondContact O-N 2.99Å; D53-L55 VanDerWaalsContact C-N 3.34Å
56	L	46.8	Very low	46.7	Very low	133 Å²	133	111.8 Å²	111.8	70%	0.696	63%	0.633	S	S	*	*	S	Bend	trans	-98.5	-3	178.6	-103.9	68.1	0	0	0	114.1	V52	V52-L56 HydrophobicContact CG1-CD1 3.98Å; V52-L56 PolarHBondContact O-N 3.25Å
57	S	44.8	Very low	48.9	Very low	103 Å²	103	105 Å²	105	72%	0.72	59%	0.592	S	S	*	*	S	Bend	trans	-101	11	178.8	-56.2	0	0	0	0	114.4
58	T	40.8	Very low	50.8	Low	107 Å²	107	98 Å²	98	66%	0.656	58%	0.58	S	S	*	*	S	Bend	trans	-97.6	117.8	172.4	53	0	0	0	0	110.4
59	E	44.5	Very low	52.2	Low	167 Å²	167	101.2 Å²	101.2	78%	0.78	59%	0.588	S	S	*	*			trans	-32.8	132.5	176.8	-64.8	-61.7	141.4	0	0	114.3	S61	E59-S61 PolarHBondContact O-N 3.02Å
60	P	42.4	Very low	54	Low	109 Å²	109	96.4 Å²	96.4	71%	0.708	57%	0.573	S	S	*	*			trans	-71.1	97	-172.6	28.7	-34.8	0	0	0	112	A62	P60-A62 PolarHBondContact O-N 3.36Å
61	S	39.3	Very low	55.8	Low	76 Å²	76	99.1 Å²	99.1	53%	0.531	57%	0.573	S	S	.	*			trans	-68.5	87.1	178.4	65.6	0	0	0	0	112.9	E59 G63	E59-S61 PolarHBondContact O-N 3.02Å; S61-G63 PolarHBondContact O-N 3.49Å
62	A	56.9	Low	57.8	Low	114 Å²	114	99.2 Å²	99.2	94%	0.942	57%	0.568	S	S	*	*	S	Bend	trans	42.5	19.3	147.2	0	0	0	0	0	120.9	P60	P60-A62 PolarHBondContact O-N 3.36Å
63	G	62.7	Low	59.3	Low	45 Å²	45	102.7 Å²	102.7	46%	0.464	58%	0.578	S	S	.	*			trans	-155	14.3	-171.5	0	0	0	0	0	116.6	S61	S61-G63 PolarHBondContact O-N 3.49Å
64	Y	66.1	Low	61.2	Low	130 Å²	130	99.5 Å²	99.5	51%	0.51	56%	0.559	S	S	.	*			trans	-111.4	134.6	179.9	-52.8	-77.6	0	0	0	111.3
65	F	68.9	Low	63	Low	92 Å²	92	104.2 Å²	104.2	40%	0.404	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.9	122.2	176.4	-64.4	-88.9	0	0	0	109.8	F74 E77 L80	F65-F74 PolarHBondContact N-O 2.83Å; F65-F74 PolarHBondContact O-N 3.39Å; F65-E77 HydrophobicContact CD1-CB 4.35Å; F65-E77 HydrophobicContact CD1-CG 4.38Å; F65-E77 HydrophobicContact CD2-CB 4.31Å; F65-E77 VanDerWaalsContact CD2-N 3.34Å; F65-E77 HydrophobicContact CE1-CB 4.07Å; F65-E77 HydrophobicContact CE1-CG 4.17Å; F65-E77 HydrophobicContact CE2-CB 4.04Å; F65-E77 HydrophobicContact CG-CB 4.46Å; F65-E77 HydrophobicContact CZ-CB 3.91Å; F65-E77 HydrophobicContact CZ-CG 4.48Å; F65-L80 HydrophobicContact CB-CB 4.06Å; F65-L80 HydrophobicContact CB-CD2 3.77Å; F65-L80 HydrophobicContact CB-CG 4.49Å
66	N	81.1	Confident	64.8	Low	92 Å²	92	100.3 Å²	100.3	49%	0.492	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	147.7	177.9	61.8	-22.5	0	0	0	112	K72 F73 L80	N66-K72 WeakPolarHBondContact CA-O 3.43Å; N66-F73 HydrophobicContact CB-CD1 4.03Å; N66-F73 HydrophobicContact CB-CE1 4.05Å; N66-L80 WeakPolarHBondContact O-CD2 3.44Å
67	C	79.7	Confident	66.4	Low	1 Å²	1	98.5 Å²	98.5	1%	0.007	54%	0.535	C	S	.	.			trans	-86.6	115.4	168.9	-176.5	0	0	0	0	111.3	H69 C70 N71 K72 F74 L80 H83 H88	C67-H69 PolarHBondContact O-N 3.38Å; C67-C70 PolarHBondContact O-N 2.93Å; C67-N71 WeakPolarHBondContact O-CA 3.41Å; C67-N71 PolarHBondContact O-N 3.43Å; C67-K72 PolarHBondContact N-O 2.78Å; C67-F74 HydrophobicContact CB-CE2 4.22Å; C67-L80 HydrophobicContact CB-CD1 3.67Å; C67-H83 PolarHBondContact SG-NE2 3.06Å; C67-H83 VanDerWaalsContact SG-NE2 3.43Å; C67-H88 VanDerWaalsContact SG-CD2 3.59Å
68	S	74.8	Confident	68	Low	97 Å²	97	96.9 Å²	96.9	68%	0.678	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-21.5	176.8	51.8	0	0	0	0	115.3
69	H	71.5	Confident	69.8	Low	128 Å²	128	93.3 Å²	93.3	59%	0.593	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-10.3	-176.6	-62.4	-70.1	0	0	0	114.7	C67 H88	C67-H69 PolarHBondContact O-N 3.38Å; H69-H88 WeakPolarHBondContact CB-CE1 3.4Å; H69-H88 VanDerWaalsContact CB-ND1 3.34Å; H69-H88 WeakPolarHBondContact CB-ND1 3.5Å; H69-H88 AromaticContact CD2-CG 3.7Å; H69-H88 AromaticContact CG-CG 3.88Å; H69-H88 AromaticContact CG-ND1 3.81Å
70	C	77.3	Confident	71.5	Confident	48 Å²	48	86.9 Å²	86.9	32%	0.324	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.6	7.7	179.5	76.5	0	0	0	0	115.7	C67 K72 H83	C67-C70 PolarHBondContact O-N 2.93Å; C70-K72 PolarHBondContact O-N 3.43Å; C70-H83 VanDerWaalsContact SG-CE1 3.57Å; C70-H83 PolarHBondContact SG-NE2 2.93Å
71	N	74.2	Confident	73.1	Confident	118 Å²	118	87.7 Å²	87.7	63%	0.631	47%	0.471	S	S	*	.			trans	53.2	24.5	176.7	-62.3	-22.3	0	0	0	115.5	C67	C67-N71 WeakPolarHBondContact O-CA 3.41Å; C67-N71 PolarHBondContact O-N 3.43Å
72	K	75.7	Confident	75	Confident	121 Å²	121	89.3 Å²	89.3	53%	0.526	47%	0.47	S	S	.	.			trans	-79.8	135	169.9	-69.7	177.8	-173.6	-63.5	0	110.4	N66 C67 C70 F74	N66-K72 WeakPolarHBondContact CA-O 3.43Å; C67-K72 PolarHBondContact N-O 2.78Å; C70-K72 PolarHBondContact O-N 3.43Å; K72-F74 HydrophobicContact CB-CE2 3.62Å; K72-F74 HydrophobicContact CB-CZ 3.85Å; K72-F74 HydrophobicContact CD-CZ 4.48Å; K72-F74 WeakPolarHBondContact O-CD2 3.34Å; K72-F74 WeakPolarHBondContact O-CE2 3.47Å
73	F	79.6	Confident	76	Confident	148 Å²	148	84.6 Å²	84.6	65%	0.649	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	139	176.3	-60.1	-82.7	0	0	0	111.5	N66	N66-F73 HydrophobicContact CB-CD1 4.03Å; N66-F73 HydrophobicContact CB-CE1 4.05Å
74	F	79.3	Confident	76.5	Confident	40 Å²	40	84.4 Å²	84.4	18%	0.175	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138	179	-63.5	-83.7	0	0	0	110.1	F65 C67 K72 S76 L80 H83	F65-F74 PolarHBondContact N-O 2.83Å; F65-F74 PolarHBondContact O-N 3.39Å; C67-F74 HydrophobicContact CB-CE2 4.22Å; K72-F74 HydrophobicContact CB-CE2 3.62Å; K72-F74 HydrophobicContact CB-CZ 3.85Å; K72-F74 HydrophobicContact CD-CZ 4.48Å; K72-F74 WeakPolarHBondContact O-CD2 3.34Å; K72-F74 WeakPolarHBondContact O-CE2 3.47Å; F74-S76 PolarHBondContact O-N 2.99Å; F74-L80 HydrophobicContact CB-CB 4.28Å; F74-L80 HydrophobicContact CD2-CB 4.29Å; F74-L80 HydrophobicContact CD2-CD1 3.94Å; F74-L80 HydrophobicContact CE2-CD1 4.32Å; F74-L80 HydrophobicContact CG-CB 4.45Å; F74-H83 HydrophobicContact CE1-CB 3.78Å; F74-H83 AromaticContact CE1-CG 3.99Å; F74-H83 HydrophobicContact CE2-CB 3.88Å; F74-H83 AromaticContact CE2-CD2 3.37Å; F74-H83 WeakPolarHBondContact CE2-CD2 3.41Å; F74-H83 AromaticContact CE2-CG 3.53Å; F74-H83 HydrophobicContact CZ-CB 3.44Å; F74-H83 VanDerWaalsContact CZ-CB 3.44Å; F74-H83 AromaticContact CZ-CD2 3.51Å; F74-H83 AromaticContact CZ-CG 3.16Å; F74-H83 AromaticContact CZ-ND1 3.57Å
75	W	75.6	Confident	76.6	Confident	205 Å²	205	81.3 Å²	81.3	78%	0.777	42%	0.417	S	S	*	.	S	Bend	trans	-78	2	-179.2	62.8	-88.2	0	0	0	113.9
76	S	78.8	Confident	76.4	Confident	33 Å²	33	78.9 Å²	78.9	23%	0.231	41%	0.408	C	S	.	.	S	Bend	trans	-154.2	139.9	-177.5	177	0	0	0	0	111	F74 A78 S79 L80	F74-S76 PolarHBondContact O-N 2.99Å; S76-A78 PolarHBondContact O-N 3.12Å; S76-A78 PolarHBondContact OG-N 2.98Å; S76-S79 WeakPolarHBondContact O-CB 3.49Å; S76-S79 PolarHBondContact O-N 3.37Å; S76-L80 PolarHBondContact O-N 3.38Å
77	E	79.8	Confident	75.5	Confident	95 Å²	95	81.4 Å²	81.4	44%	0.444	41%	0.412	S	S	.	.	H	α-helix	trans	-58.6	-34.4	172.9	-162.2	-158.7	167.7	0	0	111.7	F65 S79 L80 K81	F65-E77 HydrophobicContact CD1-CB 4.35Å; F65-E77 HydrophobicContact CD1-CG 4.38Å; F65-E77 HydrophobicContact CD2-CB 4.31Å; F65-E77 VanDerWaalsContact CD2-N 3.34Å; F65-E77 HydrophobicContact CE1-CB 4.07Å; F65-E77 HydrophobicContact CE1-CG 4.17Å; F65-E77 HydrophobicContact CE2-CB 4.04Å; F65-E77 HydrophobicContact CG-CB 4.46Å; F65-E77 HydrophobicContact CZ-CB 3.91Å; F65-E77 HydrophobicContact CZ-CG 4.48Å; E77-S79 VanDerWaalsContact C-N 3.34Å; E77-S79 PolarHBondContact O-N 3.43Å; E77-L80 PolarHBondContact O-N 3.4Å; E77-K81 HydrophobicContact CG-CD 4.36Å; E77-K81 WeakPolarHBondContact O-CB 3.49Å; E77-K81 WeakPolarHBondContact O-CG 3.48Å; E77-K81 PolarHBondContact O-N 2.97Å; E77-K81 WeakPolarHBondContact OE1-CE 3.4Å; E77-K81 IonicContact OE1-NZ 2.68Å; E77-K81 PolarHBondContact OE1-NZ 2.99Å; E77-K81 IonicContact OE2-NZ 2.62Å
78	A	79.6	Confident	74.8	Confident	68 Å²	68	84.6 Å²	84.6	56%	0.562	43%	0.426	S	S	*	.	H	α-helix	trans	-65.8	-37.5	175.5	0	0	0	0	0	111.8	S76 H82	S76-A78 PolarHBondContact O-N 3.12Å; S76-A78 PolarHBondContact OG-N 2.98Å; A78-H82 VanDerWaalsContact O-CB 3.31Å; A78-H82 WeakPolarHBondContact O-CB 3.42Å; A78-H82 PolarHBondContact O-N 2.94Å
79	S	78.7	Confident	74	Confident	33 Å²	33	81.7 Å²	81.7	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-69.8	-39	173.8	-58.4	0	0	0	0	112	S76 E77 H82 H83	S76-S79 WeakPolarHBondContact O-CB 3.49Å; S76-S79 PolarHBondContact O-N 3.37Å; E77-S79 VanDerWaalsContact C-N 3.34Å; E77-S79 PolarHBondContact O-N 3.43Å; S79-H82 PolarHBondContact O-N 3.09Å; S79-H83 VanDerWaalsContact O-CB 3.28Å; S79-H83 WeakPolarHBondContact O-CB 3.44Å; S79-H83 PolarHBondContact O-N 3.32Å
80	L	79.5	Confident	73.1	Confident	32 Å²	32	83.7 Å²	83.7	17%	0.168	42%	0.416	C	S	.	.	H	α-helix	trans	-63.3	-46.7	172.3	174.3	61.7	0	0	0	111.4	F65 N66 C67 F74 S76 E77 H82 H83 S84	F65-L80 HydrophobicContact CB-CB 4.06Å; F65-L80 HydrophobicContact CB-CD2 3.77Å; F65-L80 HydrophobicContact CB-CG 4.49Å; N66-L80 WeakPolarHBondContact O-CD2 3.44Å; C67-L80 HydrophobicContact CB-CD1 3.67Å; F74-L80 HydrophobicContact CB-CB 4.28Å; F74-L80 HydrophobicContact CD2-CB 4.29Å; F74-L80 HydrophobicContact CD2-CD1 3.94Å; F74-L80 HydrophobicContact CE2-CD1 4.32Å; F74-L80 HydrophobicContact CG-CB 4.45Å; S76-L80 PolarHBondContact O-N 3.38Å; E77-L80 PolarHBondContact O-N 3.4Å; L80-H82 PolarHBondContact O-N 2.89Å; L80-H83 PolarHBondContact O-N 3.39Å; L80-S84 WeakPolarHBondContact O-CB 3.45Å; L80-S84 PolarHBondContact O-N 2.91Å
81	K	77.1	Confident	72.1	Confident	126 Å²	126	87 Å²	87	55%	0.548	43%	0.425	S	S	.	.	H	α-helix	trans	-60.8	-42.8	176.6	-80.5	170.8	169.1	164.6	0	111.5	E77 S85	E77-K81 HydrophobicContact CG-CD 4.36Å; E77-K81 WeakPolarHBondContact O-CB 3.49Å; E77-K81 WeakPolarHBondContact O-CG 3.48Å; E77-K81 PolarHBondContact O-N 2.97Å; E77-K81 WeakPolarHBondContact OE1-CE 3.4Å; E77-K81 IonicContact OE1-NZ 2.68Å; E77-K81 PolarHBondContact OE1-NZ 2.99Å; E77-K81 IonicContact OE2-NZ 2.62Å; K81-S85 WeakPolarHBondContact O-CB 3.39Å; K81-S85 PolarHBondContact O-N 3.46Å
82	H	77.6	Confident	71.6	Confident	110 Å²	110	85.4 Å²	85.4	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-42.9	175.3	-174.2	62.3	0	0	0	112.2	A78 S79 L80 S85 L86	A78-H82 VanDerWaalsContact O-CB 3.31Å; A78-H82 WeakPolarHBondContact O-CB 3.42Å; A78-H82 PolarHBondContact O-N 2.94Å; S79-H82 PolarHBondContact O-N 3.09Å; L80-H82 PolarHBondContact O-N 2.89Å; H82-S85 CarbonylContact O-C 3.57Å; H82-S85 PolarHBondContact O-N 3.12Å; H82-L86 WeakPolarHBondContact NE2-CD1 3.5Å; H82-L86 VanDerWaalsContact O-CB 3.28Å; H82-L86 WeakPolarHBondContact O-CB 3.45Å; H82-L86 WeakPolarHBondContact O-CG 3.44Å; H82-L86 PolarHBondContact O-N 3.12Å
83	H	78.8	Confident	71	Confident	14 Å²	14	82 Å²	82	7%	0.065	41%	0.408	C	S	.	.	H	α-helix	trans	-63.9	-47.5	175.6	167	69.6	0	0	0	112.4	C67 C70 F74 S79 L80 S85 L86 Y87 H88	C67-H83 PolarHBondContact SG-NE2 3.06Å; C67-H83 VanDerWaalsContact SG-NE2 3.43Å; C70-H83 VanDerWaalsContact SG-CE1 3.57Å; C70-H83 PolarHBondContact SG-NE2 2.93Å; F74-H83 HydrophobicContact CE1-CB 3.78Å; F74-H83 AromaticContact CE1-CG 3.99Å; F74-H83 HydrophobicContact CE2-CB 3.88Å; F74-H83 AromaticContact CE2-CD2 3.37Å; F74-H83 WeakPolarHBondContact CE2-CD2 3.41Å; F74-H83 AromaticContact CE2-CG 3.53Å; F74-H83 HydrophobicContact CZ-CB 3.44Å; F74-H83 VanDerWaalsContact CZ-CB 3.44Å; F74-H83 AromaticContact CZ-CD2 3.51Å; F74-H83 AromaticContact CZ-CG 3.16Å; F74-H83 AromaticContact CZ-ND1 3.57Å; S79-H83 VanDerWaalsContact O-CB 3.28Å; S79-H83 WeakPolarHBondContact O-CB 3.44Å; S79-H83 PolarHBondContact O-N 3.32Å; L80-H83 PolarHBondContact O-N 3.39Å; H83-S85 VanDerWaalsContact C-N 3.33Å; H83-S85 PolarHBondContact O-N 3.27Å; H83-L86 WeakPolarHBondContact O-CB 3.5Å; H83-L86 PolarHBondContact O-N 3.1Å; H83-Y87 AromaticContact CE1-CD2 3.63Å; H83-Y87 AromaticContact ND1-CD2 3.37Å; H83-Y87 WeakPolarHBondContact ND1-CD2 3.45Å; H83-Y87 AromaticContact ND1-CE2 3.85Å; H83-Y87 WeakPolarHBondContact O-CD2 3.29Å; H83-Y87 PolarHBondContact O-N 3.15Å; H83-H88 AromaticContact NE2-CD2 3.99Å; H83-H88 AromaticContact NE2-NE2 3.72Å
84	S	72.1	Confident	70.6	Confident	42 Å²	42	79.8 Å²	79.8	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-59.7	-45.6	175.1	-168.9	0	0	0	0	110.7	L80 L86 Y87 H88 S89	L80-S84 WeakPolarHBondContact O-CB 3.45Å; L80-S84 PolarHBondContact O-N 2.91Å; S84-L86 PolarHBondContact O-N 3.37Å; S84-Y87 PolarHBondContact O-N 3.31Å; S84-H88 CarbonylContact O-C 3.41Å; S84-H88 WeakPolarHBondContact O-CA 3.48Å; S84-H88 WeakPolarHBondContact O-CB 3.45Å; S84-H88 PolarHBondContact O-N 2.99Å; S84-S89 PolarHBondContact O-N 2.9Å
85	S	68.6	Low	70.6	Confident	64 Å²	64	77.9 Å²	77.9	45%	0.448	39%	0.393	S	S	.	.	H	α-helix	trans	-63.6	-21.4	173.7	-172.8	0	0	0	0	114.3	K81 H82 H83 S89	K81-S85 WeakPolarHBondContact O-CB 3.39Å; K81-S85 PolarHBondContact O-N 3.46Å; H82-S85 CarbonylContact O-C 3.57Å; H82-S85 PolarHBondContact O-N 3.12Å; H83-S85 VanDerWaalsContact C-N 3.33Å; H83-S85 PolarHBondContact O-N 3.27Å; S85-S89 WeakPolarHBondContact O-CB 3.4Å; S85-S89 PolarHBondContact O-OG 3.48Å; S85-S89 VanDerWaalsContact O-OG 3.07Å
86	L	64.5	Low	70.4	Confident	42 Å²	42	74.4 Å²	74.4	22%	0.22	39%	0.386	C	S	.	.	H	α-helix	trans	-89.3	-33.2	-179.6	-93.9	174.8	0	0	0	113.4	H82 H83 S84 R103 F104	H82-L86 WeakPolarHBondContact NE2-CD1 3.5Å; H82-L86 VanDerWaalsContact O-CB 3.28Å; H82-L86 WeakPolarHBondContact O-CB 3.45Å; H82-L86 WeakPolarHBondContact O-CG 3.44Å; H82-L86 PolarHBondContact O-N 3.12Å; H83-L86 WeakPolarHBondContact O-CB 3.5Å; H83-L86 PolarHBondContact O-N 3.1Å; S84-L86 PolarHBondContact O-N 3.37Å; L86-R103 VanDerWaalsContact O-CD 3.22Å; L86-R103 WeakPolarHBondContact O-CD 3.5Å; L86-R103 PolarHBondContact O-NE 2.91Å; L86-R103 PolarHBondContact O-NH1 3.39Å; L86-F104 HydrophobicContact CD2-CE2 3.7Å; L86-F104 HydrophobicContact CD2-CZ 3.49Å; L86-F104 VanDerWaalsContact CD2-CZ 3.49Å; L86-F104 HydrophobicContact CG-CZ 4.4Å
87	Y	62	Low	70.1	Confident	144 Å²	144	76.6 Å²	76.6	57%	0.565	39%	0.394	S	S	*	.	H	α-helix	trans	-118.3	-33.3	-169.6	-69.9	-84	0	0	0	113.5	H83 S84 R103	H83-Y87 AromaticContact CE1-CD2 3.63Å; H83-Y87 AromaticContact ND1-CD2 3.37Å; H83-Y87 WeakPolarHBondContact ND1-CD2 3.45Å; H83-Y87 AromaticContact ND1-CE2 3.85Å; H83-Y87 WeakPolarHBondContact O-CD2 3.29Å; H83-Y87 PolarHBondContact O-N 3.15Å; S84-Y87 PolarHBondContact O-N 3.31Å; Y87-R103 PolarHBondContact O-NH2 3.22Å
88	H	65.8	Low	69.9	Low	69 Å²	69	74.7 Å²	74.7	32%	0.319	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-5.8	-174.1	-55.3	-60.8	0	0	0	113.2	C67 H69 H83 S84	C67-H88 VanDerWaalsContact SG-CD2 3.59Å; H69-H88 WeakPolarHBondContact CB-CE1 3.4Å; H69-H88 VanDerWaalsContact CB-ND1 3.34Å; H69-H88 WeakPolarHBondContact CB-ND1 3.5Å; H69-H88 AromaticContact CD2-CG 3.7Å; H69-H88 AromaticContact CG-CG 3.88Å; H69-H88 AromaticContact CG-ND1 3.81Å; H83-H88 AromaticContact NE2-CD2 3.99Å; H83-H88 AromaticContact NE2-NE2 3.72Å; S84-H88 CarbonylContact O-C 3.41Å; S84-H88 WeakPolarHBondContact O-CA 3.48Å; S84-H88 WeakPolarHBondContact O-CB 3.45Å; S84-H88 PolarHBondContact O-N 2.99Å
89	S	57.6	Low	69.6	Low	36 Å²	36	74 Å²	74	25%	0.252	39%	0.391	S	S	.	.	S	Bend	trans	-69.6	147	169	93.2	0	0	0	0	112.3	S84 S85	S84-S89 PolarHBondContact O-N 2.9Å; S85-S89 WeakPolarHBondContact O-CB 3.4Å; S85-S89 PolarHBondContact O-OG 3.48Å; S85-S89 VanDerWaalsContact O-OG 3.07Å
90	E	52.9	Low	69.4	Low	170 Å²	170	78.5 Å²	78.5	79%	0.794	41%	0.406	S	S	*	.			trans	-59.9	151.3	160.3	-158.5	162.7	-150.6	0	0	110.7	S92	E90-S92 PolarHBondContact O-N 3Å; E90-S92 VanDerWaalsContact O-N 3.14Å
91	K	56.3	Low	69.2	Low	117 Å²	117	78.9 Å²	78.9	51%	0.509	41%	0.413	S	S	.	.			trans	-85.8	80.7	-176.2	-63.7	174.2	-178.5	173.7	0	109.9	F93 A101 F102 R103	K91-F93 VanDerWaalsContact C-N 3.33Å; K91-F93 PolarHBondContact O-N 3.44Å; K91-A101 HydrophobicContact CB-CB 3.51Å; K91-A101 HydrophobicContact CD-CB 4Å; K91-A101 HydrophobicContact CG-CB 4.42Å; K91-F102 CarbonylContact C-O 3.59Å; K91-R103 HydrophobicContact CG-CG 4.33Å
92	S	64	Low	69	Low	85 Å²	85	75 Å²	75	59%	0.594	40%	0.397	S	S	*	.			trans	-67.9	-17.7	-166.4	-44.1	0	0	0	0	116.9	E90	E90-S92 PolarHBondContact O-N 3Å; E90-S92 VanDerWaalsContact O-N 3.14Å
93	F	62.9	Low	68.3	Low	49 Å²	49	74.2 Å²	74.2	22%	0.215	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	87.9	-171.8	-59.8	-65.7	0	0	0	112.2	K91 F102 R105 L108	K91-F93 VanDerWaalsContact C-N 3.33Å; K91-F93 PolarHBondContact O-N 3.44Å; F93-F102 HydrophobicContact CB-CB 4.27Å; F93-F102 WeakPolarHBondContact CB-O 3.44Å; F93-F102 PolarHBondContact N-O 3.12Å; F93-F102 PolarHBondContact O-N 2.96Å; F93-R105 HydrophobicContact CD1-CG 3.59Å; F93-R105 HydrophobicContact CD2-CG 4.31Å; F93-R105 HydrophobicContact CE1-CG 3.36Å; F93-R105 HydrophobicContact CE2-CG 4.09Å; F93-R105 HydrophobicContact CG-CG 4.08Å; F93-R105 HydrophobicContact CZ-CG 3.63Å; F93-L108 HydrophobicContact CB-CB 4.14Å; F93-L108 HydrophobicContact CB-CD2 4.04Å
94	I	72.2	Confident	68	Low	101 Å²	101	77.4 Å²	77.4	52%	0.518	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	136.7	-178.4	-55.9	175.1	0	0	0	110.7	K100 A101	I94-K100 CarbonylContact C-O 3.59Å; I94-A101 HydrophobicContact CG1-CB 4.03Å
95	C	78.1	Confident	68.1	Low	0 Å²	0	82 Å²	82	0%	0	41%	0.414	C	S	.	.			trans	-81.4	113.5	168.9	-173.9	0	0	0	0	110.9	I97 C98 G99 K100 F102 L108 H111	C95-I97 PolarHBondContact O-N 3.36Å; C95-C98 PolarHBondContact O-N 3.07Å; C95-G99 WeakPolarHBondContact O-CA 3.32Å; C95-G99 PolarHBondContact O-N 3.43Å; C95-K100 PolarHBondContact N-O 2.99Å; C95-F102 HydrophobicContact CB-CE2 4.35Å; C95-L108 HydrophobicContact CB-CD1 3.79Å; C95-H111 VanDerWaalsContact SG-CD2 3.55Å; C95-H111 PolarHBondContact SG-NE2 3.05Å
96	E	72.5	Confident	68.4	Low	132 Å²	132	82.5 Å²	82.5	62%	0.617	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.7	176.5	-67	144.1	-111.5	0	0	114.2	R112	E96-R112 IonicContact OE1-CZ 3.85Å; E96-R112 IonicContact OE1-NH2 2.93Å; E96-R112 PolarHBondContact OE1-NH2 3.45Å
97	I	72.5	Confident	68.9	Low	80 Å²	80	83.7 Å²	83.7	41%	0.41	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-22.9	-176.4	-48.3	174.7	0	0	0	112.3	C95 H115 F174	C95-I97 PolarHBondContact O-N 3.36Å; I97-H115 HydrophobicContact CD1-CB 3.66Å; I97-H115 HydrophobicContact CG2-CB 4.26Å; I97-H115 VanDerWaalsContact CG2-ND1 3.32Å; I97-H115 WeakPolarHBondContact CG2-ND1 3.47Å; I97-F174 HydrophobicContact CD1-CZ 4.4Å
98	C	75.5	Confident	69.8	Low	54 Å²	54	77.6 Å²	77.6	37%	0.365	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.2	8.6	-178.3	70.2	0	0	0	0	116.4	C95 K100 H111 H115	C95-C98 PolarHBondContact O-N 3.07Å; C98-K100 PolarHBondContact O-N 3.33Å; C98-K100 VanDerWaalsContact O-N 3.09Å; C98-K100 VanDerWaalsContact SG-CG 3.56Å; C98-H111 PolarHBondContact SG-NE2 3.49Å; C98-H115 PolarHBondContact SG-NE2 3.41Å
99	G	73.3	Confident	70.2	Confident	55 Å²	55	77.3 Å²	77.3	57%	0.567	41%	0.411	S	S	*	.			trans	68.8	0.5	-179.5	0	0	0	0	0	115.6	C95 A101	C95-G99 WeakPolarHBondContact O-CA 3.32Å; C95-G99 PolarHBondContact O-N 3.43Å; G99-A101 PolarHBondContact O-N 2.91Å
100	K	74.4	Confident	71	Confident	127 Å²	127	79.7 Å²	79.7	55%	0.552	42%	0.418	S	S	*	.			trans	-69.1	123.6	-178.3	-73.1	-177.4	-178.6	-176	0	111.4	I94 C95 C98 F102	I94-K100 CarbonylContact C-O 3.59Å; C95-K100 PolarHBondContact N-O 2.99Å; C98-K100 PolarHBondContact O-N 3.33Å; C98-K100 VanDerWaalsContact O-N 3.09Å; C98-K100 VanDerWaalsContact SG-CG 3.56Å; K100-F102 HydrophobicContact CB-CE2 3.68Å; K100-F102 HydrophobicContact CB-CZ 3.98Å; K100-F102 VanDerWaalsContact O-CD2 3.3Å; K100-F102 WeakPolarHBondContact O-CD2 3.37Å; K100-F102 VanDerWaalsContact O-CE2 3.26Å; K100-F102 WeakPolarHBondContact O-CE2 3.29Å
101	A	73.8	Confident	72.2	Confident	39 Å²	39	72.7 Å²	72.7	32%	0.322	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.7	-178.6	0	0	0	0	0	112.2	K91 I94 G99	K91-A101 HydrophobicContact CB-CB 3.51Å; K91-A101 HydrophobicContact CD-CB 4Å; K91-A101 HydrophobicContact CG-CB 4.42Å; I94-A101 HydrophobicContact CG1-CB 4.03Å; G99-A101 PolarHBondContact O-N 2.91Å
102	F	73.7	Confident	73.1	Confident	45 Å²	45	69.7 Å²	69.7	20%	0.197	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	151	-178.3	-62.7	-89	0	0	0	111	K91 F93 C95 K100 N107 L108 H111	K91-F102 CarbonylContact C-O 3.59Å; F93-F102 HydrophobicContact CB-CB 4.27Å; F93-F102 WeakPolarHBondContact CB-O 3.44Å; F93-F102 PolarHBondContact N-O 3.12Å; F93-F102 PolarHBondContact O-N 2.96Å; C95-F102 HydrophobicContact CB-CE2 4.35Å; K100-F102 HydrophobicContact CB-CE2 3.68Å; K100-F102 HydrophobicContact CB-CZ 3.98Å; K100-F102 VanDerWaalsContact O-CD2 3.3Å; K100-F102 WeakPolarHBondContact O-CD2 3.37Å; K100-F102 VanDerWaalsContact O-CE2 3.26Å; K100-F102 WeakPolarHBondContact O-CE2 3.29Å; F102-N107 HydrophobicContact CB-CB 4.34Å; F102-N107 HydrophobicContact CD1-CB 3.92Å; F102-N107 HydrophobicContact CG-CB 4.42Å; F102-L108 HydrophobicContact CB-CB 4.45Å; F102-L108 HydrophobicContact CD2-CB 4.36Å; F102-L108 HydrophobicContact CD2-CD1 3.89Å; F102-L108 HydrophobicContact CE2-CD1 4.32Å; F102-H111 HydrophobicContact CE1-CB 3.99Å; F102-H111 HydrophobicContact CE2-CB 3.87Å; F102-H111 AromaticContact CE2-CD2 3.26Å; F102-H111 WeakPolarHBondContact CE2-CD2 3.47Å; F102-H111 AromaticContact CE2-CG 3.51Å; F102-H111 AromaticContact CE2-NE2 3.88Å; F102-H111 HydrophobicContact CZ-CB 3.5Å; F102-H111 AromaticContact CZ-CD2 3.47Å; F102-H111 VanDerWaalsContact CZ-CD2 3.47Å; F102-H111 WeakPolarHBondContact CZ-CD2 3.36Å; F102-H111 AromaticContact CZ-CG 3.21Å; F102-H111 AromaticContact CZ-ND1 3.65Å; F102-H111 AromaticContact CZ-NE2 3.99Å
103	R	63.4	Low	73.4	Confident	94 Å²	94	66.6 Å²	66.6	36%	0.355	35%	0.349	S	S	.	.	S	Bend	trans	-82.9	-18.6	176.6	-72.3	-176.6	169	148.6	-1.2	113.9	L86 Y87 K91	L86-R103 VanDerWaalsContact O-CD 3.22Å; L86-R103 WeakPolarHBondContact O-CD 3.5Å; L86-R103 PolarHBondContact O-NE 2.91Å; L86-R103 PolarHBondContact O-NH1 3.39Å; Y87-R103 PolarHBondContact O-NH2 3.22Å; K91-R103 HydrophobicContact CG-CG 4.33Å
104	F	71.7	Confident	73.8	Confident	80 Å²	80	67.4 Å²	67.4	35%	0.351	36%	0.358	S	S	.	.	S	Bend	trans	-132.7	142	-177.9	-63.1	-65.1	0	0	0	112.3	L86 S106 N107 L108	L86-F104 HydrophobicContact CD2-CE2 3.7Å; L86-F104 HydrophobicContact CD2-CZ 3.49Å; L86-F104 VanDerWaalsContact CD2-CZ 3.49Å; L86-F104 HydrophobicContact CG-CZ 4.4Å; F104-S106 VanDerWaalsContact C-N 3.26Å; F104-S106 WeakPolarHBondContact CB-OG 3.45Å; F104-S106 PolarHBondContact O-N 2.95Å; F104-N107 HydrophobicContact CB-CB 4.48Å; F104-N107 PolarHBondContact O-N 3.36Å; F104-N107 VanDerWaalsContact O-N 3.12Å; F104-L108 PolarHBondContact O-N 3.08Å; F104-L108 VanDerWaalsContact O-N 3.15Å
105	R	74.6	Confident	73.9	Confident	139 Å²	139	65.8 Å²	65.8	53%	0.525	35%	0.348	S	S	.	.	H	α-helix	trans	-58.2	-35.8	173.3	-80.1	-170.7	156	116.5	-4	112.9	F93 N107 L108 A109	F93-R105 HydrophobicContact CD1-CG 3.59Å; F93-R105 HydrophobicContact CD2-CG 4.31Å; F93-R105 HydrophobicContact CE1-CG 3.36Å; F93-R105 HydrophobicContact CE2-CG 4.09Å; F93-R105 HydrophobicContact CG-CG 4.08Å; F93-R105 HydrophobicContact CZ-CG 3.63Å; R105-N107 VanDerWaalsContact C-N 3.3Å; R105-N107 PolarHBondContact O-N 3.22Å; R105-L108 PolarHBondContact O-N 3.31Å; R105-A109 WeakPolarHBondContact O-CB 3.42Å; R105-A109 PolarHBondContact O-N 2.91Å
106	S	75.2	Confident	73.1	Confident	75 Å²	75	68.7 Å²	68.7	52%	0.524	37%	0.366	S	S	.	.	H	α-helix	trans	-54.9	-46.6	173.7	47.8	0	0	0	0	111.8	F104 A109 E110	F104-S106 VanDerWaalsContact C-N 3.26Å; F104-S106 WeakPolarHBondContact CB-OG 3.45Å; F104-S106 PolarHBondContact O-N 2.95Å; S106-A109 PolarHBondContact O-N 3.42Å; S106-E110 WeakPolarHBondContact O-CB 3.4Å; S106-E110 PolarHBondContact O-N 2.97Å
107	N	75.5	Confident	72.6	Confident	66 Å²	66	66.4 Å²	66.4	35%	0.353	36%	0.364	S	S	.	.	H	α-helix	trans	-73.9	-33.4	-175.7	-59.2	32.8	0	0	0	110.8	F102 F104 R105 H111	F102-N107 HydrophobicContact CB-CB 4.34Å; F102-N107 HydrophobicContact CD1-CB 3.92Å; F102-N107 HydrophobicContact CG-CB 4.42Å; F104-N107 HydrophobicContact CB-CB 4.48Å; F104-N107 PolarHBondContact O-N 3.36Å; F104-N107 VanDerWaalsContact O-N 3.12Å; R105-N107 VanDerWaalsContact C-N 3.3Å; R105-N107 PolarHBondContact O-N 3.22Å; N107-H111 WeakPolarHBondContact O-CB 3.38Å; N107-H111 PolarHBondContact O-N 3.14Å
108	L	78.8	Confident	72.1	Confident	16 Å²	16	67.6 Å²	67.6	8%	0.084	37%	0.371	C	S	.	.	H	α-helix	trans	-64.3	-43.9	170.1	179.5	67.8	0	0	0	111.5	F93 C95 F102 F104 R105 H111 R112	F93-L108 HydrophobicContact CB-CB 4.14Å; F93-L108 HydrophobicContact CB-CD2 4.04Å; C95-L108 HydrophobicContact CB-CD1 3.79Å; F102-L108 HydrophobicContact CB-CB 4.45Å; F102-L108 HydrophobicContact CD2-CB 4.36Å; F102-L108 HydrophobicContact CD2-CD1 3.89Å; F102-L108 HydrophobicContact CE2-CD1 4.32Å; F104-L108 PolarHBondContact O-N 3.08Å; F104-L108 VanDerWaalsContact O-N 3.15Å; R105-L108 PolarHBondContact O-N 3.31Å; L108-H111 PolarHBondContact O-N 2.97Å; L108-R112 WeakPolarHBondContact O-CG 3.46Å; L108-R112 PolarHBondContact O-N 3.34Å
109	A	75.3	Confident	71.9	Confident	63 Å²	63	70 Å²	70	52%	0.521	38%	0.375	S	S	.	.	H	α-helix	trans	-66	-43.7	179.1	0	0	0	0	0	112.1	R105 S106 H111 R112 S113	R105-A109 WeakPolarHBondContact O-CB 3.42Å; R105-A109 PolarHBondContact O-N 2.91Å; S106-A109 PolarHBondContact O-N 3.42Å; A109-H111 VanDerWaalsContact C-N 3.34Å; A109-R112 PolarHBondContact O-N 2.91Å; A109-S113 PolarHBondContact O-N 3.24Å
110	E	74	Confident	71.9	Confident	86 Å²	86	69 Å²	69	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-56.8	-46.4	169.6	165.1	167.3	-163.4	0	0	111.4	S106 S113 L132	S106-E110 WeakPolarHBondContact O-CB 3.4Å; S106-E110 PolarHBondContact O-N 2.97Å; E110-S113 VanDerWaalsContact O-CB 3.29Å; E110-S113 WeakPolarHBondContact O-CB 3.44Å; E110-S113 PolarHBondContact O-N 3.35Å; E110-S113 VanDerWaalsContact O-N 3.13Å; E110-S113 PolarHBondContact O-OG 3.45Å; E110-L132 VanDerWaalsContact CD-CD2 3.48Å; E110-L132 HydrophobicContact CG-CD1 4.5Å; E110-L132 HydrophobicContact CG-CD2 3.82Å; E110-L132 HydrophobicContact CG-CG 4.44Å; E110-L132 WeakPolarHBondContact OE1-CD1 3.44Å; E110-L132 WeakPolarHBondContact OE1-CD2 3.46Å
111	H	79.4	Confident	71.9	Confident	23 Å²	23	65.9 Å²	65.9	11%	0.106	34%	0.344	C	S	.	.	H	α-helix	trans	-65.7	-37.9	178	173.7	65	0	0	0	113.5	C95 C98 F102 N107 L108 A109 S113 V114 H115	C95-H111 VanDerWaalsContact SG-CD2 3.55Å; C95-H111 PolarHBondContact SG-NE2 3.05Å; C98-H111 PolarHBondContact SG-NE2 3.49Å; F102-H111 HydrophobicContact CE1-CB 3.99Å; F102-H111 HydrophobicContact CE2-CB 3.87Å; F102-H111 AromaticContact CE2-CD2 3.26Å; F102-H111 WeakPolarHBondContact CE2-CD2 3.47Å; F102-H111 AromaticContact CE2-CG 3.51Å; F102-H111 AromaticContact CE2-NE2 3.88Å; F102-H111 HydrophobicContact CZ-CB 3.5Å; F102-H111 AromaticContact CZ-CD2 3.47Å; F102-H111 VanDerWaalsContact CZ-CD2 3.47Å; F102-H111 WeakPolarHBondContact CZ-CD2 3.36Å; F102-H111 AromaticContact CZ-CG 3.21Å; F102-H111 AromaticContact CZ-ND1 3.65Å; F102-H111 AromaticContact CZ-NE2 3.99Å; N107-H111 WeakPolarHBondContact O-CB 3.38Å; N107-H111 PolarHBondContact O-N 3.14Å; L108-H111 PolarHBondContact O-N 2.97Å; A109-H111 VanDerWaalsContact C-N 3.34Å; H111-S113 PolarHBondContact O-N 3.07Å; H111-S113 VanDerWaalsContact O-N 3.14Å; H111-V114 VanDerWaalsContact O-CB 3.26Å; H111-V114 WeakPolarHBondContact O-CB 3.17Å; H111-V114 PolarHBondContact O-N 3.13Å; H111-H115 AromaticContact CE1-CD2 3.93Å; H111-H115 AromaticContact CE1-NE2 3.53Å; H111-H115 AromaticContact NE2-CD2 3.64Å; H111-H115 AromaticContact NE2-NE2 3.3Å; H111-H115 PolarHBondContact NE2-NE2 2.95Å
112	R	73.6	Confident	72.2	Confident	55 Å²	55	64.5 Å²	64.5	21%	0.208	33%	0.332	C	S	.	.	H	α-helix	trans	-58	-24.9	172.8	-78.4	179.1	171.4	173.8	-1.9	112.1	E96 L108 A109 V114 H115 T116 E185	E96-R112 IonicContact OE1-CZ 3.85Å; E96-R112 IonicContact OE1-NH2 2.93Å; E96-R112 PolarHBondContact OE1-NH2 3.45Å; L108-R112 WeakPolarHBondContact O-CG 3.46Å; L108-R112 PolarHBondContact O-N 3.34Å; A109-R112 PolarHBondContact O-N 2.91Å; R112-V114 VanDerWaalsContact C-N 3.29Å; R112-V114 PolarHBondContact O-N 2.72Å; R112-H115 PolarHBondContact O-N 3.48Å; R112-T116 PolarHBondContact O-N 3.29Å; R112-T116 PolarHBondContact O-OG1 3.48Å; R112-T116 VanDerWaalsContact O-OG1 3.1Å; R112-E185 IonicContact NH1-OE2 3.6Å
113	S	70	Confident	72.5	Confident	19 Å²	19	62.4 Å²	62.4	13%	0.133	32%	0.322	C	S	.	.	H	α-helix	trans	-69.8	-20.5	172.4	83	0	0	0	0	114.3	A109 E110 H111	A109-S113 PolarHBondContact O-N 3.24Å; E110-S113 VanDerWaalsContact O-CB 3.29Å; E110-S113 WeakPolarHBondContact O-CB 3.44Å; E110-S113 PolarHBondContact O-N 3.35Å; E110-S113 VanDerWaalsContact O-N 3.13Å; E110-S113 PolarHBondContact O-OG 3.45Å; H111-S113 PolarHBondContact O-N 3.07Å; H111-S113 VanDerWaalsContact O-N 3.14Å
114	V	72.7	Confident	73.2	Confident	66 Å²	66	65.3 Å²	65.3	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-71.8	-45.4	175.2	-177.5	0	0	0	0	110	H111 R112 S117	H111-V114 VanDerWaalsContact O-CB 3.26Å; H111-V114 WeakPolarHBondContact O-CB 3.17Å; H111-V114 PolarHBondContact O-N 3.13Å; R112-V114 VanDerWaalsContact C-N 3.29Å; R112-V114 PolarHBondContact O-N 2.72Å; V114-S117 PolarHBondContact O-N 2.89Å
115	H	72.8	Confident	73.4	Confident	67 Å²	67	64.9 Å²	64.9	31%	0.31	33%	0.332	S	S	.	.	H	α-helix	trans	-66.7	-45.4	180	-76.1	-67.9	0	0	0	113.4	I97 C98 H111 R112 S117	I97-H115 HydrophobicContact CD1-CB 3.66Å; I97-H115 HydrophobicContact CG2-CB 4.26Å; I97-H115 VanDerWaalsContact CG2-ND1 3.32Å; I97-H115 WeakPolarHBondContact CG2-ND1 3.47Å; C98-H115 PolarHBondContact SG-NE2 3.41Å; H111-H115 AromaticContact CE1-CD2 3.93Å; H111-H115 AromaticContact CE1-NE2 3.53Å; H111-H115 AromaticContact NE2-CD2 3.64Å; H111-H115 AromaticContact NE2-NE2 3.3Å; H111-H115 PolarHBondContact NE2-NE2 2.95Å; R112-H115 PolarHBondContact O-N 3.48Å; H115-S117 PolarHBondContact O-N 3.47Å; H115-S117 VanDerWaalsContact O-N 3.17Å
116	T	62.5	Low	73.7	Confident	61 Å²	61	61.4 Å²	61.4	37%	0.374	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-9.3	-178.4	50.1	0	0	0	0	113.4	R112 L118	R112-T116 PolarHBondContact O-N 3.29Å; R112-T116 PolarHBondContact O-OG1 3.48Å; R112-T116 VanDerWaalsContact O-OG1 3.1Å; T116-L118 PolarHBondContact O-N 2.92Å
117	S	61.9	Low	73.9	Confident	84 Å²	84	60 Å²	60	59%	0.587	33%	0.326	S	S	*	.			trans	54	7.4	-172.9	-68.3	0	0	0	0	115.3	V114 H115 K119	V114-S117 PolarHBondContact O-N 2.89Å; H115-S117 PolarHBondContact O-N 3.47Å; H115-S117 VanDerWaalsContact O-N 3.17Å; S117-K119 PolarHBondContact O-N 3.14Å
118	L	62.8	Low	74.1	Confident	105 Å²	105	62.7 Å²	62.7	55%	0.55	33%	0.334	S	S	.	.			trans	-70.5	126.4	177.8	-65.9	174.7	0	0	0	108.9	T116 P120	T116-L118 PolarHBondContact O-N 2.92Å; L118-P120 VanDerWaalsContact C-CD 3.43Å; L118-P120 WeakPolarHBondContact O-CD 3.27Å
119	K	70.3	Confident	74.2	Confident	104 Å²	104	63.7 Å²	63.7	45%	0.452	34%	0.342	S	S	.	.			trans	-103.4	82.2	166.7	-65.7	177.8	177.1	-177.1	0	107.3	S117 Y121 S129 S130 R131	S117-K119 PolarHBondContact O-N 3.14Å; K119-Y121 VanDerWaalsContact C-N 3.29Å; K119-Y121 PolarHBondContact O-N 3.14Å; K119-S129 VanDerWaalsContact CD-OG 3.32Å; K119-S129 WeakPolarHBondContact CD-OG 3.49Å; K119-S130 CarbonylContact C-O 3.59Å; K119-S130 WeakPolarHBondContact CA-O 3.25Å; K119-R131 HydrophobicContact CG-CG 4.1Å
120	P	72.5	Confident	74.2	Confident	34 Å²	34	61.6 Å²	61.6	22%	0.221	32%	0.324	C	S	.	.			trans	-68.7	-27.8	-170.4	26.6	-35	0	0	0	112.7	L118 I159 K160	L118-P120 VanDerWaalsContact C-CD 3.43Å; L118-P120 WeakPolarHBondContact O-CD 3.27Å; P120-I159 CarbonylContact O-C 3.45Å; P120-I159 WeakPolarHBondContact O-CA 3.22Å; P120-K160 PolarHBondContact O-N 2.95Å
121	Y	75.6	Confident	74.4	Confident	62 Å²	62	62.1 Å²	62.1	24%	0.243	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.4	-178.8	-53.4	-74.2	0	0	0	110.5	K119 S129 S130 R131 L132 K133 I157 I159	K119-Y121 VanDerWaalsContact C-N 3.29Å; K119-Y121 PolarHBondContact O-N 3.14Å; Y121-S129 CarbonylContact O-C 3.59Å; Y121-S129 VanDerWaalsContact O-CA 3.23Å; Y121-S129 WeakPolarHBondContact O-CA 3.4Å; Y121-S130 PolarHBondContact N-O 2.89Å; Y121-S130 PolarHBondContact O-N 3.09Å; Y121-R131 WeakPolarHBondContact CD2-O 3.37Å; Y121-R131 WeakPolarHBondContact CE2-O 3.38Å; Y121-L132 VanDerWaalsContact CD2-C 3.44Å; Y121-K133 HydrophobicContact CD1-CB 4.17Å; Y121-K133 HydrophobicContact CD1-CG 4.42Å; Y121-K133 HydrophobicContact CD2-CB 4.34Å; Y121-K133 VanDerWaalsContact CD2-N 3.31Å; Y121-K133 HydrophobicContact CE1-CB 3.91Å; Y121-K133 HydrophobicContact CE1-CG 4.29Å; Y121-K133 HydrophobicContact CE2-CB 4.09Å; Y121-K133 HydrophobicContact CG-CB 4.38Å; Y121-I157 HydrophobicContact CD1-CG2 3.7Å; Y121-I157 HydrophobicContact CG-CG2 4.44Å; Y121-I159 HydrophobicContact CD1-CG1 4.18Å; Y121-I159 HydrophobicContact CE1-CD1 4.39Å; Y121-I159 HydrophobicContact CE1-CG1 4.23Å
122	V	79	Confident	74.2	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.067	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.3	179.9	-174.7	0	0	0	0	110	G127 L136 I158 K160	V122-G127 WeakPolarHBondContact CG1-O 3.42Å; V122-L136 VanDerWaalsContact C-CD2 3.48Å; V122-I158 HydrophobicContact CB-CB 4.18Å; V122-I158 PolarHBondContact N-O 3.44Å; V122-I158 PolarHBondContact O-N 3.37Å; V122-K160 HydrophobicContact CG2-CD 3.68Å; V122-K160 HydrophobicContact CG2-CG 3.97Å; V122-K160 VanDerWaalsContact CG2-NZ 3.34Å
123	C	80.3	Confident	74.5	Confident	1 Å²	1	66 Å²	66	1%	0.007	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	126.4	175.5	176.7	0	0	0	0	109.4	F125 C126 G127 K128 L136 I140 H144	C123-F125 VanDerWaalsContact C-N 3.34Å; C123-F125 PolarHBondContact O-N 3.13Å; C123-F125 PolarHBondContact SG-N 3.43Å; C123-C126 VanDerWaalsContact SG-SG 3.68Å; C123-G127 VanDerWaalsContact O-CA 3.29Å; C123-G127 WeakPolarHBondContact O-CA 3.2Å; C123-G127 PolarHBondContact O-N 3.35Å; C123-K128 PolarHBondContact N-O 3.06Å; C123-L136 HydrophobicContact CB-CD1 3.79Å; C123-L136 HydrophobicContact CB-CG 4.39Å; C123-I140 HydrophobicContact CB-CG1 4.5Å; C123-H144 PolarHBondContact SG-CD2 2.67Å; C123-H144 PolarHBondContact SG-NE2 3.42Å
124	R	78.6	Confident	74.9	Confident	155 Å²	155	67 Å²	67	59%	0.585	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-38.2	177.2	-175.7	168	176.8	172.1	-3.9	113.5	D155 D156 I158	R124-D155 VanDerWaalsContact CD-O 3.24Å; R124-D155 WeakPolarHBondContact CD-O 3.39Å; R124-D155 PolarHBondContact NH1-O 3.02Å; R124-D156 PolarHBondContact N-O 2.91Å; R124-I158 HydrophobicContact CB-CD1 4.21Å; R124-I158 HydrophobicContact CB-CG1 4.47Å; R124-I158 HydrophobicContact CG-CD1 4.34Å
125	F	76.1	Confident	75.4	Confident	71 Å²	71	67 Å²	67	31%	0.311	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-28.1	-174	-57.5	-78.2	0	0	0	114.9	C123 I140 H144 E147 Q148 D156	C123-F125 VanDerWaalsContact C-N 3.34Å; C123-F125 PolarHBondContact O-N 3.13Å; C123-F125 PolarHBondContact SG-N 3.43Å; F125-I140 HydrophobicContact CE2-CG2 4.33Å; F125-H144 HydrophobicContact CD2-CB 4.07Å; F125-H144 AromaticContact CD2-CD2 3.78Å; F125-H144 AromaticContact CD2-CG 3.91Å; F125-H144 HydrophobicContact CG-CB 4.23Å; F125-H144 AromaticContact CG-CG 3.89Å; F125-E147 WeakPolarHBondContact CD1-OE2 3.4Å; F125-E147 HydrophobicContact CE1-CB 4.39Å; F125-E147 WeakPolarHBondContact CE1-OE2 3.09Å; F125-Q148 HydrophobicContact CE2-CG 4.41Å; F125-Q148 HydrophobicContact CZ-CG 4.15Å; F125-D156 HydrophobicContact CE2-CB 4.1Å
126	C	81.7	Confident	75.9	Confident	65 Å²	65	63.8 Å²	63.8	44%	0.439	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	2.9	-175	70	0	0	0	0	115.4	C123 K128 H139	C123-C126 VanDerWaalsContact SG-SG 3.68Å; C126-K128 PolarHBondContact O-N 2.95Å; C126-K128 VanDerWaalsContact SG-CB 3.5Å; C126-H139 PolarHBondContact SG-NE2 2.95Å
127	G	78.3	Confident	76.7	Confident	47 Å²	47	63.2 Å²	63.2	49%	0.485	34%	0.335	S	S	.	.			trans	67.8	-1.5	-177.9	0	0	0	0	0	115.9	V122 C123 S129	V122-G127 WeakPolarHBondContact CG1-O 3.42Å; C123-G127 VanDerWaalsContact O-CA 3.29Å; C123-G127 WeakPolarHBondContact O-CA 3.2Å; C123-G127 PolarHBondContact O-N 3.35Å; G127-S129 PolarHBondContact O-N 2.94Å
128	K	81	Confident	77.7	Confident	121 Å²	121	65.5 Å²	65.5	53%	0.526	33%	0.334	S	S	.	.			trans	-60.2	131.1	177.9	-165.8	172.1	-171.5	173.8	0	109.6	C123 C126 L136	C123-K128 PolarHBondContact N-O 3.06Å; C126-K128 PolarHBondContact O-N 2.95Å; C126-K128 VanDerWaalsContact SG-CB 3.5Å; K128-L136 WeakPolarHBondContact O-CD1 3.17Å
129	S	79.7	Confident	78.7	Confident	37 Å²	37	61.4 Å²	61.4	26%	0.259	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	145.3	-175.4	59.9	0	0	0	0	112.3	K119 Y121 G127	K119-S129 VanDerWaalsContact CD-OG 3.32Å; K119-S129 WeakPolarHBondContact CD-OG 3.49Å; Y121-S129 CarbonylContact O-C 3.59Å; Y121-S129 VanDerWaalsContact O-CA 3.23Å; Y121-S129 WeakPolarHBondContact O-CA 3.4Å; G127-S129 PolarHBondContact O-N 2.94Å
130	S	76.7	Confident	79.2	Confident	19 Å²	19	56.5 Å²	56.5	13%	0.133	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	146.1	-176.4	-59.2	0	0	0	0	110.9	K119 Y121 L132	K119-S130 CarbonylContact C-O 3.59Å; K119-S130 WeakPolarHBondContact CA-O 3.25Å; Y121-S130 PolarHBondContact N-O 2.89Å; Y121-S130 PolarHBondContact O-N 3.09Å; S130-L132 WeakPolarHBondContact CB-O 3.5Å
131	R	76.3	Confident	79.6	Confident	97 Å²	97	59.8 Å²	59.8	37%	0.366	31%	0.306	S	S	.	.	S	Bend	trans	-66.4	-31.3	169.3	-70.2	-176	174.9	143.7	-4	111.6	K119 Y121	K119-R131 HydrophobicContact CG-CG 4.1Å; Y121-R131 WeakPolarHBondContact CD2-O 3.37Å; Y121-R131 WeakPolarHBondContact CE2-O 3.38Å
132	L	76.5	Confident	79.9	Confident	49 Å²	49	64.6 Å²	64.6	26%	0.257	33%	0.328	S	S	.	.	S	Bend	trans	-116.7	137.4	-172.1	-80.6	155.2	0	0	0	113	E110 Y121 S130 N135 L136	E110-L132 VanDerWaalsContact CD-CD2 3.48Å; E110-L132 HydrophobicContact CG-CD1 4.5Å; E110-L132 HydrophobicContact CG-CD2 3.82Å; E110-L132 HydrophobicContact CG-CG 4.44Å; E110-L132 WeakPolarHBondContact OE1-CD1 3.44Å; E110-L132 WeakPolarHBondContact OE1-CD2 3.46Å; Y121-L132 VanDerWaalsContact CD2-C 3.44Å; S130-L132 WeakPolarHBondContact CB-O 3.5Å; L132-N135 HydrophobicContact CB-CB 4.13Å; L132-N135 PolarHBondContact O-N 3.03Å; L132-L136 PolarHBondContact O-N 3.36Å
133	K	80.1	Confident	80	Confident	112 Å²	112	70.1 Å²	70.1	49%	0.487	35%	0.353	S	S	.	.	H	α-helix	trans	-59.6	-47.6	173.5	-171.6	-177.5	177.5	-173.5	0	110.9	Y121 N135 L136 T137 I157	Y121-K133 HydrophobicContact CD1-CB 4.17Å; Y121-K133 HydrophobicContact CD1-CG 4.42Å; Y121-K133 HydrophobicContact CD2-CB 4.34Å; Y121-K133 VanDerWaalsContact CD2-N 3.31Å; Y121-K133 HydrophobicContact CE1-CB 3.91Å; Y121-K133 HydrophobicContact CE1-CG 4.29Å; Y121-K133 HydrophobicContact CE2-CB 4.09Å; Y121-K133 HydrophobicContact CG-CB 4.38Å; K133-N135 VanDerWaalsContact C-N 3.3Å; K133-N135 PolarHBondContact O-N 3.22Å; K133-L136 WeakPolarHBondContact O-CA 3.49Å; K133-L136 WeakPolarHBondContact O-CB 3.26Å; K133-L136 PolarHBondContact O-N 3.48Å; K133-T137 PolarHBondContact O-N 3.46Å; K133-T137 PolarHBondContact O-OG1 3.34Å; K133-T137 VanDerWaalsContact O-OG1 3.06Å; K133-I157 HydrophobicContact CG-CD1 4.1Å
134	G	78.6	Confident	79.9	Confident	40 Å²	40	71.4 Å²	71.4	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-59.7	-36.2	-179.6	0	0	0	0	0	113.8	T137 K138	G134-T137 PolarHBondContact O-N 2.9Å; G134-K138 WeakPolarHBondContact O-CB 3.37Å; G134-K138 VanDerWaalsContact O-CG 3.31Å; G134-K138 WeakPolarHBondContact O-CG 3.25Å; G134-K138 PolarHBondContact O-N 2.95Å
135	N	82	Confident	79.3	Confident	65 Å²	65	70.6 Å²	70.6	35%	0.348	36%	0.36	S	S	.	.	H	α-helix	trans	-71.9	-32.5	176	-70.1	1.9	0	0	0	111.6	L132 K133 H139	L132-N135 HydrophobicContact CB-CB 4.13Å; L132-N135 PolarHBondContact O-N 3.03Å; K133-N135 VanDerWaalsContact C-N 3.3Å; K133-N135 PolarHBondContact O-N 3.22Å; N135-H139 WeakPolarHBondContact O-CB 3.43Å; N135-H139 PolarHBondContact O-N 3.27Å
136	L	83.4	Confident	78.4	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-69.6	-42.3	171.6	-160.5	74	0	0	0	112.2	V122 C123 K128 L132 K133 K138 H139 I140 I157	V122-L136 VanDerWaalsContact C-CD2 3.48Å; C123-L136 HydrophobicContact CB-CD1 3.79Å; C123-L136 HydrophobicContact CB-CG 4.39Å; K128-L136 WeakPolarHBondContact O-CD1 3.17Å; L132-L136 PolarHBondContact O-N 3.36Å; K133-L136 WeakPolarHBondContact O-CA 3.49Å; K133-L136 WeakPolarHBondContact O-CB 3.26Å; K133-L136 PolarHBondContact O-N 3.48Å; L136-K138 PolarHBondContact O-N 2.88Å; L136-H139 WeakPolarHBondContact O-CB 3.4Å; L136-H139 PolarHBondContact O-N 3.42Å; L136-H139 VanDerWaalsContact O-N 3.12Å; L136-I140 HydrophobicContact CD2-CD1 4.43Å; L136-I140 HydrophobicContact CG-CD1 4.22Å; L136-I140 WeakPolarHBondContact O-CG1 3.44Å; L136-I140 PolarHBondContact O-N 2.98Å; L136-I157 HydrophobicContact CD2-CB 4.15Å; L136-I157 HydrophobicContact CD2-CG1 3.94Å; L136-I157 HydrophobicContact CD2-CG2 3.8Å
137	T	80.1	Confident	77.2	Confident	48 Å²	48	82.3 Å²	82.3	29%	0.294	40%	0.399	S	S	.	.	H	α-helix	trans	-58.5	-46	174	-54.3	0	0	0	0	111	K133 G134 H139 I140 L141 I152	K133-T137 PolarHBondContact O-N 3.46Å; K133-T137 PolarHBondContact O-OG1 3.34Å; K133-T137 VanDerWaalsContact O-OG1 3.06Å; G134-T137 PolarHBondContact O-N 2.9Å; T137-H139 VanDerWaalsContact C-N 3.34Å; T137-H139 PolarHBondContact O-N 3.15Å; T137-I140 PolarHBondContact O-N 3.48Å; T137-L141 WeakPolarHBondContact O-CB 3.42Å; T137-L141 PolarHBondContact O-N 3.43Å; T137-I152 HydrophobicContact CG2-CD1 3.48Å; T137-I152 VanDerWaalsContact CG2-CD1 3.48Å
138	K	81.9	Confident	76	Confident	132 Å²	132	81.7 Å²	81.7	57%	0.574	38%	0.383	S	S	*	.	H	α-helix	trans	-60.1	-41.1	172.3	-73.5	171.8	-177.8	174.3	0	112.2	G134 L136 K142	G134-K138 WeakPolarHBondContact O-CB 3.37Å; G134-K138 VanDerWaalsContact O-CG 3.31Å; G134-K138 WeakPolarHBondContact O-CG 3.25Å; G134-K138 PolarHBondContact O-N 2.95Å; L136-K138 PolarHBondContact O-N 2.88Å; K138-K142 WeakPolarHBondContact O-CB 3.4Å; K138-K142 WeakPolarHBondContact O-CG 3.32Å; K138-K142 PolarHBondContact O-N 3.45Å
139	H	83.8	Confident	74.3	Confident	19 Å²	19	83 Å²	83	9%	0.088	40%	0.396	C	S	.	.	H	α-helix	trans	-64.2	-46.4	177.6	163.7	68.5	0	0	0	111.9	C126 N135 L136 T137 K142 H143 H144	C126-H139 PolarHBondContact SG-NE2 2.95Å; N135-H139 WeakPolarHBondContact O-CB 3.43Å; N135-H139 PolarHBondContact O-N 3.27Å; L136-H139 WeakPolarHBondContact O-CB 3.4Å; L136-H139 PolarHBondContact O-N 3.42Å; L136-H139 VanDerWaalsContact O-N 3.12Å; T137-H139 VanDerWaalsContact C-N 3.34Å; T137-H139 PolarHBondContact O-N 3.15Å; H139-K142 PolarHBondContact O-N 3.08Å; H139-H143 AromaticContact CE1-CD2 3.6Å; H139-H143 AromaticContact CE1-CG 3.8Å; H139-H143 AromaticContact ND1-CD2 3.24Å; H139-H143 PolarHBondContact ND1-CD2 3.22Å; H139-H143 AromaticContact ND1-CG 3.9Å; H139-H143 AromaticContact ND1-NE2 3.95Å; H139-H143 PolarHBondContact O-N 3.23Å; H139-H144 AromaticContact CE1-NE2 3.74Å; H139-H144 AromaticContact NE2-CD2 3.89Å; H139-H144 AromaticContact NE2-NE2 3.19Å; H139-H144 PolarHBondContact NE2-NE2 3.43Å; H139-H144 VanDerWaalsContact NE2-NE2 3.19Å
140	I	81.7	Confident	73	Confident	1 Å²	1	85.8 Å²	85.8	1%	0.005	42%	0.421	C	S	.	.	H	α-helix	trans	-61.4	-47.9	177	-64.4	164.2	0	0	0	110.1	C123 F125 L136 T137 K142 H143 H144 Q148 I152 D156 I157	C123-I140 HydrophobicContact CB-CG1 4.5Å; F125-I140 HydrophobicContact CE2-CG2 4.33Å; L136-I140 HydrophobicContact CD2-CD1 4.43Å; L136-I140 HydrophobicContact CG-CD1 4.22Å; L136-I140 WeakPolarHBondContact O-CG1 3.44Å; L136-I140 PolarHBondContact O-N 2.98Å; T137-I140 PolarHBondContact O-N 3.48Å; I140-K142 VanDerWaalsContact C-N 3.28Å; I140-K142 PolarHBondContact O-N 3.19Å; I140-H143 PolarHBondContact O-N 3.41Å; I140-H144 HydrophobicContact CG2-CB 4.28Å; I140-H144 WeakPolarHBondContact O-CA 3.38Å; I140-H144 PolarHBondContact O-N 3.43Å; I140-Q148 VanDerWaalsContact CG2-OE1 3.3Å; I140-I152 HydrophobicContact CB-CD1 4.19Å; I140-I152 HydrophobicContact CD1-CG2 3.97Å; I140-I152 HydrophobicContact CG2-CD1 4.12Å; I140-I152 HydrophobicContact CG2-CG1 3.95Å; I140-I152 HydrophobicContact CG2-CG2 4.49Å; I140-D156 HydrophobicContact CD1-CB 4.25Å; I140-I157 HydrophobicContact CD1-CG1 4.07Å
141	L	81.3	Confident	72	Confident	103 Å²	103	91.2 Å²	91.2	54%	0.539	44%	0.442	S	S	.	.	H	α-helix	trans	-64	-27.7	178.8	-172.2	63.8	0	0	0	114	T137 K145 I152	T137-L141 WeakPolarHBondContact O-CB 3.42Å; T137-L141 PolarHBondContact O-N 3.43Å; L141-K145 WeakPolarHBondContact O-CB 3.4Å; L141-K145 WeakPolarHBondContact O-CD 3.49Å; L141-K145 VanDerWaalsContact O-CG 3.29Å; L141-K145 WeakPolarHBondContact O-CG 3.44Å; L141-I152 HydrophobicContact CB-CD1 4.37Å
142	K	81.7	Confident	71.2	Confident	163 Å²	163	88.7 Å²	88.7	71%	0.709	44%	0.435	S	S	*	.	H	α-helix	trans	-85.5	-44.9	177	-77.8	-174.8	174.8	-172.2	0	113.1	K138 H139 I140	K138-K142 WeakPolarHBondContact O-CB 3.4Å; K138-K142 WeakPolarHBondContact O-CG 3.32Å; K138-K142 PolarHBondContact O-N 3.45Å; H139-K142 PolarHBondContact O-N 3.08Å; I140-K142 VanDerWaalsContact C-N 3.28Å; I140-K142 PolarHBondContact O-N 3.19Å
143	H	79.7	Confident	70.5	Confident	128 Å²	128	87.1 Å²	87.1	59%	0.593	43%	0.431	S	S	*	.	H	α-helix	trans	-95	-36.9	-172.7	-76.1	-89.3	0	0	0	114.3	H139 I140	H139-H143 AromaticContact CE1-CD2 3.6Å; H139-H143 AromaticContact CE1-CG 3.8Å; H139-H143 AromaticContact ND1-CD2 3.24Å; H139-H143 PolarHBondContact ND1-CD2 3.22Å; H139-H143 AromaticContact ND1-CG 3.9Å; H139-H143 AromaticContact ND1-NE2 3.95Å; H139-H143 PolarHBondContact O-N 3.23Å; I140-H143 PolarHBondContact O-N 3.41Å
144	H	78.7	Confident	69.8	Low	28 Å²	28	89.2 Å²	89.2	13%	0.13	44%	0.44	C	S	.	.	S	Bend	trans	-104.8	20.6	-172.6	-51	-48.2	0	0	0	112.1	C123 F125 H139 I140 R146 E147 Q148	C123-H144 PolarHBondContact SG-CD2 2.67Å; C123-H144 PolarHBondContact SG-NE2 3.42Å; F125-H144 HydrophobicContact CD2-CB 4.07Å; F125-H144 AromaticContact CD2-CD2 3.78Å; F125-H144 AromaticContact CD2-CG 3.91Å; F125-H144 HydrophobicContact CG-CB 4.23Å; F125-H144 AromaticContact CG-CG 3.89Å; H139-H144 AromaticContact CE1-NE2 3.74Å; H139-H144 AromaticContact NE2-CD2 3.89Å; H139-H144 AromaticContact NE2-NE2 3.19Å; H139-H144 PolarHBondContact NE2-NE2 3.43Å; H139-H144 VanDerWaalsContact NE2-NE2 3.19Å; I140-H144 HydrophobicContact CG2-CB 4.28Å; I140-H144 WeakPolarHBondContact O-CA 3.38Å; I140-H144 PolarHBondContact O-N 3.43Å; H144-R146 PolarHBondContact O-N 3.33Å; H144-E147 PolarHBondContact O-N 3.46Å; H144-Q148 PolarHBondContact O-N 3.19Å
145	K	65.8	Low	69.1	Low	137 Å²	137	93.1 Å²	93.1	60%	0.596	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-12.9	-172.3	-155.6	-179.5	-178.7	-173	0	115.3	L141	L141-K145 WeakPolarHBondContact O-CB 3.4Å; L141-K145 WeakPolarHBondContact O-CD 3.49Å; L141-K145 VanDerWaalsContact O-CG 3.29Å; L141-K145 WeakPolarHBondContact O-CG 3.44Å
146	R	56.9	Low	68.2	Low	243 Å²	243	91 Å²	91	92%	0.917	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-21.3	176.1	-70.2	-174.3	178.3	178.2	-0.1	113.8	H144	H144-R146 PolarHBondContact O-N 3.33Å
147	E	57	Low	67.3	Low	140 Å²	140	91.7 Å²	91.7	65%	0.654	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-10	179	-63	-177.5	172.1	0	0	111.8	F125 H144	F125-E147 WeakPolarHBondContact CD1-OE2 3.4Å; F125-E147 HydrophobicContact CE1-CB 4.39Å; F125-E147 WeakPolarHBondContact CE1-OE2 3.09Å; H144-E147 PolarHBondContact O-N 3.46Å
148	Q	54	Low	66.7	Low	33 Å²	33	93.5 Å²	93.5	15%	0.154	45%	0.451	C	S	.	.			trans	-131.3	77.6	178	-61.4	-156.7	-29.9	0	0	112.5	F125 I140 H144 D156	F125-Q148 HydrophobicContact CE2-CG 4.41Å; F125-Q148 HydrophobicContact CZ-CG 4.15Å; I140-Q148 VanDerWaalsContact CG2-OE1 3.3Å; H144-Q148 PolarHBondContact O-N 3.19Å; Q148-D156 PolarHBondContact NE2-OD1 2.9Å; Q148-D156 PolarHBondContact NE2-OD2 3.45Å
149	N	45	Very low	66	Low	150 Å²	150	92.3 Å²	92.3	80%	0.802	45%	0.45	S	S	*	.	S	Bend	trans	-77.6	115.8	151.8	-75	-27	0	0	0	107.7
150	A	50.9	Low	64.8	Low	94 Å²	94	96.1 Å²	96.1	78%	0.777	47%	0.466	S	S	*	.	S	Bend	trans	70.7	127.2	-175	0	0	0	0	0	116.7
151	F	57.6	Low	63.3	Low	133 Å²	133	105.2 Å²	105.2	58%	0.583	51%	0.506	S	S	*	.			trans	58	103.2	166	-140.5	-94.1	0	0	0	118.3	G153	F151-G153 PolarHBondContact O-N 3.19Å
152	I	59.5	Low	61.2	Low	44 Å²	44	104.2 Å²	104.2	23%	0.226	52%	0.52	C	S	.	.			trans	-68.9	103.7	163	-62.2	161.9	0	0	0	107.7	T137 I140 L141 D156 I157	T137-I152 HydrophobicContact CG2-CD1 3.48Å; T137-I152 VanDerWaalsContact CG2-CD1 3.48Å; I140-I152 HydrophobicContact CB-CD1 4.19Å; I140-I152 HydrophobicContact CD1-CG2 3.97Å; I140-I152 HydrophobicContact CG2-CD1 4.12Å; I140-I152 HydrophobicContact CG2-CG1 3.95Å; I140-I152 HydrophobicContact CG2-CG2 4.49Å; L141-I152 HydrophobicContact CB-CD1 4.37Å; I152-D156 HydrophobicContact CG2-CB 4.22Å; I152-I157 HydrophobicContact CG2-CD1 4.16Å; I152-I157 HydrophobicContact CG2-CG1 4.31Å
153	G	60.4	Low	59	Low	16 Å²	16	106.2 Å²	106.2	17%	0.165	53%	0.529	C	S	.	.			trans	-67.2	162.4	178.7	0	0	0	0	0	112.4	F151 D155 D156	F151-G153 PolarHBondContact O-N 3.19Å; G153-D155 PolarHBondContact O-N 3.4Å; G153-D156 WeakPolarHBondContact CA-OD2 3.24Å; G153-D156 PolarHBondContact N-OD2 2.89Å; G153-D156 PolarHBondContact O-N 3.09Å
154	K	65.1	Low	57.1	Low	157 Å²	157	108.2 Å²	108.2	68%	0.683	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-59.8	-30.6	171	-66.7	179.5	-175.5	173.6	0	110.8	D156 I157 D437	K154-D156 VanDerWaalsContact C-N 3.29Å; K154-D156 PolarHBondContact O-N 2.98Å; K154-I157 PolarHBondContact O-N 3.04Å; K154-D437 IonicContact NZ-OD2 2.8Å
155	D	64.1	Low	55	Low	121 Å²	121	112 Å²	112	65%	0.647	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-76	-10.5	-175.1	-53.9	-57.6	0	0	0	114.7	R124 G153 I157	R124-D155 VanDerWaalsContact CD-O 3.24Å; R124-D155 WeakPolarHBondContact CD-O 3.39Å; R124-D155 PolarHBondContact NH1-O 3.02Å; G153-D155 PolarHBondContact O-N 3.4Å; D155-I157 VanDerWaalsContact C-N 3.35Å
156	D	63.7	Low	53.8	Low	21 Å²	21	108.2 Å²	108.2	11%	0.112	55%	0.554	C	S	.	*	G	3₁₀ helix	trans	-86.5	-14.8	174.1	-52.4	-50.1	0	0	0	112.3	R124 F125 I140 Q148 I152 G153 K154	R124-D156 PolarHBondContact N-O 2.91Å; F125-D156 HydrophobicContact CE2-CB 4.1Å; I140-D156 HydrophobicContact CD1-CB 4.25Å; Q148-D156 PolarHBondContact NE2-OD1 2.9Å; Q148-D156 PolarHBondContact NE2-OD2 3.45Å; I152-D156 HydrophobicContact CG2-CB 4.22Å; G153-D156 WeakPolarHBondContact CA-OD2 3.24Å; G153-D156 PolarHBondContact N-OD2 2.89Å; G153-D156 PolarHBondContact O-N 3.09Å; K154-D156 VanDerWaalsContact C-N 3.29Å; K154-D156 PolarHBondContact O-N 2.98Å
157	I	63.5	Low	53.2	Low	14 Å²	14	105.6 Å²	105.6	7%	0.072	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	88.9	-177.9	-58.8	-177.1	0	0	0	108	Y121 K133 L136 I140 I152 K154 D155 I159	Y121-I157 HydrophobicContact CD1-CG2 3.7Å; Y121-I157 HydrophobicContact CG-CG2 4.44Å; K133-I157 HydrophobicContact CG-CD1 4.1Å; L136-I157 HydrophobicContact CD2-CB 4.15Å; L136-I157 HydrophobicContact CD2-CG1 3.94Å; L136-I157 HydrophobicContact CD2-CG2 3.8Å; I140-I157 HydrophobicContact CD1-CG1 4.07Å; I152-I157 HydrophobicContact CG2-CD1 4.16Å; I152-I157 HydrophobicContact CG2-CG1 4.31Å; K154-I157 PolarHBondContact O-N 3.04Å; D155-I157 VanDerWaalsContact C-N 3.35Å; I157-I159 PolarHBondContact O-N 2.83Å; I157-I159 VanDerWaalsContact O-N 3.17Å
158	I	67.5	Low	52.3	Low	87 Å²	87	104.1 Å²	104.1	45%	0.446	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	113.7	176.6	-59.4	167.9	0	0	0	108.3	V122 R124	V122-I158 HydrophobicContact CB-CB 4.18Å; V122-I158 PolarHBondContact N-O 3.44Å; V122-I158 PolarHBondContact O-N 3.37Å; R124-I158 HydrophobicContact CB-CD1 4.21Å; R124-I158 HydrophobicContact CB-CG1 4.47Å; R124-I158 HydrophobicContact CG-CD1 4.34Å
159	I	67.1	Low	51.8	Low	106 Å²	106	107.7 Å²	107.7	54%	0.544	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.7	112.3	173.1	-56.3	177	0	0	0	108.7	P120 Y121 I157 K161	P120-I159 CarbonylContact O-C 3.45Å; P120-I159 WeakPolarHBondContact O-CA 3.22Å; Y121-I159 HydrophobicContact CD1-CG1 4.18Å; Y121-I159 HydrophobicContact CE1-CD1 4.39Å; Y121-I159 HydrophobicContact CE1-CG1 4.23Å; I157-I159 PolarHBondContact O-N 2.83Å; I157-I159 VanDerWaalsContact O-N 3.17Å; I159-K161 PolarHBondContact O-N 2.99Å
160	K	59	Low	51.7	Low	100 Å²	100	104.3 Å²	104.3	44%	0.435	57%	0.565	S	S	.	*			trans	-68.3	92	172.9	-79.9	172.5	170.7	148.9	0	110.5	P120 V122	P120-K160 PolarHBondContact O-N 2.95Å; V122-K160 HydrophobicContact CG2-CD 3.68Å; V122-K160 HydrophobicContact CG2-CG 3.97Å; V122-K160 VanDerWaalsContact CG2-NZ 3.34Å
161	K	50	Low	51.5	Low	192 Å²	192	101.6 Å²	101.6	84%	0.835	54%	0.542	S	S	*	.			trans	-59.4	135.6	161	-70.7	-176.1	177.3	179	0	108.7	I159 K163	I159-K161 PolarHBondContact O-N 2.99Å; K161-K163 PolarHBondContact O-N 3.15Å
162	G	37.4	Very low	51.1	Low	82 Å²	82	98.4 Å²	98.4	85%	0.845	53%	0.533	S	S	*	.	S	Bend	trans	-65.8	88.1	-170.5	0	0	0	0	0	114.2
163	K	35.2	Very low	50.5	Low	204 Å²	204	99.8 Å²	99.8	89%	0.887	54%	0.541	S	S	*	.			trans	-130.8	70.3	160.4	-71.7	-168.3	178.4	-173.2	0	109.4	K161	K161-K163 PolarHBondContact O-N 3.15Å
164	K	41.7	Very low	49.9	Very low	171 Å²	171	104.8 Å²	104.8	74%	0.743	56%	0.558	S	S	*	*			trans	-127	122.2	163.3	-75	-158.9	168.4	-151.1	0	108	V166	K164-V166 PolarHBondContact O-N 3.34Å; K164-V166 VanDerWaalsContact O-N 3.09Å
165	S	33.4	Very low	49.1	Very low	107 Å²	107	100.5 Å²	100.5	75%	0.748	54%	0.543	S	S	*	.			trans	-56	113	177.5	169.5	0	0	0	0	109.4
166	V	41.8	Very low	48.4	Very low	58 Å²	58	100.3 Å²	100.3	35%	0.352	54%	0.538	S	S	.	.			trans	-81.3	117.9	161.9	175.8	0	0	0	0	105.2	K164 D168 A171 V172 L175	K164-V166 PolarHBondContact O-N 3.34Å; K164-V166 VanDerWaalsContact O-N 3.09Å; V166-D168 VanDerWaalsContact C-N 3.32Å; V166-A171 HydrophobicContact CG1-CB 3.53Å; V166-V172 HydrophobicContact CB-CG2 4.06Å; V166-V172 HydrophobicContact CG1-CG2 4.07Å; V166-L175 HydrophobicContact CG2-CD1 3.82Å
167	K	42.3	Very low	48.3	Very low	187 Å²	187	104.7 Å²	104.7	81%	0.813	56%	0.556	S	S	*	*			trans	-81.8	-12.9	-176.2	-70.9	-174.4	174.7	-174.3	0	113.2
168	D	39.3	Very low	47.6	Very low	110 Å²	110	105.8 Å²	105.8	59%	0.588	57%	0.565	S	S	*	*			trans	-97.3	115.5	-176.4	-56.5	-49.7	0	0	0	111.2	V166 A170 A171 V172	V166-D168 VanDerWaalsContact C-N 3.32Å; D168-A170 VanDerWaalsContact C-N 3.26Å; D168-A170 PolarHBondContact O-N 3.48Å; D168-A171 HydrophobicContact CB-CB 4.1Å; D168-A171 PolarHBondContact O-N 2.8Å; D168-V172 PolarHBondContact O-N 3.11Å; D168-V172 VanDerWaalsContact O-N 3.14Å
169	P	42.5	Very low	46.5	Very low	108 Å²	108	106.6 Å²	106.6	70%	0.701	57%	0.568	S	S	*	*	H	α-helix	trans	-56.9	-36.8	-179.1	-26.8	35.3	0	0	0	113.7	A171 V172 D173	P169-A171 VanDerWaalsContact C-N 3.3Å; P169-A171 PolarHBondContact O-N 2.68Å; P169-V172 WeakPolarHBondContact O-CB 3.29Å; P169-V172 PolarHBondContact O-N 3.05Å; P169-D173 PolarHBondContact O-N 3.46Å
170	A	44	Very low	45.8	Very low	79 Å²	79	105.5 Å²	105.5	65%	0.653	56%	0.562	S	S	*	*	H	α-helix	trans	-64.8	-31.7	177.5	0	0	0	0	0	113.2	D168 F174	D168-A170 VanDerWaalsContact C-N 3.26Å; D168-A170 PolarHBondContact O-N 3.48Å; A170-F174 WeakPolarHBondContact O-CB 3.5Å; A170-F174 PolarHBondContact O-N 3.32Å; A170-F174 VanDerWaalsContact O-N 3.09Å
171	A	45.5	Very low	45.3	Very low	36 Å²	36	103.5 Å²	103.5	30%	0.298	56%	0.556	S	S	.	*	H	α-helix	trans	-80	-27.7	175.8	0	0	0	0	0	111.9	V166 D168 P169 L175	V166-A171 HydrophobicContact CG1-CB 3.53Å; D168-A171 HydrophobicContact CB-CB 4.1Å; D168-A171 PolarHBondContact O-N 2.8Å; P169-A171 VanDerWaalsContact C-N 3.3Å; P169-A171 PolarHBondContact O-N 2.68Å; A171-L175 VanDerWaalsContact O-CB 3.31Å; A171-L175 WeakPolarHBondContact O-CB 3.47Å; A171-L175 WeakPolarHBondContact O-CD1 3.45Å; A171-L175 WeakPolarHBondContact O-CG 3.47Å; A171-L175 PolarHBondContact O-N 3.5Å
172	V	50	Low	44.9	Very low	66 Å²	66	97.8 Å²	97.8	40%	0.4	53%	0.534	S	S	.	.	H	α-helix	trans	-65.5	-48.5	168.8	178.4	0	0	0	0	110.3	V166 D168 P169 F174 L175 E176	V166-V172 HydrophobicContact CB-CG2 4.06Å; V166-V172 HydrophobicContact CG1-CG2 4.07Å; D168-V172 PolarHBondContact O-N 3.11Å; D168-V172 VanDerWaalsContact O-N 3.14Å; P169-V172 WeakPolarHBondContact O-CB 3.29Å; P169-V172 PolarHBondContact O-N 3.05Å; V172-F174 PolarHBondContact O-N 3.27Å; V172-L175 CarbonylContact O-C 3.58Å; V172-L175 PolarHBondContact O-N 2.93Å; V172-L175 VanDerWaalsContact O-N 3.11Å; V172-E176 WeakPolarHBondContact O-CB 3.29Å; V172-E176 PolarHBondContact O-N 3.02Å
173	D	46	Very low	45.4	Very low	74 Å²	74	97.9 Å²	97.9	40%	0.396	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-39.8	178.5	179.6	46.8	0	0	0	112.4	P169 K177	P169-D173 PolarHBondContact O-N 3.46Å; D173-K177 WeakPolarHBondContact O-CB 3.43Å; D173-K177 WeakPolarHBondContact O-CD 3.37Å; D173-K177 VanDerWaalsContact O-CG 3.29Å; D173-K177 WeakPolarHBondContact O-CG 3.43Å; D173-K177 PolarHBondContact O-N 3.35Å; D173-K177 WeakPolarHBondContact OD1-CE 3.49Å; D173-K177 IonicContact OD1-NZ 2.61Å; D173-K177 PolarHBondContact OD1-NZ 3.36Å; D173-K177 IonicContact OD2-NZ 3.33Å; D173-K177 PolarHBondContact OD2-NZ 2.86Å
174	F	48.8	Very low	46.4	Very low	121 Å²	121	91 Å²	91	53%	0.531	50%	0.495	S	S	.	.	H	α-helix	trans	-64.7	-41.7	171.3	-174.7	-95.1	0	0	0	112.7	I97 A170 V172 S178	I97-F174 HydrophobicContact CD1-CZ 4.4Å; A170-F174 WeakPolarHBondContact O-CB 3.5Å; A170-F174 PolarHBondContact O-N 3.32Å; A170-F174 VanDerWaalsContact O-N 3.09Å; V172-F174 PolarHBondContact O-N 3.27Å; F174-S178 WeakPolarHBondContact O-CB 3.49Å; F174-S178 PolarHBondContact O-N 3.28Å; F174-S178 PolarHBondContact O-OG 3.04Å
175	L	47.7	Very low	46.5	Very low	67 Å²	67	86.1 Å²	86.1	35%	0.351	48%	0.475	S	S	.	.	H	α-helix	trans	-66.1	-41	177.1	-79.1	167.7	0	0	0	111.9	V166 A171 V172 S178 M179	V166-L175 HydrophobicContact CG2-CD1 3.82Å; A171-L175 VanDerWaalsContact O-CB 3.31Å; A171-L175 WeakPolarHBondContact O-CB 3.47Å; A171-L175 WeakPolarHBondContact O-CD1 3.45Å; A171-L175 WeakPolarHBondContact O-CG 3.47Å; A171-L175 PolarHBondContact O-N 3.5Å; V172-L175 CarbonylContact O-C 3.58Å; V172-L175 PolarHBondContact O-N 2.93Å; V172-L175 VanDerWaalsContact O-N 3.11Å; L175-S178 WeakPolarHBondContact CA-OG 3.39Å; L175-S178 PolarHBondContact O-N 3.08Å; L175-S178 PolarHBondContact O-OG 2.89Å; L175-M179 WeakPolarHBondContact O-CB 3.2Å; L175-M179 WeakPolarHBondContact O-CG 3.36Å; L175-M179 PolarHBondContact O-N 3.3Å
176	E	50.5	Low	47.1	Very low	117 Å²	117	87 Å²	87	55%	0.547	47%	0.468	S	S	.	.	H	α-helix	trans	-63.7	-48.4	176.8	-173.4	160.9	-160.3	0	0	111.1	V172 S178 M179 I180	V172-E176 WeakPolarHBondContact O-CB 3.29Å; V172-E176 PolarHBondContact O-N 3.02Å; E176-S178 VanDerWaalsContact C-N 3.32Å; E176-S178 PolarHBondContact O-N 3.3Å; E176-M179 PolarHBondContact O-N 3.17Å; E176-M179 VanDerWaalsContact O-N 3.14Å; E176-I180 HydrophobicContact CG-CD1 4.16Å; E176-I180 VanDerWaalsContact O-CG1 3.31Å; E176-I180 WeakPolarHBondContact O-CG1 3.33Å; E176-I180 PolarHBondContact O-N 3.12Å
177	K	62.2	Low	47.2	Very low	113 Å²	113	87.2 Å²	87.2	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-57.3	-42.7	172.5	-73.6	164.2	179.7	163.7	0	112.1	D173 I180 I181	D173-K177 WeakPolarHBondContact O-CB 3.43Å; D173-K177 WeakPolarHBondContact O-CD 3.37Å; D173-K177 VanDerWaalsContact O-CG 3.29Å; D173-K177 WeakPolarHBondContact O-CG 3.43Å; D173-K177 PolarHBondContact O-N 3.35Å; D173-K177 WeakPolarHBondContact OD1-CE 3.49Å; D173-K177 IonicContact OD1-NZ 2.61Å; D173-K177 PolarHBondContact OD1-NZ 3.36Å; D173-K177 IonicContact OD2-NZ 3.33Å; D173-K177 PolarHBondContact OD2-NZ 2.86Å; K177-I180 PolarHBondContact O-N 3.21Å; K177-I181 WeakPolarHBondContact O-CG1 3.44Å; K177-I181 PolarHBondContact O-N 3.36Å
178	S	46.9	Very low	47.4	Very low	37 Å²	37	81 Å²	81	26%	0.259	46%	0.459	S	S	.	.	H	α-helix	trans	-69.5	-32.7	176.8	78.1	0	0	0	0	113.7	F174 L175 E176 L182	F174-S178 WeakPolarHBondContact O-CB 3.49Å; F174-S178 PolarHBondContact O-N 3.28Å; F174-S178 PolarHBondContact O-OG 3.04Å; L175-S178 WeakPolarHBondContact CA-OG 3.39Å; L175-S178 PolarHBondContact O-N 3.08Å; L175-S178 PolarHBondContact O-OG 2.89Å; E176-S178 VanDerWaalsContact C-N 3.32Å; E176-S178 PolarHBondContact O-N 3.3Å; S178-L182 WeakPolarHBondContact O-CG 3.13Å; S178-L182 PolarHBondContact O-N 3.07Å; S178-L182 VanDerWaalsContact O-N 3.12Å
179	M	44.6	Very low	47.5	Very low	103 Å²	103	81 Å²	81	51%	0.507	46%	0.457	S	S	.	.	H	α-helix	trans	-69.8	-40.7	174.3	-83.9	-101.7	53.6	0	0	111.4	L175 E176 I181 L182 T183	L175-M179 WeakPolarHBondContact O-CB 3.2Å; L175-M179 WeakPolarHBondContact O-CG 3.36Å; L175-M179 PolarHBondContact O-N 3.3Å; E176-M179 PolarHBondContact O-N 3.17Å; E176-M179 VanDerWaalsContact O-N 3.14Å; M179-I181 VanDerWaalsContact C-N 3.35Å; M179-I181 PolarHBondContact O-N 2.71Å; M179-L182 HydrophobicContact CE-CB 4.4Å; M179-L182 HydrophobicContact CE-CD1 4.41Å; M179-L182 PolarHBondContact O-N 2.93Å; M179-T183 HydrophobicContact CE-CG2 4.47Å; M179-T183 WeakPolarHBondContact O-CG2 3.39Å; M179-T183 PolarHBondContact O-N 3.09Å; M179-T183 PolarHBondContact O-OG1 2.98Å
180	I	53.3	Low	47.7	Very low	84 Å²	84	82 Å²	82	43%	0.431	46%	0.457	S	S	.	.	H	α-helix	trans	-59.1	-46.9	175.5	-69.8	163.6	0	0	0	110.2	E176 K177 L182 T183 S184	E176-I180 HydrophobicContact CG-CD1 4.16Å; E176-I180 VanDerWaalsContact O-CG1 3.31Å; E176-I180 WeakPolarHBondContact O-CG1 3.33Å; E176-I180 PolarHBondContact O-N 3.12Å; K177-I180 PolarHBondContact O-N 3.21Å; I180-L182 PolarHBondContact O-N 2.89Å; I180-T183 WeakPolarHBondContact CA-OG1 3.27Å; I180-T183 PolarHBondContact O-N 3.11Å; I180-T183 PolarHBondContact O-OG1 3.47Å; I180-S184 PolarHBondContact O-N 2.71Å; I180-S184 PolarHBondContact O-OG 2.95Å
181	I	47.5	Very low	47.5	Very low	57 Å²	57	81.1 Å²	81.1	29%	0.292	45%	0.445	S	S	.	.	H	α-helix	trans	-58.2	-46.3	175.1	-65.7	164.9	0	0	0	111.3	K177 M179 T183 S184 E185	K177-I181 WeakPolarHBondContact O-CG1 3.44Å; K177-I181 PolarHBondContact O-N 3.36Å; M179-I181 VanDerWaalsContact C-N 3.35Å; M179-I181 PolarHBondContact O-N 2.71Å; I181-T183 VanDerWaalsContact C-N 3.35Å; I181-T183 PolarHBondContact O-N 3.48Å; I181-S184 PolarHBondContact O-N 3.22Å; I181-S184 PolarHBondContact O-OG 2.87Å; I181-E185 WeakPolarHBondContact O-CG 3.42Å; I181-E185 PolarHBondContact O-N 3.43Å
182	L	41.4	Very low	47.1	Very low	73 Å²	73	85 Å²	85	38%	0.382	47%	0.471	S	S	.	.	H	α-helix	trans	-63	-40	177.4	-71.4	169.8	0	0	0	112.2	S178 M179 I180 Q186	S178-L182 WeakPolarHBondContact O-CG 3.13Å; S178-L182 PolarHBondContact O-N 3.07Å; S178-L182 VanDerWaalsContact O-N 3.12Å; M179-L182 HydrophobicContact CE-CB 4.4Å; M179-L182 HydrophobicContact CE-CD1 4.41Å; M179-L182 PolarHBondContact O-N 2.93Å; I180-L182 PolarHBondContact O-N 2.89Å; L182-Q186 VanDerWaalsContact O-CB 3.3Å; L182-Q186 WeakPolarHBondContact O-CB 3.4Å; L182-Q186 PolarHBondContact O-N 3.49Å
183	T	49.5	Very low	46.2	Very low	83 Å²	83	84.7 Å²	84.7	51%	0.509	47%	0.471	S	S	.	.	H	α-helix	trans	-71.4	-32.8	178.4	56.9	0	0	0	0	113.4	M179 I180 I181 Q186 A187	M179-T183 HydrophobicContact CE-CG2 4.47Å; M179-T183 WeakPolarHBondContact O-CG2 3.39Å; M179-T183 PolarHBondContact O-N 3.09Å; M179-T183 PolarHBondContact O-OG1 2.98Å; I180-T183 WeakPolarHBondContact CA-OG1 3.27Å; I180-T183 PolarHBondContact O-N 3.11Å; I180-T183 PolarHBondContact O-OG1 3.47Å; I181-T183 VanDerWaalsContact C-N 3.35Å; I181-T183 PolarHBondContact O-N 3.48Å; T183-Q186 PolarHBondContact O-N 3.46Å; T183-A187 WeakPolarHBondContact O-CB 3.29Å; T183-A187 PolarHBondContact O-N 2.73Å
184	S	55.8	Low	45.8	Very low	59 Å²	59	86.8 Å²	86.8	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-74.9	-38.5	175.7	65.2	0	0	0	0	111.9	I180 I181 A187 A188	I180-S184 PolarHBondContact O-N 2.71Å; I180-S184 PolarHBondContact O-OG 2.95Å; I181-S184 PolarHBondContact O-N 3.22Å; I181-S184 PolarHBondContact O-OG 2.87Å; S184-A187 PolarHBondContact O-N 3.17Å; S184-A188 WeakPolarHBondContact O-CB 3.47Å; S184-A188 PolarHBondContact O-N 3.34Å
185	E	44.6	Very low	45.2	Very low	69 Å²	69	86.1 Å²	86.1	32%	0.322	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-45.6	167.5	-73.9	-165.5	105.2	0	0	110.8	R112 I181 A187 A188 M189	R112-E185 IonicContact NH1-OE2 3.6Å; I181-E185 WeakPolarHBondContact O-CG 3.42Å; I181-E185 PolarHBondContact O-N 3.43Å; E185-A187 VanDerWaalsContact C-N 3.32Å; E185-A187 PolarHBondContact O-N 2.75Å; E185-A188 PolarHBondContact O-N 3.35Å; E185-M189 WeakPolarHBondContact O-CG 3.35Å; E185-M189 PolarHBondContact O-N 2.98Å
186	Q	44.3	Very low	44.8	Very low	127 Å²	127	86.6 Å²	86.6	59%	0.593	51%	0.505	S	S	*	.	H	α-helix	trans	-62.8	-37.1	178.1	-153.7	90.8	40.9	0	0	112.3	L182 T183 N190	L182-Q186 VanDerWaalsContact O-CB 3.3Å; L182-Q186 WeakPolarHBondContact O-CB 3.4Å; L182-Q186 PolarHBondContact O-N 3.49Å; T183-Q186 PolarHBondContact O-N 3.46Å; Q186-N190 VanDerWaalsContact O-CG 3.3Å; Q186-N190 PolarHBondContact O-ND2 3.27Å; Q186-N190 VanDerWaalsContact O-ND2 3.08Å
187	A	44.4	Very low	44.4	Very low	61 Å²	61	84 Å²	84	50%	0.504	50%	0.497	S	S	.	.	H	α-helix	trans	-69.4	-43.7	176.2	0	0	0	0	0	112.1	T183 S184 E185 M189 N190	T183-A187 WeakPolarHBondContact O-CB 3.29Å; T183-A187 PolarHBondContact O-N 2.73Å; S184-A187 PolarHBondContact O-N 3.17Å; E185-A187 VanDerWaalsContact C-N 3.32Å; E185-A187 PolarHBondContact O-N 2.75Å; A187-M189 VanDerWaalsContact C-N 3.29Å; A187-M189 PolarHBondContact O-N 3.36Å; A187-N190 PolarHBondContact O-N 2.93Å; A187-N190 VanDerWaalsContact O-N 3.16Å
188	A	46.8	Very low	43.6	Very low	57 Å²	57	82.8 Å²	82.8	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-64.7	-30.7	176.8	0	0	0	0	0	113	S184 E185 N190 S191	S184-A188 WeakPolarHBondContact O-CB 3.47Å; S184-A188 PolarHBondContact O-N 3.34Å; E185-A188 PolarHBondContact O-N 3.35Å; A188-N190 VanDerWaalsContact C-N 3.29Å; A188-N190 PolarHBondContact O-N 2.85Å; A188-S191 PolarHBondContact O-OG 3.38Å
189	M	40.4	Very low	43.4	Very low	110 Å²	110	86.5 Å²	86.5	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-72	-20.4	175.7	-63.4	-97.7	-173.2	0	0	113.3	E185 A187	E185-M189 WeakPolarHBondContact O-CG 3.35Å; E185-M189 PolarHBondContact O-N 2.98Å; A187-M189 VanDerWaalsContact C-N 3.29Å; A187-M189 PolarHBondContact O-N 3.36Å
190	N	47.4	Very low	43.2	Very low	130 Å²	130	87.6 Å²	87.6	70%	0.695	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-7.7	-177.3	-70.1	-28.1	0	0	0	113.7	Q186 A187 A188	Q186-N190 VanDerWaalsContact O-CG 3.3Å; Q186-N190 PolarHBondContact O-ND2 3.27Å; Q186-N190 VanDerWaalsContact O-ND2 3.08Å; A187-N190 PolarHBondContact O-N 2.93Å; A187-N190 VanDerWaalsContact O-N 3.16Å; A188-N190 VanDerWaalsContact C-N 3.29Å; A188-N190 PolarHBondContact O-N 2.85Å
191	S	40.3	Very low	43	Very low	60 Å²	60	88.6 Å²	88.6	42%	0.42	53%	0.529	S	S	.	.			trans	-88.9	107.2	175.7	53.7	0	0	0	0	111.7	A188 S193	A188-S191 PolarHBondContact O-OG 3.38Å; S191-S193 PolarHBondContact O-N 3.29Å
192	S	36.3	Very low	43.1	Very low	118 Å²	118	88.4 Å²	88.4	83%	0.825	53%	0.533	S	S	*	.			trans	-77	52.5	-178.8	58.9	0	0	0	0	113.6
193	S	32.5	Very low	43.6	Very low	59 Å²	59	91.5 Å²	91.5	41%	0.413	54%	0.544	S	S	.	.			trans	-155.5	110.2	-178.8	-63.1	0	0	0	0	111.3	S191 S195	S191-S193 PolarHBondContact O-N 3.29Å; S193-S195 VanDerWaalsContact C-N 3.32Å; S193-S195 PolarHBondContact O-N 3.33Å
194	P	37.1	Very low	43.1	Very low	117 Å²	117	89.5 Å²	89.5	76%	0.76	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-66.5	-28.9	-176.5	-23.2	34.3	0	0	0	114.6	T196 T197	P194-T196 PolarHBondContact O-N 2.92Å; P194-T197 PolarHBondContact O-OG1 3.46Å
195	S	35	Very low	42.7	Very low	107 Å²	107	91.7 Å²	91.7	75%	0.748	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-75.7	-22.1	-166.4	48	0	0	0	0	115.8	S193	S193-S195 VanDerWaalsContact C-N 3.32Å; S193-S195 PolarHBondContact O-N 3.33Å
196	T	39.4	Very low	43.3	Very low	77 Å²	77	95.7 Å²	95.7	47%	0.472	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-95.4	-2.7	-177.8	48.1	0	0	0	0	113.6	P194 Q200	P194-T196 PolarHBondContact O-N 2.92Å; T196-Q200 VanDerWaalsContact O-CG 3.31Å; T196-Q200 WeakPolarHBondContact O-CG 3.47Å; T196-Q200 PolarHBondContact O-N 3.34Å
197	T	43.5	Very low	43	Very low	64 Å²	64	98.2 Å²	98.2	39%	0.393	56%	0.564	S	S	.	*	H	α-helix	trans	-70.7	-34.1	-173.7	58.5	0	0	0	0	113.4	P194 L201	P194-T197 PolarHBondContact O-OG1 3.46Å; T197-L201 PolarHBondContact O-N 3.4Å
198	S	45	Very low	42.8	Very low	87 Å²	87	100.6 Å²	100.6	61%	0.608	56%	0.563	S	S	*	*	H	α-helix	trans	-64.9	-47.6	-179.3	-168.9	0	0	0	0	112.6	Q200 L201 S202	S198-Q200 VanDerWaalsContact C-N 3.35Å; S198-Q200 PolarHBondContact O-N 2.94Å; S198-L201 PolarHBondContact O-N 2.95Å; S198-S202 WeakPolarHBondContact O-CB 3.39Å; S198-S202 PolarHBondContact O-N 3.34Å
199	D	43	Very low	42.4	Very low	115 Å²	115	99.3 Å²	99.3	62%	0.615	56%	0.556	S	S	*	*	H	α-helix	trans	-68.9	-32.5	179.5	-77.9	-33.8	0	0	0	113	S202 K203	D199-S202 PolarHBondContact O-N 3.12Å; D199-K203 PolarHBondContact O-N 2.96Å
200	Q	40.4	Very low	42.5	Very low	125 Å²	125	96.8 Å²	96.8	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-71.2	-40	175.2	-65.1	-69	-1.3	0	0	111.3	T196 S198 K203 A204	T196-Q200 VanDerWaalsContact O-CG 3.31Å; T196-Q200 WeakPolarHBondContact O-CG 3.47Å; T196-Q200 PolarHBondContact O-N 3.34Å; S198-Q200 VanDerWaalsContact C-N 3.35Å; S198-Q200 PolarHBondContact O-N 2.94Å; Q200-K203 PolarHBondContact O-N 3.47Å; Q200-A204 WeakPolarHBondContact O-CB 3.22Å; Q200-A204 PolarHBondContact O-N 3.27Å
201	L	48.2	Very low	42.2	Very low	105 Å²	105	95.7 Å²	95.7	55%	0.55	55%	0.545	S	S	.	.	H	α-helix	trans	-63.6	-40.1	169.6	-104.9	71.8	0	0	0	111.9	T197 S198 A204 N205	T197-L201 PolarHBondContact O-N 3.4Å; S198-L201 PolarHBondContact O-N 2.95Å; L201-A204 PolarHBondContact O-N 3.06Å; L201-N205 VanDerWaalsContact O-CB 3.28Å; L201-N205 WeakPolarHBondContact O-CB 3.43Å; L201-N205 VanDerWaalsContact O-CG 3.24Å; L201-N205 PolarHBondContact O-N 3.45Å; L201-N205 PolarHBondContact O-ND2 3.14Å
202	S	49	Very low	42.3	Very low	54 Å²	54	101.1 Å²	101.1	38%	0.378	56%	0.561	S	S	.	*	H	α-helix	trans	-62.4	-44	176.8	-177	0	0	0	0	111.9	S198 D199 K206	S198-S202 WeakPolarHBondContact O-CB 3.39Å; S198-S202 PolarHBondContact O-N 3.34Å; D199-S202 PolarHBondContact O-N 3.12Å; S202-K206 WeakPolarHBondContact O-CG 3.32Å; S202-K206 PolarHBondContact O-N 3.29Å
203	K	52	Low	42.5	Very low	138 Å²	138	103.3 Å²	103.3	60%	0.6	56%	0.558	S	S	*	*	H	α-helix	trans	-65.4	-44.4	173.1	-86.7	174	174.3	169.5	0	112.5	D199 Q200 N205 K206 Y207	D199-K203 PolarHBondContact O-N 2.96Å; Q200-K203 PolarHBondContact O-N 3.47Å; K203-N205 PolarHBondContact O-N 3.14Å; K203-K206 PolarHBondContact O-N 3.49Å; K203-Y207 WeakPolarHBondContact O-CD2 3.41Å; K203-Y207 PolarHBondContact O-N 3.23Å; K203-Y207 VanDerWaalsContact O-N 3.13Å
204	A	39.9	Very low	42.8	Very low	41 Å²	41	105.2 Å²	105.2	34%	0.339	57%	0.571	S	S	.	*	H	α-helix	trans	-60.2	-46.6	176.1	0	0	0	0	0	111.7	Q200 L201 K206 Y207 F208	Q200-A204 WeakPolarHBondContact O-CB 3.22Å; Q200-A204 PolarHBondContact O-N 3.27Å; L201-A204 PolarHBondContact O-N 3.06Å; A204-K206 VanDerWaalsContact C-N 3.32Å; A204-K206 PolarHBondContact O-N 3.03Å; A204-Y207 WeakPolarHBondContact O-CB 3.33Å; A204-Y207 PolarHBondContact O-N 3.44Å; A204-Y207 VanDerWaalsContact O-N 3.11Å; A204-F208 HydrophobicContact CB-CE2 4.48Å; A204-F208 WeakPolarHBondContact O-CD2 3.29Å; A204-F208 PolarHBondContact O-N 3.42Å
205	N	46.9	Very low	42.8	Very low	104 Å²	104	103.9 Å²	103.9	56%	0.556	57%	0.571	S	S	*	*	H	α-helix	trans	-65.2	-32	178.7	-73.3	-19.3	0	0	0	112.8	L201 K203 F208 G209	L201-N205 VanDerWaalsContact O-CB 3.28Å; L201-N205 WeakPolarHBondContact O-CB 3.43Å; L201-N205 VanDerWaalsContact O-CG 3.24Å; L201-N205 PolarHBondContact O-N 3.45Å; L201-N205 PolarHBondContact O-ND2 3.14Å; K203-N205 PolarHBondContact O-N 3.14Å; N205-F208 PolarHBondContact O-N 3.34Å; N205-G209 PolarHBondContact O-N 3.08Å
206	K	56.5	Low	42.5	Very low	154 Å²	154	102.1 Å²	102.1	67%	0.67	57%	0.569	S	S	*	*	H	α-helix	trans	-65	-40.3	170.3	-77.5	178.7	178.7	-176.2	0	112.5	S202 K203 A204 G209 A210	S202-K206 WeakPolarHBondContact O-CG 3.32Å; S202-K206 PolarHBondContact O-N 3.29Å; K203-K206 PolarHBondContact O-N 3.49Å; A204-K206 VanDerWaalsContact C-N 3.32Å; A204-K206 PolarHBondContact O-N 3.03Å; K206-G209 PolarHBondContact O-N 3.01Å; K206-A210 PolarHBondContact O-N 3.35Å; K206-A210 VanDerWaalsContact O-N 3.15Å
207	Y	39.9	Very low	42.1	Very low	180 Å²	180	101.3 Å²	101.3	71%	0.706	58%	0.576	S	S	*	*	H	α-helix	trans	-64.6	-41.9	172.9	-90.8	-84.8	0	0	0	112.3	K203 A204 G209 A210 I211	K203-Y207 WeakPolarHBondContact O-CD2 3.41Å; K203-Y207 PolarHBondContact O-N 3.23Å; K203-Y207 VanDerWaalsContact O-N 3.13Å; A204-Y207 WeakPolarHBondContact O-CB 3.33Å; A204-Y207 PolarHBondContact O-N 3.44Å; A204-Y207 VanDerWaalsContact O-N 3.11Å; Y207-G209 VanDerWaalsContact C-N 3.34Å; Y207-G209 PolarHBondContact O-N 3.21Å; Y207-A210 PolarHBondContact O-N 3.19Å; Y207-I211 WeakPolarHBondContact O-CD1 3.34Å; Y207-I211 WeakPolarHBondContact O-CG1 3.36Å; Y207-I211 PolarHBondContact O-N 2.96Å
208	F	38.5	Very low	41.8	Very low	111 Å²	111	105.9 Å²	105.9	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-69.1	-29.2	175.2	-71.4	-64.8	0	0	0	113.6	A204 N205 K212	A204-F208 HydrophobicContact CB-CE2 4.48Å; A204-F208 WeakPolarHBondContact O-CD2 3.29Å; A204-F208 PolarHBondContact O-N 3.42Å; N205-F208 PolarHBondContact O-N 3.34Å; F208-K212 PolarHBondContact O-N 2.87Å
209	G	39.6	Very low	41.2	Very low	30 Å²	30	105.6 Å²	105.6	31%	0.309	62%	0.615	S	S	.	*	H	α-helix	trans	-62.7	-50.5	171.3	0	0	0	0	0	112.5	N205 K206 Y207 I211 K212 E213	N205-G209 PolarHBondContact O-N 3.08Å; K206-G209 PolarHBondContact O-N 3.01Å; Y207-G209 VanDerWaalsContact C-N 3.34Å; Y207-G209 PolarHBondContact O-N 3.21Å; G209-I211 VanDerWaalsContact C-N 3.26Å; G209-I211 PolarHBondContact O-N 3.42Å; G209-K212 WeakPolarHBondContact O-CA 3.44Å; G209-K212 WeakPolarHBondContact O-CB 3.44Å; G209-K212 PolarHBondContact O-N 3.45Å; G209-E213 PolarHBondContact O-N 2.9Å; G209-E213 VanDerWaalsContact O-N 3.11Å
210	A	41.9	Very low	40.6	Very low	56 Å²	56	103.6 Å²	103.6	46%	0.463	62%	0.622	S	S	.	*	H	α-helix	trans	-62.1	-30.4	179.6	0	0	0	0	0	113.6	K206 Y207 K212 S214	K206-A210 PolarHBondContact O-N 3.35Å; K206-A210 VanDerWaalsContact O-N 3.15Å; Y207-A210 PolarHBondContact O-N 3.19Å; A210-K212 VanDerWaalsContact C-N 3.33Å; A210-S214 PolarHBondContact O-N 2.87Å; A210-S214 PolarHBondContact O-OG 3.04Å
211	I	40.3	Very low	40.4	Very low	107 Å²	107	103.7 Å²	103.7	55%	0.549	64%	0.636	S	S	.	*	H	α-helix	trans	-74.1	-26.1	174.4	-64	165.8	0	0	0	111.4	Y207 G209 S214	Y207-I211 WeakPolarHBondContact O-CD1 3.34Å; Y207-I211 WeakPolarHBondContact O-CG1 3.36Å; Y207-I211 PolarHBondContact O-N 2.96Å; G209-I211 VanDerWaalsContact C-N 3.26Å; G209-I211 PolarHBondContact O-N 3.42Å; I211-S214 WeakPolarHBondContact CA-OG 3.23Å; I211-S214 PolarHBondContact O-OG 2.89Å
212	K	42.3	Very low	39.7	Very low	175 Å²	175	103.1 Å²	103.1	76%	0.761	65%	0.647	S	S	*	*	H	α-helix	trans	-80.2	-30.9	177.4	-156.4	175	-175.3	-178.3	0	112.5	F208 G209 A210	F208-K212 PolarHBondContact O-N 2.87Å; G209-K212 WeakPolarHBondContact O-CA 3.44Å; G209-K212 WeakPolarHBondContact O-CB 3.44Å; G209-K212 PolarHBondContact O-N 3.45Å; A210-K212 VanDerWaalsContact C-N 3.33Å
213	E	40.8	Very low	38.9	Very low	163 Å²	163	105.8 Å²	105.8	76%	0.762	67%	0.665	S	S	*	*	H	α-helix	trans	-75.6	-26.1	176.2	-69.7	174.2	162.6	0	0	112.8	G209 A215	G209-E213 PolarHBondContact O-N 2.9Å; G209-E213 VanDerWaalsContact O-N 3.11Å; E213-A215 VanDerWaalsContact C-N 3.34Å; E213-A215 PolarHBondContact O-N 2.91Å
214	S	38.8	Very low	38.1	Very low	99 Å²	99	111 Å²	111	69%	0.692	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-0.9	178.7	40.6	0	0	0	0	114.9	A210 I211	A210-S214 PolarHBondContact O-N 2.87Å; A210-S214 PolarHBondContact O-OG 3.04Å; I211-S214 WeakPolarHBondContact CA-OG 3.23Å; I211-S214 PolarHBondContact O-OG 2.89Å
215	A	37.8	Very low	37.7	Very low	90 Å²	90	112.9 Å²	112.9	74%	0.744	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	1.3	175.6	0	0	0	0	0	113.9	E213	E213-A215 VanDerWaalsContact C-N 3.34Å; E213-A215 PolarHBondContact O-N 2.91Å
216	G	29.3	Very low	37	Very low	70 Å²	70	112 Å²	112	72%	0.722	72%	0.72	S	S	*	*			trans	-103.9	71.4	-174.8	0	0	0	0	0	113.8
217	G	30.8	Very low	35.8	Very low	60 Å²	60	108.6 Å²	108.6	62%	0.619	73%	0.728	S	S	*	*			trans	-118.7	126.6	-179.7	0	0	0	0	0	114.3
218	T	35.8	Very low	35.4	Very low	159 Å²	159	108.8 Å²	108.8	98%	0.975	74%	0.735	S	S	*	*	S	Bend	trans	77.2	139.8	169.8	75.5	0	0	0	0	118.4
219	G	33.5	Very low	35.1	Very low	81 Å²	81	110.1 Å²	110.1	84%	0.835	75%	0.753	S	S	*	*			trans	113.9	41.9	156.6	0	0	0	0	0	119.4
220	G	29.7	Very low	34.4	Very low	74 Å²	74	114.1 Å²	114.1	76%	0.763	78%	0.776	S	S	*	*			trans	-87.4	133.5	170.6	0	0	0	0	0	113.6
221	S	36.3	Very low	34.2	Very low	126 Å²	126	116.7 Å²	116.7	88%	0.881	79%	0.788	S	S	*	*			trans	-170.7	109.6	144.7	-85.2	0	0	0	0	114.2
222	A	33.5	Very low	33.5	Very low	93 Å²	93	119.7 Å²	119.7	77%	0.769	80%	0.802	S	S	*	*			trans	27.6	118.3	144	0	0	0	0	0	122.7
223	S	32.7	Very low	33.1	Very low	110 Å²	110	119.5 Å²	119.5	77%	0.769	81%	0.808	S	S	*	*				85.7	133	119.4	-74.3	0	0	0	0	123.3
224	R	35.1	Very low	32.5	Very low	249 Å²	249	118 Å²	118	94%	0.94	81%	0.81	S	S	*	*			trans	75.7	95.3	152.9	-68	173	176.2	-173.2	-2.2	118.8
225	G	32.4	Very low	32.1	Very low	80 Å²	80	117.2 Å²	117.2	83%	0.825	82%	0.817	S	S	*	*				107.5	100.9	91.8	0	0	0	0	0	118.9
226	G	31.2	Very low	31.7	Very low	86 Å²	86	118.7 Å²	118.7	89%	0.887	82%	0.822	S	S	*	*			trans	80.9	160.6	143.3	0	0	0	0	0	118.2
227	G	32.3	Very low	31.7	Very low	81 Å²	81	121.7 Å²	121.7	84%	0.835	83%	0.83	S	S	*	*			trans	109.8	91.5	163	0	0	0	0	0	115.7
228	Q	29.9	Very low	31.9	Very low	184 Å²	184	123.9 Å²	123.9	86%	0.86	84%	0.843	S	S	*	*			trans	-44.9	142.9	165.5	-54.9	160	20.3	0	0	113.8
229	T	32.3	Very low	31.7	Very low	140 Å²	140	120.4 Å²	120.4	86%	0.859	84%	0.838	S	S	*	*				168.4	148.7	119.9	35.9	0	0	0	0	112.1
230	S	26.5	Very low	31.4	Very low	113 Å²	113	120.5 Å²	120.5	79%	0.79	84%	0.839	S	S	*	*			trans	-108.9	178.3	164.4	-49.1	0	0	0	0	107.8
231	P	36.1	Very low	31.6	Very low	111 Å²	111	122 Å²	122	72%	0.721	84%	0.838	S	S	*	*			cis	-142.1	-168.5	5.1	45.2	-26.4	0	0	0	115.4
232	M	26.7	Very low	31.3	Very low	170 Å²	170	122.4 Å²	122.4	84%	0.837	83%	0.83	S	S	*	*			trans	43.2	113.5	153.9	-61.9	-156	-176.1	0	0	121.2
233	I	32.8	Very low	31.1	Very low	171 Å²	171	126.4 Å²	126.4	88%	0.877	83%	0.83	S	S	*	*			trans	-136.8	138.8	130.4	-63.8	-171.1	0	0	0	109.4
234	T	28.5	Very low	31	Very low	132 Å²	132	128.3 Å²	128.3	81%	0.81	83%	0.831	S	S	*	*			trans	-85.9	145.2	180	48.9	0	0	0	0	113.4
235	G	31.8	Very low	30.7	Very low	82 Å²	82	122.1 Å²	122.1	85%	0.845	82%	0.823	S	S	*	*			trans	-140	119	166.6	0	0	0	0	0	110.8
236	S	27.9	Very low	30.5	Very low	121 Å²	121	124.8 Å²	124.8	85%	0.846	83%	0.828	S	S	*	*			trans	-102.3	146.6	-173.4	-177.7	0	0	0	0	111.7
237	C	29.2	Very low	30.3	Very low	132 Å²	132	124 Å²	124	89%	0.892	82%	0.82	S	S	*	*			trans	-142	125.7	160	-112.9	0	0	0	0	112.2
238	A	35.5	Very low	30.3	Very low	107 Å²	107	124.9 Å²	124.9	88%	0.884	82%	0.819	S	S	*	*			trans	-46.3	162.5	-175.4	0	0	0	0	0	118.9
239	G	31.7	Very low	30.1	Very low	85 Å²	85	123.4 Å²	123.4	88%	0.876	82%	0.817	S	S	*	*			trans	133.9	64.7	144.1	0	0	0	0	0	117.6
240	G	27.5	Very low	30	Very low	83 Å²	83	124.6 Å²	124.6	86%	0.856	82%	0.818	S	S	*	*			trans	-161.7	117	170.3	0	0	0	0	0	113.6
241	S	33.5	Very low	30.1	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	81%	0.814	S	S	*	*			trans	-140.6	146.3	176.4	66.7	0	0	0	0	112.8
242	L	30.5	Very low	29.7	Very low	135 Å²	135	126.7 Å²	126.7	71%	0.707	82%	0.818	S	S	*	*			trans	103.8	107.1	154.9	-57	175.8	0	0	0	118.8
243	F	28.8	Very low	29.9	Very low	177 Å²	177	124.2 Å²	124.2	78%	0.776	81%	0.813	S	S	*	*			trans	71.4	135.8	144.7	-61.5	-50.9	0	0	0	119.3
244	L	30	Very low	29.8	Very low	149 Å²	149	123 Å²	123	78%	0.78	81%	0.808	S	S	*	*			cis	-156.2	146.3	-0.1	-137	141.3	0	0	0	109.2
245	P	29.1	Very low	29.8	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	80%	0.803	S	S	*	*			trans	-109.1	144.2	-172.2	38.2	-32.5	0	0	0	115.8
246	C	29.2	Very low	29.9	Very low	136 Å²	136	126.6 Å²	126.6	92%	0.919	81%	0.808	S	S	*	*			trans	-170.2	139.5	149.7	-148.6	0	0	0	0	107.8
247	G	25.9	Very low	29.9	Very low	70 Å²	70	124.3 Å²	124.3	72%	0.722	80%	0.803	S	S	*	*			cis	140.6	78.3	4.2	0	0	0	0	0	110
248	A	33.1	Very low	29.8	Very low	99 Å²	99	123.1 Å²	123.1	82%	0.818	80%	0.803	S	S	*	*			trans	-164.7	125.1	165.3	0	0	0	0	0	109.8
249	N	25.5	Very low	29.5	Very low	153 Å²	153	122.9 Å²	122.9	82%	0.818	80%	0.795	S	S	*	*			trans	-75.1	150	174.9	-52	-58.6	0	0	0	110
250	D	29.6	Very low	29.2	Very low	165 Å²	165	126.7 Å²	126.7	88%	0.882	79%	0.794	S	S	*	*			trans	-159.6	136.3	140.6	-100.8	-34.1	0	0	0	110.7
251	V	28.4	Very low	29.4	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.715	79%	0.792	S	S	*	*			trans	-96.5	100.1	-173.5	176.2	0	0	0	0	109.2	T253	V251-T253 HydrophobicContact CG1-CG2 4.04Å; V251-T253 PolarHBondContact O-N 3.09Å
252	D	29.3	Very low	29	Very low	150 Å²	150	127.9 Å²	127.9	80%	0.802	80%	0.795	S	S	*	*			trans	-87.6	83.5	167.2	-81.4	-46.2	0	0	0	109.4	D254	D252-D254 PolarHBondContact O-N 3.17Å
253	T	30.1	Very low	29.5	Very low	118 Å²	118	126.7 Å²	126.7	72%	0.724	80%	0.798	S	S	*	*			trans	-67.9	111.5	162.9	33.5	0	0	0	0	110.1	V251 P255	V251-T253 HydrophobicContact CG1-CG2 4.04Å; V251-T253 PolarHBondContact O-N 3.09Å; T253-P255 VanDerWaalsContact O-CD 3.32Å; T253-P255 WeakPolarHBondContact O-CD 3.45Å
254	D	31.6	Very low	29.7	Very low	144 Å²	144	125.3 Å²	125.3	77%	0.77	80%	0.798	S	S	*	*			trans	-72.3	120.6	169	-76.7	-46.6	0	0	0	110.7	D252	D252-D254 PolarHBondContact O-N 3.17Å
255	P	27.8	Very low	29.9	Very low	109 Å²	109	124.9 Å²	124.9	71%	0.708	80%	0.796	S	S	*	*			trans	-84	129.2	161.8	33.2	-28.5	0	0	0	109.1	T253	T253-P255 VanDerWaalsContact O-CD 3.32Å; T253-P255 WeakPolarHBondContact O-CD 3.45Å
256	L	32.9	Very low	30.2	Very low	181 Å²	181	126.6 Å²	126.6	95%	0.948	79%	0.792	S	S	*	*			trans	165.2	124	144.3	-90.7	159.6	0	0	0	111.3
257	G	28.3	Very low	30.4	Very low	73 Å²	73	127.8 Å²	127.8	75%	0.753	78%	0.784	S	S	*	*			trans	93.9	38	151.6	0	0	0	0	0	119.1
258	A	28	Very low	30.7	Very low	108 Å²	108	128.4 Å²	128.4	89%	0.893	79%	0.79	S	S	*	*			trans	-75.4	120.8	161.9	0	0	0	0	0	110.3
259	S	29.3	Very low	30.8	Very low	102 Å²	102	127.7 Å²	127.7	71%	0.713	79%	0.793	S	S	*	*			trans	-138.4	118.4	170.9	-66	0	0	0	0	110.1
260	I	24.8	Very low	31.3	Very low	165 Å²	165	129.2 Å²	129.2	85%	0.846	80%	0.795	S	S	*	*			trans	67.9	105.6	161.4	-44.5	159.9	0	0	0	116.3
261	A	31.8	Very low	31.6	Very low	99 Å²	99	128.4 Å²	128.4	82%	0.818	80%	0.796	S	S	*	*			trans	-155.5	115.1	137.3	0	0	0	0	0	108.1
262	S	26.1	Very low	31.7	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	80%	0.797	S	S	*	*			trans	-85.2	131.3	174.8	-56.5	0	0	0	0	109.8
263	S	40.4	Very low	32.1	Very low	111 Å²	111	131 Å²	131	78%	0.776	80%	0.804	S	S	*	*			trans	-162.5	91.4	163.2	-71.3	0	0	0	0	109.9
264	D	32.1	Very low	32.3	Very low	147 Å²	147	130.4 Å²	130.4	79%	0.786	80%	0.804	S	S	*	*			trans	49.1	133	133.3	-68.7	-57.8	0	0	0	125
265	L	33.6	Very low	32.3	Very low	141 Å²	141	134.7 Å²	134.7	74%	0.738	81%	0.81	S	S	*	*			trans	82.2	106.9	142	-65.9	163.1	0	0	0	121.9
266	K	35.4	Very low	32.7	Very low	156 Å²	156	141.6 Å²	141.6	68%	0.678	82%	0.822	S	S	*	*				91.3	116.6	125	-78.1	-178.8	170	-120.2	0	122.5
267	E	34.1	Very low	32.5	Very low	160 Å²	160	139.8 Å²	139.8	75%	0.748	82%	0.818	S	S	*	*				78.5	126.4	126.5	-69.9	166.2	-155.1	0	0	121.7
268	G	32.6	Very low	32.8	Very low	84 Å²	84	141.2 Å²	141.2	87%	0.866	82%	0.823	S	S	*	*			trans	113.7	126.2	139.2	0	0	0	0	0	117.8
269	G	34.8	Very low	32.8	Very low	84 Å²	84	141.5 Å²	141.5	87%	0.866	82%	0.819	S	S	*	*			trans	113.3	94.5	156.2	0	0	0	0	0	116.9
270	Q	35.8	Very low	33	Very low	184 Å²	184	145.9 Å²	145.9	86%	0.86	83%	0.828	S	S	*	*			trans	-92.6	-177.4	167.2	-71.7	-176.2	-11.5	0	0	112.1
271	T	35.9	Very low	33.4	Very low	148 Å²	148	142.2 Å²	142.2	91%	0.908	82%	0.822	S	S	*	*			trans	87.7	139.7	173.1	78.5	0	0	0	0	116.1
272	G	31.7	Very low	33.5	Very low	71 Å²	71	146.4 Å²	146.4	73%	0.732	82%	0.824	S	S	*	*			cis	146.1	82.7	-13.8	0	0	0	0	0	116
273	R	36.8	Very low	33.6	Very low	251 Å²	251	149 Å²	149	95%	0.947	82%	0.824	S	S	*	*			trans	-173.6	121.5	155.3	-105.7	160.6	179.2	-177.4	-0.5	108.4
274	S	34	Very low	33.3	Very low	106 Å²	106	149.1 Å²	149.1	74%	0.741	83%	0.825	S	S	*	*				91.1	99	61.3	-154.2	0	0	0	0	113.8
275	R	32.5	Very low	33.3	Very low	234 Å²	234	149.4 Å²	149.4	88%	0.883	83%	0.826	S	S	*	*			trans	25	134.2	136.3	-63.6	-178.7	-178.8	-179.2	1.8	119.5
276	R	35.3	Very low	33.2	Very low	255 Å²	255	149.5 Å²	149.5	96%	0.962	83%	0.833	S	S	*	*				-161.5	153.8	110.3	-103	165.4	-162.1	-167.9	4.8	112
277	T	30.3	Very low	33.1	Very low	142 Å²	142	151.3 Å²	151.3	87%	0.871	84%	0.841	S	S	*	*			trans	-110.5	146.8	-177.1	45.6	0	0	0	0	110.4
278	A	33.7	Very low	33	Very low	104 Å²	104	153.8 Å²	153.8	86%	0.86	85%	0.849	S	S	*	*			trans	-162.2	135.4	151	0	0	0	0	0	110.9
279	S	28.9	Very low	33	Very low	114 Å²	114	153.4 Å²	153.4	80%	0.797	84%	0.837	S	S	*	*			trans	-105.1	149.1	160.9	-60.8	0	0	0	0	108.3
280	Q	33.4	Very low	32.9	Very low	194 Å²	194	156.6 Å²	156.6	91%	0.907	84%	0.84	S	S	*	*			trans	143.6	157.2	140.5	-81.7	178.9	-14.1	0	0	113.7
281	A	32.9	Very low	32.7	Very low	88 Å²	88	151.1 Å²	151.1	73%	0.727	83%	0.834	S	S	*	*			trans	88	111.7	152	0	0	0	0	0	119.9
282	H	33	Very low	32.4	Very low	186 Å²	186	149.6 Å²	149.6	86%	0.861	83%	0.828	S	S	*	*				97.5	130.5	125.7	-107.9	-81.5	0	0	0	122.8
283	E	28.2	Very low	32.3	Very low	168 Å²	168	152.6 Å²	152.6	79%	0.785	83%	0.827	S	S	*	*			trans	-85.3	140	171.8	168.2	-178.3	-155.3	0	0	110.6
284	S	34.1	Very low	32	Very low	114 Å²	114	148.6 Å²	148.6	80%	0.797	82%	0.823	S	S	*	*			trans	179.4	152	148.6	40.4	0	0	0	0	112.1
285	D	31.7	Very low	31.8	Very low	153 Å²	153	147.1 Å²	147.1	82%	0.818	83%	0.825	S	S	*	*			trans	-68	167.7	-175.3	-55.4	-94.7	0	0	0	116
286	V	32.9	Very low	31.4	Very low	144 Å²	144	141.9 Å²	141.9	87%	0.873	83%	0.825	S	S	*	*				175.7	143.7	114.9	153.1	0	0	0	0	112.3
287	K	31.9	Very low	31.4	Very low	194 Å²	194	135.3 Å²	135.3	84%	0.843	82%	0.815	S	S	*	*			trans	-82.5	149.9	-179.1	-59	162.1	178	168.8	0	113.6
288	K	32.9	Very low	31.2	Very low	211 Å²	211	136.3 Å²	136.3	92%	0.917	82%	0.815	S	S	*	*			trans	169.5	152.6	144.1	-97.4	170.5	174.8	179.9	0	109.1
289	A	31.4	Very low	31.1	Very low	76 Å²	76	134.9 Å²	134.9	63%	0.628	81%	0.81	S	S	*	*			cis	-170.9	-179.3	-18.6	0	0	0	0	0	109.4
290	T	34.5	Very low	31	Very low	151 Å²	151	138.4 Å²	138.4	93%	0.926	81%	0.812	S	S	*	*			trans	72.2	134.8	179.7	75.6	0	0	0	0	114.3
291	G	31.1	Very low	30.7	Very low	70 Å²	70	135.9 Å²	135.9	72%	0.722	80%	0.804	S	S	*	*			cis	161.3	146	-1.5	0	0	0	0	0	106.8
292	C	29.1	Very low	30.4	Very low	116 Å²	116	138.6 Å²	138.6	78%	0.784	81%	0.811	S	S	*	*			cis	-156	161.2	14.6	-67.3	0	0	0	0	111.3
293	N	30	Very low	30.1	Very low	133 Å²	133	134.5 Å²	134.5	71%	0.711	80%	0.803	S	S	*	*			trans	53	116.9	145.5	-61.7	-19.7	0	0	0	121.1
294	L	29.3	Very low	30.1	Very low	167 Å²	167	133.3 Å²	133.3	87%	0.874	81%	0.808	S	S	*	*				63.7	126.1	84.5	-62.7	170.2	0	0	0	113.1
295	G	29.8	Very low	30	Very low	76 Å²	76	133.5 Å²	133.5	78%	0.784	81%	0.806	S	S	*	*			cis	-175.3	178.3	-1	0	0	0	0	0	111.7
296	S	25.2	Very low	29.9	Very low	124 Å²	124	133 Å²	133	87%	0.867	81%	0.808	S	S	*	*			trans	-75.5	161.1	168.7	-109.2	0	0	0	0	111.1
297	P	35.3	Very low	29.7	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	80%	0.8	S	S	*	*				-150.8	-162.3	61.3	42.4	-20.3	0	0	0	116.8
298	D	26.8	Very low	29.5	Very low	163 Å²	163	125.7 Å²	125.7	87%	0.872	79%	0.794	S	S	*	*			trans	-61.2	158.9	-171.2	-47	-88.8	0	0	0	117.2
299	G	29.9	Very low	29.2	Very low	74 Å²	74	126.6 Å²	126.6	76%	0.763	79%	0.793	S	S	*	*			trans	175.3	80.9	172.6	0	0	0	0	0	118.3
300	F	28.2	Very low	29.2	Very low	189 Å²	189	129 Å²	129	83%	0.829	80%	0.802	S	S	*	*			trans	30.4	125.4	142	-89.3	-117.4	0	0	0	122.8
301	L	25.8	Very low	28.9	Very low	141 Å²	141	125.5 Å²	125.5	74%	0.738	80%	0.796	S	S	*	*			trans	50.2	120.8	139.1	-51.8	-179.9	0	0	0	120.7
302	T	28	Very low	28.7	Very low	144 Å²	144	130.9 Å²	130.9	88%	0.883	80%	0.802	S	S	*	*				-177.7	160.8	91.1	29.7	0	0	0	0	112.2
303	S	25.9	Very low	28.6	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	81%	0.805	S	S	*	*			trans	-87.2	155.8	-171.2	52.6	0	0	0	0	115.3
304	T	28.7	Very low	28.6	Very low	143 Å²	143	133 Å²	133	88%	0.877	80%	0.802	S	S	*	*				-167.3	141.3	118.6	15.4	0	0	0	0	112.4
305	P	31.7	Very low	28.6	Very low	118 Å²	118	134.8 Å²	134.8	77%	0.766	80%	0.799	S	S	*	*			trans	-116.8	163.6	-174.7	41.2	-31.9	0	0	0	114.8
306	V	30.2	Very low	28.5	Very low	142 Å²	142	136.8 Å²	136.8	86%	0.861	79%	0.791	S	S	*	*			trans	-143.4	125.4	165.7	-179	0	0	0	0	113.2
307	S	28.3	Very low	28.6	Very low	99 Å²	99	138 Å²	138	69%	0.692	79%	0.793	S	S	*	*			trans	35.3	112.8	155.3	-147.3	0	0	0	0	120
308	A	26.9	Very low	28.3	Very low	87 Å²	87	140.6 Å²	140.6	72%	0.719	79%	0.793	S	S	*	*			cis	73.1	117.5	49.7	0	0	0	0	0	115.9
309	Y	27.5	Very low	28.5	Very low	229 Å²	229	139.9 Å²	139.9	90%	0.898	79%	0.789	S	S	*	*			trans	-156.3	141.1	132.5	-106.4	-78.4	0	0	0	109.3
310	P	30.1	Very low	28.5	Very low	127 Å²	127	145.7 Å²	145.7	83%	0.825	80%	0.795	S	S	*	*			trans	-111.9	165.9	-160.4	39.8	-30.3	0	0	0	115.3
311	G	29.1	Very low	28.8	Very low	78 Å²	78	145 Å²	145	80%	0.804	80%	0.795	S	S	*	*			trans	-168	48.9	178.1	0	0	0	0	0	114.3
312	H	27.7	Very low	29.2	Very low	182 Å²	182	147.5 Å²	147.5	84%	0.843	80%	0.803	S	S	*	*			trans	-94.4	117.3	176.3	-117.7	-107.7	0	0	0	110.6
313	F	27.1	Very low	29.4	Very low	194 Å²	194	149.7 Å²	149.7	85%	0.851	80%	0.803	S	S	*	*			trans	-102.8	114.1	158.8	-103.2	-83	0	0	0	108.2
314	P	29.6	Very low	29.9	Very low	100 Å²	100	154.1 Å²	154.1	65%	0.649	81%	0.813	S	S	*	*			trans	-84.6	131.6	173.8	32.9	-30.3	0	0	0	109.9
315	Y	28.2	Very low	30.3	Very low	204 Å²	204	155.9 Å²	155.9	80%	0.8	81%	0.811	S	S	*	*			trans	-132.3	96.2	162	-107.1	-86.5	0	0	0	111
316	L	28.3	Very low	30.3	Very low	118 Å²	118	159.3 Å²	159.3	62%	0.618	82%	0.816	S	S	*	*			trans	50.1	93.1	144.5	-52.8	178.2	0	0	0	117.1	F318	L316-F318 HydrophobicContact CB-CD2 3.98Å; L316-F318 HydrophobicContact CB-CE2 4.24Å; L316-F318 HydrophobicContact CD1-CD2 4.46Å; L316-F318 HydrophobicContact CD1-CE2 3.91Å; L316-F318 PolarHBondContact O-N 3.26Å
317	V	26.9	Very low	30.2	Very low	149 Å²	149	157 Å²	157	90%	0.903	81%	0.812	S	S	*	*			trans	-57.2	119.2	143.1	177.3	0	0	0	0	107.3
318	F	29.7	Very low	30.4	Very low	172 Å²	172	159.2 Å²	159.2	75%	0.754	82%	0.816	S	S	*	*			trans	-113.8	147.5	168.8	-106.3	-70.6	0	0	0	110.2	L316	L316-F318 HydrophobicContact CB-CD2 3.98Å; L316-F318 HydrophobicContact CB-CE2 4.24Å; L316-F318 HydrophobicContact CD1-CD2 4.46Å; L316-F318 HydrophobicContact CD1-CE2 3.91Å; L316-F318 PolarHBondContact O-N 3.26Å
319	D	29.9	Very low	30.5	Very low	147 Å²	147	164.6 Å²	164.6	79%	0.786	82%	0.823	S	S	*	*			trans	-62.5	142.9	-156.6	-92.9	-62.1	0	0	0	117.2	Q321	D319-Q321 VanDerWaalsContact C-N 3.27Å; D319-Q321 PolarHBondContact O-N 2.85Å
320	H	30.6	Very low	30.6	Very low	196 Å²	196	158.4 Å²	158.4	91%	0.907	82%	0.819	S	S	*	*	S	Bend	trans	-85.5	53.8	-178.6	-168.2	61.2	0	0	0	111.9
321	Q	34.1	Very low	30.6	Very low	174 Å²	174	158.1 Å²	158.1	81%	0.813	82%	0.816	S	S	*	*			trans	-150.1	40.4	-173	-147.9	168.5	-1	0	0	117.9	D319	D319-Q321 VanDerWaalsContact C-N 3.27Å; D319-Q321 PolarHBondContact O-N 2.85Å
322	Q	34.2	Very low	30.6	Very low	194 Å²	194	160.3 Å²	160.3	91%	0.907	82%	0.816	S	S	*	*	S	Bend	trans	-155.1	67.4	166.3	-131.2	175.5	51.5	0	0	116.5
323	Q	33.6	Very low	30.6	Very low	190 Å²	190	155 Å²	155	89%	0.888	80%	0.803	S	S	*	*			trans	-150.5	17.7	161.8	-122.1	164.5	21.7	0	0	116.8	Q325	Q323-Q325 VanDerWaalsContact C-N 3.29Å; Q323-Q325 PolarHBondContact O-N 3.05Å; Q323-Q325 VanDerWaalsContact O-N 3.09Å
324	Q	34.8	Very low	30.7	Very low	193 Å²	193	152 Å²	152	90%	0.902	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	64.7	169.9	-68.4	-175.9	-4.9	0	0	112
325	Q	37.4	Very low	30.6	Very low	181 Å²	181	153.7 Å²	153.7	85%	0.846	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.5	5.4	170	-118.4	163.6	54.4	0	0	117.1	Q323	Q323-Q325 VanDerWaalsContact C-N 3.29Å; Q323-Q325 PolarHBondContact O-N 3.05Å; Q323-Q325 VanDerWaalsContact O-N 3.09Å
326	H	33.1	Very low	30.8	Very low	190 Å²	190	150.9 Å²	150.9	88%	0.88	81%	0.811	S	S	*	*			trans	-121	44.2	164.7	-72.6	-57.7	0	0	0	112.5	N328	H326-N328 PolarHBondContact O-N 3.15Å; H326-N328 VanDerWaalsContact O-N 3.15Å
327	A	27.8	Very low	30.9	Very low	92 Å²	92	151.3 Å²	151.3	76%	0.76	81%	0.814	S	S	*	*			trans	-73.3	97.3	162.7	0	0	0	0	0	109.4
328	N	31	Very low	31.3	Very low	147 Å²	147	152.5 Å²	152.5	79%	0.786	81%	0.81	S	S	*	*			trans	-174.1	129.5	153	-102	-48.8	0	0	0	112.7	H326	H326-N328 PolarHBondContact O-N 3.15Å; H326-N328 VanDerWaalsContact O-N 3.15Å
329	K	30.5	Very low	31.5	Very low	199 Å²	199	149 Å²	149	87%	0.865	81%	0.812	S	S	*	*	S	Bend	trans	70.9	89.7	162.7	-55.5	166.2	-178.1	172	0	118.4
330	A	29.5	Very low	31.7	Very low	99 Å²	99	149.1 Å²	149.1	82%	0.818	81%	0.812	S	S	*	*			trans	-175.7	57.4	131.6	0	0	0	0	0	113.2
331	T	30.1	Very low	32.1	Very low	122 Å²	122	145.4 Å²	145.4	75%	0.748	80%	0.803	S	S	*	*			trans	-112.2	115.5	166.5	47.2	0	0	0	0	109.2	A333	T331-A333 PolarHBondContact O-N 3.37Å
332	P	29.5	Very low	32.4	Very low	124 Å²	124	145.5 Å²	145.5	81%	0.805	80%	0.801	S	S	*	*			trans	-81.1	56.5	172.1	34.8	-33.9	0	0	0	110.5
333	A	27.7	Very low	32.2	Very low	69 Å²	69	144 Å²	144	57%	0.57	80%	0.799	S	S	*	*			trans	-115.7	147.5	163.6	0	0	0	0	0	107.3	T331	T331-A333 PolarHBondContact O-N 3.37Å
334	V	29	Very low	32.1	Very low	133 Å²	133	146.9 Å²	146.9	81%	0.806	80%	0.802	S	S	*	*			trans	72.1	88	-172.6	-164.7	0	0	0	0	114
335	C	26.6	Very low	32	Very low	135 Å²	135	140.6 Å²	140.6	91%	0.912	79%	0.789	S	S	*	*			trans	-146	40.7	155	-108.3	0	0	0	0	110.4
336	L	33.6	Very low	31.8	Very low	145 Å²	145	138.7 Å²	138.7	76%	0.759	79%	0.789	S	S	*	*	S	Bend	trans	-110.4	156.1	153.3	-83.8	81.6	0	0	0	107.1
337	D	29.9	Very low	31.6	Very low	126 Å²	126	133.3 Å²	133.3	67%	0.674	79%	0.785	S	S	*	*	S	Bend	trans	77.7	23	169	-56.3	-29.2	0	0	0	121.5
338	E	34.9	Very low	32	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	79%	0.79	S	S	*	*	S	Bend	trans	-101.6	-0.3	166.7	-107.1	-164.2	137.7	0	0	116.1
339	A	33	Very low	32	Very low	98 Å²	98	139.9 Å²	139.9	81%	0.81	80%	0.795	S	S	*	*	S	Bend	trans	-97.2	-10.6	179.9	0	0	0	0	0	115.2
340	L	35.1	Very low	31.8	Very low	151 Å²	151	140.5 Å²	140.5	79%	0.791	80%	0.798	S	S	*	*	S	Bend	trans	-106.2	-2.3	-169.2	-84.8	165.2	0	0	0	115.8
341	V	39.1	Very low	32	Very low	118 Å²	118	141.4 Å²	141.4	72%	0.715	80%	0.796	S	S	*	*	S	Bend	trans	-109.5	-5.9	-168.8	-175.9	0	0	0	0	114.3
342	K	39.1	Very low	32.1	Very low	176 Å²	176	144 Å²	144	77%	0.765	80%	0.801	S	S	*	*	S	Bend	trans	-104.1	-2.1	-173	-79.6	175	178.8	161.9	0	117.3
343	N	31.9	Very low	32.2	Very low	163 Å²	163	144.5 Å²	144.5	87%	0.872	80%	0.804	S	S	*	*			trans	-103.9	60.8	173.9	-74.1	-23.6	0	0	0	112.2
344	R	31.4	Very low	32.3	Very low	250 Å²	250	144.5 Å²	144.5	94%	0.943	81%	0.811	S	S	*	*			trans	-95.7	95.7	160.1	-82.4	-174.2	176.4	171.1	0.1	109
345	G	31.2	Very low	32.4	Very low	61 Å²	61	146.6 Å²	146.6	63%	0.629	81%	0.812	S	S	*	*	S	Bend	trans	155.9	139.1	175.1	0	0	0	0	0	112.1
346	V	34.8	Very low	32.6	Very low	140 Å²	140	145 Å²	145	85%	0.848	80%	0.8	S	S	*	*			trans	65.5	91.4	178.7	-162.1	0	0	0	0	114.1
347	G	27.4	Very low	32.5	Very low	78 Å²	78	143.8 Å²	143.8	80%	0.804	80%	0.798	S	S	*	*			trans	-67.7	134.5	170.4	0	0	0	0	0	112.2
348	K	35.7	Very low	32.7	Very low	195 Å²	195	143.5 Å²	143.5	85%	0.848	80%	0.801	S	S	*	*			trans	-153.5	130.8	158.6	-104	160.1	-173.1	-180	0	108.6
349	M	32.2	Very low	32.6	Very low	181 Å²	181	140.7 Å²	140.7	89%	0.892	79%	0.792	S	S	*	*			trans	-13.6	132.2	-177.7	-65.7	156	73.2	0	0	119.2
350	F	26.1	Very low	32.6	Very low	212 Å²	212	142 Å²	142	93%	0.93	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-62.1	136.9	166.9	-75	-100.8	0	0	0	112.6
351	P	34.7	Very low	32.7	Very low	119 Å²	119	140.6 Å²	140.6	77%	0.773	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-94.6	147.5	149.3	33	-26.1	0	0	0	111.3
352	M	30.7	Very low	32.3	Very low	177 Å²	177	142.4 Å²	142.4	87%	0.872	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-62.8	149.8	-175.2	-73.2	-75.1	-172.8	0	0	114.2	G354	M352-G354 PolarHBondContact O-N 3.13Å
353	P	32.3	Very low	32.2	Very low	133 Å²	133	137.6 Å²	137.6	86%	0.864	77%	0.768	S	S	*	*	S	Bend	trans	-76	102.9	172.1	31.6	-32.1	0	0	0	110.2
354	G	30.3	Very low	32.5	Very low	70 Å²	70	136.5 Å²	136.5	72%	0.722	77%	0.768	S	S	*	*			trans	-152.8	15.6	-170.1	0	0	0	0	0	117.4	M352	M352-G354 PolarHBondContact O-N 3.13Å
355	Q	29.5	Very low	32.8	Very low	177 Å²	177	134.4 Å²	134.4	83%	0.827	76%	0.76	S	S	*	*			trans	-137.9	125.2	173.8	-70.8	-166.4	-26	0	0	112.2	V357	Q355-V357 PolarHBondContact O-N 2.89Å
356	P	30.7	Very low	33.2	Very low	100 Å²	100	132.4 Å²	132.4	65%	0.649	74%	0.736	S	S	*	*			trans	-70.7	115.9	168.5	29.3	-31.4	0	0	0	108.6	V358	P356-V358 VanDerWaalsContact C-N 3.3Å; P356-V358 PolarHBondContact O-N 3.39Å
357	V	31.8	Very low	33.8	Very low	120 Å²	120	132.7 Å²	132.7	73%	0.727	73%	0.728	S	S	*	*			trans	-71.6	90.8	172.5	-174.6	0	0	0	0	108.1	Q355 N359	Q355-V357 PolarHBondContact O-N 2.89Å; V357-N359 VanDerWaalsContact C-N 3.29Å; V357-N359 WeakPolarHBondContact CG1-OD1 3.41Å; V357-N359 PolarHBondContact O-N 3.2Å
358	V	34.3	Very low	34.8	Very low	121 Å²	121	134.4 Å²	134.4	73%	0.733	72%	0.718	S	S	*	*			trans	-68.9	90.6	173.9	-172.7	0	0	0	0	107.9	P356 N360	P356-V358 VanDerWaalsContact C-N 3.3Å; P356-V358 PolarHBondContact O-N 3.39Å; V358-N360 PolarHBondContact O-N 3.27Å
359	N	33.2	Very low	35	Very low	115 Å²	115	128 Å²	128	62%	0.615	70%	0.697	S	S	*	*			trans	-69.9	73.1	175.2	-79.9	-27.1	0	0	0	110.3	V357 H361	V357-N359 VanDerWaalsContact C-N 3.29Å; V357-N359 WeakPolarHBondContact CG1-OD1 3.41Å; V357-N359 PolarHBondContact O-N 3.2Å; N359-H361 PolarHBondContact O-N 2.93Å
360	N	32.7	Very low	35.8	Very low	126 Å²	126	122.8 Å²	122.8	67%	0.674	67%	0.67	S	S	*	*			trans	-72.9	72.7	175.5	-169	6.2	0	0	0	109.9	V358 N362	V358-N360 PolarHBondContact O-N 3.27Å; N360-N362 PolarHBondContact O-N 2.89Å; N360-N362 WeakPolarHBondContact OD1-CB 3.2Å
361	H	37.1	Very low	37.2	Very low	121 Å²	121	119.2 Å²	119.2	56%	0.56	66%	0.655	S	S	*	*			trans	-74.3	18.5	179.2	-87.4	-50.6	0	0	0	114	N359 S363	N359-H361 PolarHBondContact O-N 2.93Å; H361-S363 PolarHBondContact O-N 2.95Å
362	N	30.3	Very low	38	Very low	155 Å²	155	119.4 Å²	119.4	83%	0.829	65%	0.645	S	S	*	*			trans	-80.8	61	173.3	-147.5	14.4	0	0	0	111	N360	N360-N362 PolarHBondContact O-N 2.89Å; N360-N362 WeakPolarHBondContact OD1-CB 3.2Å
363	S	37.5	Very low	38.5	Very low	75 Å²	75	118.2 Å²	118.2	52%	0.524	64%	0.635	S	S	.	*	S	Bend	trans	-148.2	136.8	175	-176.1	0	0	0	0	110.5	H361 R365	H361-S363 PolarHBondContact O-N 2.95Å; S363-R365 PolarHBondContact O-N 3.1Å
364	T	39.2	Very low	39.6	Very low	141 Å²	141	119.8 Å²	119.8	87%	0.865	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	9.6	177.7	44.5	0	0	0	0	114.8	Q370	T364-Q370 PolarHBondContact O-NE2 3.4Å
365	R	36.5	Very low	40.7	Very low	206 Å²	206	123.6 Å²	123.6	78%	0.777	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-2.7	-170.3	-157.1	168.9	-176.6	143.9	-0.2	114.8	S363 Q367	S363-R365 PolarHBondContact O-N 3.1Å; R365-Q367 PolarHBondContact O-N 3.37Å; R365-Q367 VanDerWaalsContact O-N 3.15Å
366	C	40.2	Very low	41.5	Very low	19 Å²	19	117.3 Å²	117.3	13%	0.128	60%	0.599	C	S	.	*			trans	-64.6	114.8	177.3	-177.7	0	0	0	0	111.3	I368 C369 Q370	C366-I368 PolarHBondContact O-N 3.13Å; C366-C369 HydrophobicContact CB-CB 4.03Å; C366-C369 PolarHBondContact O-N 3.32Å; C366-C369 VanDerWaalsContact SG-SG 3.68Å; C366-Q370 WeakPolarHBondContact O-CG 3.31Å; C366-Q370 PolarHBondContact O-N 3.49Å
367	Q	47	Very low	42.2	Very low	146 Å²	146	115.2 Å²	115.2	68%	0.682	59%	0.59	S	S	*	*	H	α-helix	trans	-61.9	-28.4	-178.5	-73.6	-173.6	-3.3	0	0	113.4	R365 K371	R365-Q367 PolarHBondContact O-N 3.37Å; R365-Q367 VanDerWaalsContact O-N 3.15Å; Q367-K371 WeakPolarHBondContact O-CB 3.4Å; Q367-K371 WeakPolarHBondContact O-CG 3.47Å; Q367-K371 PolarHBondContact O-N 3.33Å
368	I	48.7	Very low	43.1	Very low	113 Å²	113	114.7 Å²	114.7	58%	0.579	58%	0.583	S	S	*	*	H	α-helix	trans	-67.9	-55.5	175.4	-61.2	170.8	0	0	0	108.7	C366 Q370 K371 H372	C366-I368 PolarHBondContact O-N 3.13Å; I368-Q370 VanDerWaalsContact C-N 3.3Å; I368-Q370 PolarHBondContact O-N 3.29Å; I368-K371 WeakPolarHBondContact O-CA 3.48Å; I368-K371 WeakPolarHBondContact O-CB 3.44Å; I368-K371 PolarHBondContact O-N 3.35Å; I368-H372 PolarHBondContact O-CD2 3.44Å; I368-H372 VanDerWaalsContact O-CD2 3.23Å; I368-H372 PolarHBondContact O-N 2.97Å
369	C	40.6	Very low	44	Very low	62 Å²	62	112.9 Å²	112.9	42%	0.419	57%	0.569	S	S	.	*	H	α-helix	trans	-55.8	-44.2	176	-55.1	0	0	0	0	111.6	C366 K371 H372 F373	C366-C369 HydrophobicContact CB-CB 4.03Å; C366-C369 PolarHBondContact O-N 3.32Å; C366-C369 VanDerWaalsContact SG-SG 3.68Å; C369-K371 VanDerWaalsContact C-N 3.33Å; C369-K371 PolarHBondContact O-N 3.06Å; C369-H372 PolarHBondContact O-N 3.34Å; C369-F373 WeakPolarHBondContact O-CD2 3.43Å; C369-F373 PolarHBondContact O-N 3.38Å
370	Q	49.5	Very low	44.5	Very low	70 Å²	70	110 Å²	110	33%	0.327	56%	0.561	S	S	.	*	H	α-helix	trans	-61.8	-35.9	175.4	-71.7	-173	3.6	0	0	113.1	T364 C366 I368 R374	T364-Q370 PolarHBondContact O-NE2 3.4Å; C366-Q370 WeakPolarHBondContact O-CG 3.31Å; C366-Q370 PolarHBondContact O-N 3.49Å; I368-Q370 VanDerWaalsContact C-N 3.3Å; I368-Q370 PolarHBondContact O-N 3.29Å; Q370-R374 VanDerWaalsContact O-CB 3.26Å; Q370-R374 WeakPolarHBondContact O-CB 3.36Å; Q370-R374 WeakPolarHBondContact O-CG 3.43Å; Q370-R374 PolarHBondContact O-N 3.28Å
371	K	54.9	Low	45.2	Very low	138 Å²	138	109.3 Å²	109.3	60%	0.6	56%	0.557	S	S	*	*	H	α-helix	trans	-66.6	-40.4	173	-80.5	174.5	178.6	176.1	0	111.9	Q367 I368 C369 K375	Q367-K371 WeakPolarHBondContact O-CB 3.4Å; Q367-K371 WeakPolarHBondContact O-CG 3.47Å; Q367-K371 PolarHBondContact O-N 3.33Å; I368-K371 WeakPolarHBondContact O-CA 3.48Å; I368-K371 WeakPolarHBondContact O-CB 3.44Å; I368-K371 PolarHBondContact O-N 3.35Å; C369-K371 VanDerWaalsContact C-N 3.33Å; C369-K371 PolarHBondContact O-N 3.06Å; K371-K375 WeakPolarHBondContact O-CB 3.39Å; K371-K375 WeakPolarHBondContact O-CG 3.39Å; K371-K375 PolarHBondContact O-N 3.03Å
372	H	50	Low	45.7	Very low	123 Å²	123	109.1 Å²	109.1	57%	0.569	56%	0.556	S	S	*	*	H	α-helix	trans	-67.4	-47.2	175.8	-74.8	-84.1	0	0	0	112	I368 C369 R374 K375 A376	I368-H372 PolarHBondContact O-CD2 3.44Å; I368-H372 VanDerWaalsContact O-CD2 3.23Å; I368-H372 PolarHBondContact O-N 2.97Å; C369-H372 PolarHBondContact O-N 3.34Å; H372-R374 PolarHBondContact O-N 2.94Å; H372-K375 PolarHBondContact O-N 2.91Å; H372-A376 PolarHBondContact O-N 3.17Å
373	F	43.1	Very low	46.2	Very low	151 Å²	151	105.2 Å²	105.2	66%	0.662	54%	0.535	S	S	*	.	H	α-helix	trans	-60.9	-41.6	174.9	-87.5	-76.6	0	0	0	112.6	C369 A376 A377	C369-F373 WeakPolarHBondContact O-CD2 3.43Å; C369-F373 PolarHBondContact O-N 3.38Å; F373-A376 PolarHBondContact O-N 3.09Å; F373-A377 VanDerWaalsContact O-CB 3.25Å; F373-A377 WeakPolarHBondContact O-CB 3.38Å; F373-A377 PolarHBondContact O-N 3.45Å
374	R	54.4	Low	46.5	Very low	167 Å²	167	106 Å²	106	63%	0.63	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-37.8	174.7	-75.7	176.4	-176.3	-176.6	3.1	112.6	Q370 H372 N378	Q370-R374 VanDerWaalsContact O-CB 3.26Å; Q370-R374 WeakPolarHBondContact O-CB 3.36Å; Q370-R374 WeakPolarHBondContact O-CG 3.43Å; Q370-R374 PolarHBondContact O-N 3.28Å; H372-R374 PolarHBondContact O-N 2.94Å; R374-N378 WeakPolarHBondContact O-CB 3.29Å; R374-N378 PolarHBondContact O-N 2.82Å; R374-N378 PolarHBondContact O-ND2 3.41Å
375	K	54.1	Low	46.9	Very low	150 Å²	150	104 Å²	104	65%	0.652	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-45.5	174	-78.1	179.3	177.3	-174	0	111.7	K371 H372 L379	K371-K375 WeakPolarHBondContact O-CB 3.39Å; K371-K375 WeakPolarHBondContact O-CG 3.39Å; K371-K375 PolarHBondContact O-N 3.03Å; H372-K375 PolarHBondContact O-N 2.91Å; K375-L379 WeakPolarHBondContact O-CB 3.05Å; K375-L379 PolarHBondContact O-N 2.86Å
376	A	45.8	Very low	47.2	Very low	45 Å²	45	101.7 Å²	101.7	37%	0.372	52%	0.519	S	S	.	.	H	α-helix	trans	-63.9	-46.1	177	0	0	0	0	0	112.2	H372 F373 L379 A380	H372-A376 PolarHBondContact O-N 3.17Å; F373-A376 PolarHBondContact O-N 3.09Å; A376-L379 PolarHBondContact O-N 3.03Å; A376-A380 PolarHBondContact O-N 2.88Å
377	A	46	Very low	47.1	Very low	56 Å²	56	105.9 Å²	105.9	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-44	177.3	0	0	0	0	0	112.1	F373 L379 A380 L381	F373-A377 VanDerWaalsContact O-CB 3.25Å; F373-A377 WeakPolarHBondContact O-CB 3.38Å; F373-A377 PolarHBondContact O-N 3.45Å; A377-L379 VanDerWaalsContact C-N 3.33Å; A377-L379 PolarHBondContact O-N 3.42Å; A377-A380 PolarHBondContact O-N 3.28Å; A377-L381 WeakPolarHBondContact O-CB 3.37Å; A377-L381 PolarHBondContact O-N 2.99Å
378	N	50.7	Low	46.5	Very low	108 Å²	108	109.7 Å²	109.7	58%	0.578	55%	0.545	S	S	*	.	H	α-helix	trans	-64.6	-36.2	175.7	-76	-14.8	0	0	0	111.9	R374 L381 H382	R374-N378 WeakPolarHBondContact O-CB 3.29Å; R374-N378 PolarHBondContact O-N 2.82Å; R374-N378 PolarHBondContact O-ND2 3.41Å; N378-L381 PolarHBondContact O-N 2.86Å; N378-H382 VanDerWaalsContact O-CB 3.29Å; N378-H382 WeakPolarHBondContact O-CB 3.3Å; N378-H382 PolarHBondContact O-N 3.3Å
379	L	52.7	Low	45.6	Very low	83 Å²	83	112.5 Å²	112.5	44%	0.435	55%	0.553	S	S	.	*	H	α-helix	trans	-67.4	-43.4	175.3	-169.4	68.2	0	0	0	111.5	K375 A376 A377 L381 H382 L383 M535	K375-L379 WeakPolarHBondContact O-CB 3.05Å; K375-L379 PolarHBondContact O-N 2.86Å; A376-L379 PolarHBondContact O-N 3.03Å; A377-L379 VanDerWaalsContact C-N 3.33Å; A377-L379 PolarHBondContact O-N 3.42Å; L379-L381 VanDerWaalsContact C-N 3.31Å; L379-L381 PolarHBondContact O-N 2.88Å; L379-H382 PolarHBondContact O-N 3.24Å; L379-L383 HydrophobicContact CG-CD1 4.3Å; L379-L383 WeakPolarHBondContact O-CB 3.37Å; L379-L383 VanDerWaalsContact O-CG 3.27Å; L379-L383 WeakPolarHBondContact O-CG 3.44Å; L379-L383 PolarHBondContact O-N 3.5Å; L379-M535 HydrophobicContact CD2-CE 3.57Å
380	A	43.2	Very low	45.2	Very low	55 Å²	55	114.5 Å²	114.5	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-61.5	-38.3	173.7	0	0	0	0	0	112.3	A376 A377 T384	A376-A380 PolarHBondContact O-N 2.88Å; A377-A380 PolarHBondContact O-N 3.28Å; A380-T384 WeakPolarHBondContact O-CG2 3.31Å; A380-T384 PolarHBondContact O-N 3.4Å; A380-T384 PolarHBondContact O-OG1 2.94Å
381	L	47.9	Very low	44.3	Very low	112 Å²	112	116.3 Å²	116.3	59%	0.586	58%	0.583	S	S	*	*	H	α-helix	trans	-67	-41.9	172.9	-142.1	82.8	0	0	0	111.3	A377 N378 L379 L383 T384 V385	A377-L381 WeakPolarHBondContact O-CB 3.37Å; A377-L381 PolarHBondContact O-N 2.99Å; N378-L381 PolarHBondContact O-N 2.86Å; L379-L381 VanDerWaalsContact C-N 3.31Å; L379-L381 PolarHBondContact O-N 2.88Å; L381-L383 VanDerWaalsContact C-N 3.32Å; L381-L383 PolarHBondContact O-N 3.29Å; L381-T384 WeakPolarHBondContact CA-OG1 3.49Å; L381-T384 PolarHBondContact O-N 2.85Å; L381-T384 PolarHBondContact O-OG1 3.47Å; L381-T384 VanDerWaalsContact O-OG1 3.09Å; L381-V385 WeakPolarHBondContact O-CB 3.42Å; L381-V385 VanDerWaalsContact O-CG2 3.22Å; L381-V385 WeakPolarHBondContact O-CG2 3.45Å; L381-V385 PolarHBondContact O-N 3.12Å
382	H	46.7	Very low	43.2	Very low	117 Å²	117	115.9 Å²	115.9	54%	0.542	60%	0.595	S	S	.	*	H	α-helix	trans	-68.9	-31.3	-178.4	-149.4	-34	0	0	0	112.7	N378 L379 K386	N378-H382 VanDerWaalsContact O-CB 3.29Å; N378-H382 WeakPolarHBondContact O-CB 3.3Å; N378-H382 PolarHBondContact O-N 3.3Å; L379-H382 PolarHBondContact O-N 3.24Å; H382-K386 PolarHBondContact O-N 2.83Å
383	L	41.9	Very low	42.3	Very low	73 Å²	73	119.7 Å²	119.7	38%	0.382	61%	0.609	S	S	.	*	H	α-helix	trans	-70.9	-46.3	171.2	-70.1	167.9	0	0	0	111.3	L379 L381 V385 H387 T528	L379-L383 HydrophobicContact CG-CD1 4.3Å; L379-L383 WeakPolarHBondContact O-CB 3.37Å; L379-L383 VanDerWaalsContact O-CG 3.27Å; L379-L383 WeakPolarHBondContact O-CG 3.44Å; L379-L383 PolarHBondContact O-N 3.5Å; L381-L383 VanDerWaalsContact C-N 3.32Å; L381-L383 PolarHBondContact O-N 3.29Å; L383-V385 PolarHBondContact O-N 2.97Å; L383-H387 PolarHBondContact O-CD2 3.14Å; L383-T528 HydrophobicContact CD2-CG2 4.17Å
384	T	42.6	Very low	41.8	Very low	92 Å²	92	120.3 Å²	120.3	56%	0.564	61%	0.614	S	S	*	*	H	α-helix	trans	-69.8	-31.3	179.3	48.7	0	0	0	0	113.6	A380 L381	A380-T384 WeakPolarHBondContact O-CG2 3.31Å; A380-T384 PolarHBondContact O-N 3.4Å; A380-T384 PolarHBondContact O-OG1 2.94Å; L381-T384 WeakPolarHBondContact CA-OG1 3.49Å; L381-T384 PolarHBondContact O-N 2.85Å; L381-T384 PolarHBondContact O-OG1 3.47Å; L381-T384 VanDerWaalsContact O-OG1 3.09Å
385	V	48.3	Very low	40.6	Very low	97 Å²	97	118.3 Å²	118.3	59%	0.588	62%	0.623	S	S	*	*	H	α-helix	trans	-75.8	-35.4	177.3	171.7	0	0	0	0	112.5	L381 L383 H387	L381-V385 WeakPolarHBondContact O-CB 3.42Å; L381-V385 VanDerWaalsContact O-CG2 3.22Å; L381-V385 WeakPolarHBondContact O-CG2 3.45Å; L381-V385 PolarHBondContact O-N 3.12Å; L383-V385 PolarHBondContact O-N 2.97Å; V385-H387 PolarHBondContact O-N 3.4Å
386	K	42.8	Very low	39.4	Very low	159 Å²	159	118.8 Å²	118.8	69%	0.691	63%	0.632	S	S	*	*	H	α-helix	trans	-69.4	-10.7	176.1	-91.7	-171	171.9	-176.3	0	114.5	H382	H382-K386 PolarHBondContact O-N 2.83Å
387	H	38.7	Very low	38.5	Very low	106 Å²	106	122.8 Å²	122.8	49%	0.491	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.1	8.6	-179.1	-74.4	-58.5	0	0	0	115.2	L383 V385 F389	L383-H387 PolarHBondContact O-CD2 3.14Å; V385-H387 PolarHBondContact O-N 3.4Å; H387-F389 PolarHBondContact O-N 3.4Å
388	R	32.8	Very low	37.6	Very low	226 Å²	226	128.3 Å²	128.3	85%	0.853	67%	0.668	S	S	*	*			trans	-82.7	85.4	163.1	-74.2	-167.1	-176.5	-154	1.8	110.8
389	F	30.5	Very low	36.5	Very low	173 Å²	173	129.5 Å²	129.5	76%	0.759	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-71.1	140.8	165.6	-78	-87.4	0	0	0	110.6	H387	H387-F389 PolarHBondContact O-N 3.4Å
390	P	32.7	Very low	35.3	Very low	104 Å²	104	133.3 Å²	133.3	68%	0.675	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-67.9	155.4	176.2	29.9	-35.2	0	0	0	111
391	P	31	Very low	34.5	Very low	108 Å²	108	136.4 Å²	136.4	70%	0.701	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-62.7	144.4	174.1	28.1	-34.8	0	0	0	110.6	K393	P391-K393 PolarHBondContact O-N 3Å
392	P	32	Very low	33.7	Very low	129 Å²	129	136.9 Å²	136.9	84%	0.838	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-63	127.9	177.5	26.2	-33.5	0	0	0	110.5	E394	P392-E394 PolarHBondContact O-N 3.2Å
393	K	30.5	Very low	32.7	Very low	202 Å²	202	136.2 Å²	136.2	88%	0.878	74%	0.74	S	S	*	*			trans	-90.1	82.2	175.1	-69.5	-176.3	178.9	-177.8	0	110.2	P391	P391-K393 PolarHBondContact O-N 3Å
394	E	33.4	Very low	32.3	Very low	164 Å²	164	137.8 Å²	137.8	77%	0.766	76%	0.757	S	S	*	*			trans	-168.5	118.4	158.8	-113.8	158.7	-145.3	0	0	110.3	P392 L396	P392-E394 PolarHBondContact O-N 3.2Å; E394-L396 PolarHBondContact O-N 3.02Å
395	P	27.2	Very low	31.8	Very low	126 Å²	126	138.6 Å²	138.6	82%	0.818	76%	0.762	S	S	*	*			trans	-91.4	97.5	174.4	33.8	-28.4	0	0	0	109.8
396	L	29.2	Very low	31	Very low	160 Å²	160	139.1 Å²	139.1	84%	0.838	77%	0.769	S	S	*	*			trans	-103.5	116.2	161.4	-81.4	168.7	0	0	0	109.6	E394 E398	E394-L396 PolarHBondContact O-N 3.02Å; L396-E398 PolarHBondContact O-N 3.39Å
397	T	26.9	Very low	30.6	Very low	129 Å²	129	135.8 Å²	135.8	79%	0.791	77%	0.765	S	S	*	*			trans	-68.8	116.8	-176.3	45.2	0	0	0	0	111.7
398	E	29	Very low	30.5	Very low	172 Å²	172	134.4 Å²	134.4	80%	0.804	77%	0.768	S	S	*	*			trans	177.8	128.7	132.4	-100.8	171.6	-155.3	0	0	110.5	L396 M400	L396-E398 PolarHBondContact O-N 3.39Å; E398-M400 PolarHBondContact O-N 3.23Å
399	P	26.3	Very low	30.4	Very low	133 Å²	133	125.7 Å²	125.7	86%	0.864	75%	0.748	S	S	*	*			trans	-88	100	-176.8	33.3	-32.1	0	0	0	111.7
400	M	28.7	Very low	30.5	Very low	163 Å²	163	122 Å²	122	80%	0.803	74%	0.74	S	S	*	*			trans	-103.3	123.2	166	-67.5	-142	78.7	0	0	111.9	E398 V402	E398-M400 PolarHBondContact O-N 3.23Å; M400-V402 PolarHBondContact O-N 2.96Å; M400-V402 VanDerWaalsContact O-N 3.14Å
401	S	26.5	Very low	30.5	Very low	120 Å²	120	119.6 Å²	119.6	84%	0.839	73%	0.728	S	S	*	*			trans	-78.8	89.7	-170.4	42.4	0	0	0	0	113.7
402	V	29.3	Very low	30.9	Very low	122 Å²	122	120.7 Å²	120.7	74%	0.739	72%	0.722	S	S	*	*			trans	-126.2	67	171	-80.2	0	0	0	0	111.9	M400	M400-V402 PolarHBondContact O-N 2.96Å; M400-V402 VanDerWaalsContact O-N 3.14Å
403	A	26.3	Very low	30.9	Very low	103 Å²	103	117.7 Å²	117.7	85%	0.851	70%	0.698	S	S	*	*			trans	-100.8	7.5	-176.2	0	0	0	0	0	115.2
404	S	33.1	Very low	31.2	Very low	105 Å²	105	113.2 Å²	113.2	73%	0.734	68%	0.684	S	S	*	*	S	Bend	trans	-108.2	-1.7	-166.5	55.3	0	0	0	0	116.6
405	T	32.1	Very low	31.3	Very low	110 Å²	110	110.6 Å²	110.6	68%	0.675	68%	0.675	S	S	*	*	S	Bend	trans	-115	-6	-167.6	47.9	0	0	0	0	116.5
406	C	32.1	Very low	31.9	Very low	108 Å²	108	110.3 Å²	110.3	73%	0.73	67%	0.666	S	S	*	*	S	Bend	trans	-100.4	-15.3	-170.3	-151.2	0	0	0	0	115.4
407	S	34.5	Very low	32.4	Very low	88 Å²	88	105.9 Å²	105.9	62%	0.615	64%	0.643	S	S	*	*	H	α-helix	trans	-86	-17.8	-173	40.1	0	0	0	0	115.2
408	S	35.5	Very low	33	Very low	78 Å²	78	106.3 Å²	106.3	55%	0.545	64%	0.64	S	S	.	*	H	α-helix	trans	-81.8	-22.4	-175.5	63.6	0	0	0	0	114.7	K412	S408-K412 PolarHBondContact O-N 3.42Å
409	G	31.5	Very low	33.4	Very low	43 Å²	43	106.8 Å²	106.8	44%	0.443	64%	0.639	S	S	.	*	H	α-helix	trans	-71.7	-41.1	175.8	0	0	0	0	0	112.8	K412 L413	G409-K412 PolarHBondContact O-N 2.87Å; G409-L413 PolarHBondContact O-N 3.03Å
410	V	32.3	Very low	33.7	Very low	96 Å²	96	103.5 Å²	103.5	58%	0.582	62%	0.623	S	S	*	*	H	α-helix	trans	-69.7	-35.5	-180	-170	0	0	0	0	111.5	L413 N414	V410-L413 PolarHBondContact O-N 3.22Å; V410-N414 PolarHBondContact O-N 3.06Å
411	A	32.9	Very low	33.7	Very low	52 Å²	52	98.9 Å²	98.9	43%	0.43	62%	0.618	S	S	.	*	H	α-helix	trans	-61.1	-43.9	174.1	0	0	0	0	0	112.4	L413 N414 D415	A411-L413 VanDerWaalsContact C-N 3.29Å; A411-L413 PolarHBondContact O-N 3.3Å; A411-N414 PolarHBondContact O-N 3.31Å; A411-N414 VanDerWaalsContact O-N 3.13Å; A411-D415 PolarHBondContact O-N 2.8Å
412	K	39	Very low	34	Very low	131 Å²	131	98.2 Å²	98.2	57%	0.57	61%	0.613	S	S	*	*	H	α-helix	trans	-65.6	-28	177.4	-78.2	177.1	175.9	172.7	0	113.8	S408 G409 L416	S408-K412 PolarHBondContact O-N 3.42Å; G409-K412 PolarHBondContact O-N 2.87Å; K412-L416 WeakPolarHBondContact O-CG 3.35Å; K412-L416 PolarHBondContact O-N 3.48Å; K412-L416 VanDerWaalsContact O-N 3.13Å
413	L	33.7	Very low	34.2	Very low	66 Å²	66	95.2 Å²	95.2	35%	0.346	61%	0.607	S	S	.	*	H	α-helix	trans	-67.2	-39.1	172.3	-78.7	162.1	0	0	0	111.4	G409 V410 A411 L416 L417	G409-L413 PolarHBondContact O-N 3.03Å; V410-L413 PolarHBondContact O-N 3.22Å; A411-L413 VanDerWaalsContact C-N 3.29Å; A411-L413 PolarHBondContact O-N 3.3Å; L413-L416 PolarHBondContact O-N 3.11Å; L413-L417 WeakPolarHBondContact O-CG 3.47Å; L413-L417 PolarHBondContact O-N 2.93Å
414	N	36	Very low	34.5	Very low	109 Å²	109	99.8 Å²	99.8	58%	0.583	61%	0.61	S	S	*	*	H	α-helix	trans	-67.8	-37.8	173.3	-90.4	0.6	0	0	0	113.1	V410 A411 L416 L417	V410-N414 PolarHBondContact O-N 3.06Å; A411-N414 PolarHBondContact O-N 3.31Å; A411-N414 VanDerWaalsContact O-N 3.13Å; N414-L416 VanDerWaalsContact C-N 3.31Å; N414-L416 PolarHBondContact O-N 3.43Å; N414-L417 WeakPolarHBondContact O-CB 3.44Å; N414-L417 PolarHBondContact O-N 3.14Å
415	D	35.8	Very low	34.5	Very low	108 Å²	108	100.8 Å²	100.8	58%	0.578	60%	0.603	S	S	*	*	H	α-helix	trans	-67.3	-31.2	176.3	-73.4	-27.4	0	0	0	112.8	A411 L417	A411-D415 PolarHBondContact O-N 2.8Å; D415-L417 VanDerWaalsContact C-N 3.32Å
416	L	39.3	Very low	34.6	Very low	121 Å²	121	102 Å²	102	63%	0.634	60%	0.601	S	S	*	*	H	α-helix	trans	-73.3	-23.2	174.1	-73.7	168.9	0	0	0	113	K412 L413 N414 L418	K412-L416 WeakPolarHBondContact O-CG 3.35Å; K412-L416 PolarHBondContact O-N 3.48Å; K412-L416 VanDerWaalsContact O-N 3.13Å; L413-L416 PolarHBondContact O-N 3.11Å; N414-L416 VanDerWaalsContact C-N 3.31Å; N414-L416 PolarHBondContact O-N 3.43Å; L416-L418 VanDerWaalsContact C-N 3.26Å; L416-L418 PolarHBondContact O-N 2.98Å
417	L	39.3	Very low	34.8	Very low	67 Å²	67	101.5 Å²	101.5	35%	0.351	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74	-11.8	179.2	-81.7	163.1	0	0	0	114.4	L413 N414 D415 L529 F533	L413-L417 WeakPolarHBondContact O-CG 3.47Å; L413-L417 PolarHBondContact O-N 2.93Å; N414-L417 WeakPolarHBondContact O-CB 3.44Å; N414-L417 PolarHBondContact O-N 3.14Å; D415-L417 VanDerWaalsContact C-N 3.32Å; L417-L529 HydrophobicContact CD1-CD1 4.35Å; L417-L529 HydrophobicContact CD1-CD2 4.01Å; L417-L529 HydrophobicContact CD2-CD1 3.91Å; L417-L529 HydrophobicContact CD2-CD2 3.44Å; L417-L529 VanDerWaalsContact CD2-CD2 3.44Å; L417-L529 HydrophobicContact CD2-CG 4.25Å; L417-L529 HydrophobicContact CG-CD1 4.47Å; L417-L529 HydrophobicContact CG-CD2 4.36Å; L417-F533 HydrophobicContact CD2-CE2 4.43Å; L417-F533 HydrophobicContact CD2-CZ 4.32Å
418	L	39.2	Very low	34.9	Very low	137 Å²	137	102.8 Å²	102.8	72%	0.717	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	0.1	179.8	-84	157.5	0	0	0	114.9	L416	L416-L418 VanDerWaalsContact C-N 3.26Å; L416-L418 PolarHBondContact O-N 2.98Å
419	F	36.9	Very low	35.1	Very low	182 Å²	182	101.8 Å²	101.8	80%	0.798	59%	0.585	S	S	*	*			trans	-128.3	2.9	-173.5	-74.9	-80.4	0	0	0	116.1	G421	F419-G421 VanDerWaalsContact C-N 3.32Å; F419-G421 PolarHBondContact O-N 2.82Å
420	A	33.3	Very low	35.5	Very low	64 Å²	64	104.4 Å²	104.4	53%	0.529	59%	0.588	S	S	.	*			trans	-81.6	71.3	-179.5	0	0	0	0	0	112.4	F533	A420-F533 HydrophobicContact CB-CE1 3.9Å; A420-F533 HydrophobicContact CB-CZ 3.6Å
421	G	28.3	Very low	35.6	Very low	66 Å²	66	105.2 Å²	105.2	68%	0.68	58%	0.584	S	S	*	*			trans	-137.6	49.7	-175.3	0	0	0	0	0	114.3	F419	F419-G421 VanDerWaalsContact C-N 3.32Å; F419-G421 PolarHBondContact O-N 2.82Å
422	S	34.5	Very low	35.9	Very low	107 Å²	107	111.7 Å²	111.7	75%	0.748	60%	0.597	S	S	*	*	S	Bend	trans	-178.2	136.8	160.9	27.1	0	0	0	0	112.3
423	G	33.6	Very low	35.8	Very low	58 Å²	58	111.3 Å²	111.3	60%	0.598	59%	0.592	S	S	*	*			trans	67	103.9	148.9	0	0	0	0	0	118.9	H425	G423-H425 PolarHBondContact O-N 3.36Å
424	E	31.2	Very low	36.1	Very low	200 Å²	200	111.3 Å²	111.3	94%	0.935	59%	0.592	S	S	*	*			trans	32.1	80.7	131.8	-62.4	173.9	-174.1	0	0	117
425	H	33.4	Very low	36.2	Very low	125 Å²	125	112 Å²	112	58%	0.579	59%	0.59	S	S	*	*			trans	-130.7	130	162.1	-95.9	-75.9	0	0	0	111.4	G423	G423-H425 PolarHBondContact O-N 3.36Å
426	E	34.3	Very low	36.3	Very low	135 Å²	135	117.6 Å²	117.6	63%	0.631	60%	0.603	S	S	*	*			trans	-67.4	138.7	-175.8	-146.7	-110.2	113.7	0	0	111.2	L428	E426-L428 VanDerWaalsContact C-N 3.28Å; E426-L428 PolarHBondContact O-N 2.88Å; E426-L428 VanDerWaalsContact O-N 3.11Å
427	P	37.1	Very low	36.2	Very low	99 Å²	99	117.3 Å²	117.3	64%	0.643	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-10.7	-158.8	27.2	-35.8	0	0	0	115.8	D429	P427-D429 PolarHBondContact O-N 2.8Å
428	L	35.4	Very low	35.9	Very low	115 Å²	115	118.4 Å²	118.4	60%	0.602	61%	0.612	S	S	*	*	H	α-helix	trans	-71.8	-25.9	-179.4	-75.6	166	0	0	0	113.9	E426 L430	E426-L428 VanDerWaalsContact C-N 3.28Å; E426-L428 PolarHBondContact O-N 2.88Å; E426-L428 VanDerWaalsContact O-N 3.11Å; L428-L430 PolarHBondContact O-N 3.32Å
429	D	40.8	Very low	35.6	Very low	57 Å²	57	117.2 Å²	117.2	31%	0.305	61%	0.612	S	S	.	*	H	α-helix	trans	-78.7	-20.6	-172.9	-151.6	41.8	0	0	0	113	P427 R432 R433	P427-D429 PolarHBondContact O-N 2.8Å; D429-R432 PolarHBondContact O-N 3.44Å; D429-R433 VanDerWaalsContact O-CG 3.26Å; D429-R433 WeakPolarHBondContact O-CG 3.42Å; D429-R433 PolarHBondContact O-N 3.2Å; D429-R433 IonicContact OD2-CZ 2.67Å; D429-R433 IonicContact OD2-NE 2.67Å; D429-R433 PolarHBondContact OD2-NE 3.23Å; D429-R433 IonicContact OD2-NH2 3.78Å; D429-R433 PolarHBondContact OD2-NH2 2.87Å
430	L	38.1	Very low	35.4	Very low	98 Å²	98	112.5 Å²	112.5	51%	0.513	60%	0.598	S	S	.	*	H	α-helix	trans	-70.3	-40	177.7	-160.1	71.8	0	0	0	112	L428 R433 L434	L428-L430 PolarHBondContact O-N 3.32Å; L430-R433 PolarHBondContact O-N 3.22Å; L430-L434 HydrophobicContact CG-CD1 4.31Å; L430-L434 WeakPolarHBondContact O-CG 3.49Å; L430-L434 PolarHBondContact O-N 2.86Å
431	K	35.3	Very low	35.3	Very low	113 Å²	113	112.5 Å²	112.5	49%	0.491	59%	0.594	S	S	.	*	H	α-helix	trans	-58.7	-48.5	172	-78.8	-172.6	175.3	-176.6	0	110.4	R433 L434 F435 E523	K431-R433 VanDerWaalsContact C-N 3.34Å; K431-R433 PolarHBondContact O-N 3.48Å; K431-L434 PolarHBondContact O-N 3.29Å; K431-F435 WeakPolarHBondContact O-CD2 3.34Å; K431-F435 PolarHBondContact O-N 3.45Å; K431-E523 IonicContact NZ-OE1 3.28Å; K431-E523 PolarHBondContact NZ-OE1 3.47Å
432	R	39.5	Very low	35.5	Very low	187 Å²	187	113.4 Å²	113.4	71%	0.706	59%	0.59	S	S	*	*	H	α-helix	trans	-59	-42.2	178.5	-68.9	-177.2	178.8	-178.3	1	112.8	D429 R436	D429-R432 PolarHBondContact O-N 3.44Å; R432-R436 PolarHBondContact O-N 2.97Å
433	R	37.4	Very low	35.5	Very low	123 Å²	123	112.7 Å²	112.7	46%	0.464	59%	0.585	S	S	.	*	H	α-helix	trans	-68.4	-36.6	179.7	-70.2	170.7	-171	-155.5	2.2	112.8	D429 L430 K431	D429-R433 VanDerWaalsContact O-CG 3.26Å; D429-R433 WeakPolarHBondContact O-CG 3.42Å; D429-R433 PolarHBondContact O-N 3.2Å; D429-R433 IonicContact OD2-CZ 2.67Å; D429-R433 IonicContact OD2-NE 2.67Å; D429-R433 PolarHBondContact OD2-NE 3.23Å; D429-R433 IonicContact OD2-NH2 3.78Å; D429-R433 PolarHBondContact OD2-NH2 2.87Å; L430-R433 PolarHBondContact O-N 3.22Å; K431-R433 VanDerWaalsContact C-N 3.34Å; K431-R433 PolarHBondContact O-N 3.48Å
434	L	39	Very low	35.6	Very low	66 Å²	66	112.1 Å²	112.1	35%	0.346	57%	0.572	S	S	.	*	H	α-helix	trans	-68.6	-34.9	179.1	-74.5	165.8	0	0	0	113.3	L430 K431 V522	L430-L434 HydrophobicContact CG-CD1 4.31Å; L430-L434 WeakPolarHBondContact O-CG 3.49Å; L430-L434 PolarHBondContact O-N 2.86Å; K431-L434 PolarHBondContact O-N 3.29Å; L434-V522 HydrophobicContact CD1-CG1 3.89Å
435	F	37.9	Very low	35.8	Very low	124 Å²	124	105.6 Å²	105.6	54%	0.544	55%	0.546	S	S	.	.	H	α-helix	trans	-82.2	-24.2	177.5	-79.9	-86.5	0	0	0	114.5	K431 T438 E519	K431-F435 WeakPolarHBondContact O-CD2 3.34Å; K431-F435 PolarHBondContact O-N 3.45Å; F435-T438 PolarHBondContact O-OG1 2.91Å; F435-E519 HydrophobicContact CE1-CG 4.42Å; F435-E519 WeakPolarHBondContact CE1-OE1 3.44Å; F435-E519 HydrophobicContact CZ-CG 3.88Å; F435-E519 VanDerWaalsContact CZ-OE1 3.25Å; F435-E519 WeakPolarHBondContact CZ-OE1 3.45Å
436	R	39.5	Very low	35.9	Very low	226 Å²	226	103.6 Å²	103.6	85%	0.853	54%	0.539	S	S	*	.	H	α-helix	trans	-81.9	-25.6	-177.2	-126.8	179.2	-170.1	-173	3.4	114.4	R432	R432-R436 PolarHBondContact O-N 2.97Å
437	D	35.4	Very low	36	Very low	114 Å²	114	99.5 Å²	99.5	61%	0.61	53%	0.528	S	S	*	.	S	Bend	trans	-102.9	12	-171.6	-80.5	-9.5	0	0	0	113.5	K154 P439	K154-D437 IonicContact NZ-OD2 2.8Å; D437-P439 WeakPolarHBondContact O-CD 3.49Å
438	T	33.8	Very low	36.2	Very low	91 Å²	91	100.1 Å²	100.1	56%	0.558	53%	0.525	S	S	*	.			trans	-74.8	113.7	171.2	47.6	0	0	0	0	110.4	F435 V440	F435-T438 PolarHBondContact O-OG1 2.91Å; T438-V440 PolarHBondContact O-N 3.4Å
439	P	33.3	Very low	36.4	Very low	112 Å²	112	101 Å²	101	73%	0.727	53%	0.526	S	S	*	.			trans	-75.9	92.8	175.8	31.9	-32.7	0	0	0	108.8	D437 S441	D437-P439 WeakPolarHBondContact O-CD 3.49Å; P439-S441 PolarHBondContact O-N 2.92Å; P439-S441 VanDerWaalsContact O-N 3.12Å
440	V	32	Very low	36.5	Very low	82 Å²	82	105.2 Å²	105.2	50%	0.497	54%	0.542	S	S	.	.			trans	-54.9	117.5	157.8	-174.4	0	0	0	0	105.9	T438 S444 T445	T438-V440 PolarHBondContact O-N 3.4Å; V440-S444 WeakPolarHBondContact CG1-OG 3.21Å; V440-T445 HydrophobicContact CB-CG2 4.12Å; V440-T445 HydrophobicContact CG1-CG2 3.68Å
441	S	31.9	Very low	36.9	Very low	64 Å²	64	103.9 Å²	103.9	45%	0.448	54%	0.535	S	S	.	.			trans	-63.2	150.5	-176.8	62.6	0	0	0	0	109.7	P439 S443 S444 T445	P439-S441 PolarHBondContact O-N 2.92Å; P439-S441 VanDerWaalsContact O-N 3.12Å; S441-S443 PolarHBondContact O-N 3.33Å; S441-S444 PolarHBondContact N-OG 3.2Å; S441-S444 PolarHBondContact O-N 3.47Å; S441-S444 PolarHBondContact O-OG 2.93Å; S441-S444 VanDerWaalsContact O-OG 3.08Å; S441-S444 PolarHBondContact OG-OG 3.27Å; S441-T445 PolarHBondContact O-N 3.45Å
442	S	33	Very low	37.5	Very low	86 Å²	86	102.2 Å²	102.2	60%	0.601	54%	0.537	S	S	*	.	H	α-helix	trans	-55.3	-26.5	179	42.2	0	0	0	0	112.7	T445 I446	S442-T445 PolarHBondContact O-OG1 3.08Å; S442-T445 VanDerWaalsContact O-OG1 3.08Å; S442-I446 WeakPolarHBondContact O-CB 3.25Å; S442-I446 VanDerWaalsContact O-CD1 3.27Å; S442-I446 WeakPolarHBondContact O-CD1 3.37Å; S442-I446 WeakPolarHBondContact O-CG1 3.47Å; S442-I446 PolarHBondContact O-N 3.46Å
443	S	33.6	Very low	37.7	Very low	91 Å²	91	95.3 Å²	95.3	64%	0.636	52%	0.524	S	S	*	.	H	α-helix	trans	-68.4	-35.3	173.5	-52.2	0	0	0	0	113.9	S441 A447	S441-S443 PolarHBondContact O-N 3.33Å; S443-A447 PolarHBondContact O-N 3.16Å
444	S	36	Very low	38.3	Very low	47 Å²	47	94.7 Å²	94.7	33%	0.329	53%	0.529	S	S	.	.	H	α-helix	trans	-84.7	-26.8	178.7	39.8	0	0	0	0	113.4	V440 S441 A447 L448	V440-S444 WeakPolarHBondContact CG1-OG 3.21Å; S441-S444 PolarHBondContact N-OG 3.2Å; S441-S444 PolarHBondContact O-N 3.47Å; S441-S444 PolarHBondContact O-OG 2.93Å; S441-S444 VanDerWaalsContact O-OG 3.08Å; S441-S444 PolarHBondContact OG-OG 3.27Å; S444-A447 PolarHBondContact O-N 3.39Å; S444-L448 WeakPolarHBondContact O-CG 3.36Å; S444-L448 PolarHBondContact O-N 3.41Å
445	T	35.1	Very low	38.6	Very low	63 Å²	63	94.5 Å²	94.5	39%	0.387	54%	0.537	S	S	.	.	H	α-helix	trans	-66.8	-42	168.3	57.5	0	0	0	0	111.7	V440 S441 S442 A447 L448 E449	V440-T445 HydrophobicContact CB-CG2 4.12Å; V440-T445 HydrophobicContact CG1-CG2 3.68Å; S441-T445 PolarHBondContact O-N 3.45Å; S442-T445 PolarHBondContact O-OG1 3.08Å; S442-T445 VanDerWaalsContact O-OG1 3.08Å; T445-A447 VanDerWaalsContact C-N 3.3Å; T445-A447 PolarHBondContact O-N 3.45Å; T445-L448 PolarHBondContact O-N 3.07Å; T445-E449 PolarHBondContact O-N 2.88Å
446	I	36	Very low	39	Very low	83 Å²	83	91.6 Å²	91.6	43%	0.426	54%	0.536	S	S	.	.	H	α-helix	trans	-65.2	-33.5	175.7	-68	166.7	0	0	0	111.5	S442 K450	S442-I446 WeakPolarHBondContact O-CB 3.25Å; S442-I446 VanDerWaalsContact O-CD1 3.27Å; S442-I446 WeakPolarHBondContact O-CD1 3.37Å; S442-I446 WeakPolarHBondContact O-CG1 3.47Å; S442-I446 PolarHBondContact O-N 3.46Å; I446-K450 HydrophobicContact CG2-CD 4.28Å; I446-K450 WeakPolarHBondContact O-CB 3.11Å; I446-K450 VanDerWaalsContact O-CG 3.32Å; I446-K450 WeakPolarHBondContact O-CG 3.49Å; I446-K450 PolarHBondContact O-N 2.92Å; I446-K450 VanDerWaalsContact O-N 3.13Å
447	A	36.8	Very low	39.3	Very low	48 Å²	48	83.8 Å²	83.8	40%	0.397	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-42.8	173.5	0	0	0	0	0	111.9	S443 S444 T445 K450 L451	S443-A447 PolarHBondContact O-N 3.16Å; S444-A447 PolarHBondContact O-N 3.39Å; T445-A447 VanDerWaalsContact C-N 3.3Å; T445-A447 PolarHBondContact O-N 3.45Å; A447-K450 PolarHBondContact O-N 3.48Å; A447-L451 WeakPolarHBondContact O-CB 3.31Å; A447-L451 VanDerWaalsContact O-CG 3.29Å; A447-L451 WeakPolarHBondContact O-CG 3.49Å; A447-L451 PolarHBondContact O-N 2.94Å
448	L	39.9	Very low	39.9	Very low	112 Å²	112	81.2 Å²	81.2	59%	0.586	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-41.3	177.9	-72.1	168.5	0	0	0	112.6	S444 T445 L451 S452	S444-L448 WeakPolarHBondContact O-CG 3.36Å; S444-L448 PolarHBondContact O-N 3.41Å; T445-L448 PolarHBondContact O-N 3.07Å; L448-L451 PolarHBondContact O-N 2.92Å; L448-S452 PolarHBondContact O-N 3.42Å
449	E	40.3	Very low	40.6	Very low	134 Å²	134	79.7 Å²	79.7	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-60.2	-46.1	173.2	-77	-176.2	141.7	0	0	111.4	T445 L451 S452 G453	T445-E449 PolarHBondContact O-N 2.88Å; E449-L451 PolarHBondContact O-N 3.25Å; E449-S452 PolarHBondContact O-N 3.49Å; E449-S452 PolarHBondContact O-OG 2.94Å; E449-G453 PolarHBondContact O-N 3.21Å
450	K	43.1	Very low	41.4	Very low	145 Å²	145	77.3 Å²	77.3	63%	0.63	50%	0.501	S	S	*	.	H	α-helix	trans	-62.7	-40.5	177.2	-75.1	-179.6	178	-172.2	0	112.6	I446 A447 G453 I454	I446-K450 HydrophobicContact CG2-CD 4.28Å; I446-K450 WeakPolarHBondContact O-CB 3.11Å; I446-K450 VanDerWaalsContact O-CG 3.32Å; I446-K450 WeakPolarHBondContact O-CG 3.49Å; I446-K450 PolarHBondContact O-N 2.92Å; I446-K450 VanDerWaalsContact O-N 3.13Å; A447-K450 PolarHBondContact O-N 3.48Å; K450-G453 PolarHBondContact O-N 3.44Å; K450-I454 WeakPolarHBondContact O-CD1 3.29Å; K450-I454 VanDerWaalsContact O-CG1 3.29Å; K450-I454 WeakPolarHBondContact O-CG1 3.18Å; K450-I454 PolarHBondContact O-N 3.01Å
451	L	46.9	Very low	42.2	Very low	70 Å²	70	76.1 Å²	76.1	37%	0.366	50%	0.5	S	S	.	.	H	α-helix	trans	-65.5	-37.9	175.5	-73.2	171.9	0	0	0	112.3	A447 L448 E449 G453 I454 A455 L504	A447-L451 WeakPolarHBondContact O-CB 3.31Å; A447-L451 VanDerWaalsContact O-CG 3.29Å; A447-L451 WeakPolarHBondContact O-CG 3.49Å; A447-L451 PolarHBondContact O-N 2.94Å; L448-L451 PolarHBondContact O-N 2.92Å; E449-L451 PolarHBondContact O-N 3.25Å; L451-G453 VanDerWaalsContact C-N 3.34Å; L451-G453 PolarHBondContact O-N 3.17Å; L451-I454 PolarHBondContact O-N 3.44Å; L451-A455 WeakPolarHBondContact O-CB 3.37Å; L451-A455 PolarHBondContact O-N 3Å; L451-L504 HydrophobicContact CD1-CD2 4.48Å; L451-L504 HydrophobicContact CD2-CD2 3.69Å
452	S	48.3	Very low	42.9	Very low	78 Å²	78	76 Å²	76	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-64.8	-37.4	174.9	76.5	0	0	0	0	112.5	L448 E449 A455 A456	L448-S452 PolarHBondContact O-N 3.42Å; E449-S452 PolarHBondContact O-N 3.49Å; E449-S452 PolarHBondContact O-OG 2.94Å; S452-A455 PolarHBondContact O-N 3.23Å; S452-A456 WeakPolarHBondContact O-CB 3.36Å; S452-A456 PolarHBondContact O-N 3.42Å
453	G	43.7	Very low	43.6	Very low	42 Å²	42	75 Å²	75	43%	0.433	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-39.2	175	0	0	0	0	0	113	E449 K450 L451 A456 A457	E449-G453 PolarHBondContact O-N 3.21Å; K450-G453 PolarHBondContact O-N 3.44Å; L451-G453 VanDerWaalsContact C-N 3.34Å; L451-G453 PolarHBondContact O-N 3.17Å; G453-A456 PolarHBondContact O-N 2.9Å; G453-A457 WeakPolarHBondContact O-CB 3.37Å; G453-A457 PolarHBondContact O-N 2.85Å
454	I	48.7	Very low	44.2	Very low	111 Å²	111	75 Å²	75	57%	0.569	50%	0.504	S	S	*	.	H	α-helix	trans	-68.2	-40.6	176.8	-64.1	160.2	0	0	0	110.7	K450 L451 A457 A458	K450-I454 WeakPolarHBondContact O-CD1 3.29Å; K450-I454 VanDerWaalsContact O-CG1 3.29Å; K450-I454 WeakPolarHBondContact O-CG1 3.18Å; K450-I454 PolarHBondContact O-N 3.01Å; L451-I454 PolarHBondContact O-N 3.44Å; I454-A457 PolarHBondContact O-N 2.86Å; I454-A458 WeakPolarHBondContact O-CB 3.46Å; I454-A458 PolarHBondContact O-N 3.17Å
455	A	45.6	Very low	44.8	Very low	62 Å²	62	77.2 Å²	77.2	51%	0.512	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-40.9	174.9	0	0	0	0	0	112.4	L451 S452 A458 A459	L451-A455 WeakPolarHBondContact O-CB 3.37Å; L451-A455 PolarHBondContact O-N 3Å; S452-A455 PolarHBondContact O-N 3.23Å; A455-A458 PolarHBondContact O-N 3.4Å; A455-A459 WeakPolarHBondContact O-CB 3.47Å; A455-A459 PolarHBondContact O-N 3.45Å
456	A	46.7	Very low	45	Very low	62 Å²	62	78.8 Å²	78.8	51%	0.512	53%	0.53	S	S	.	.	H	α-helix	trans	-65.1	-40.6	174.8	0	0	0	0	0	112.5	S452 G453 A459 A460	S452-A456 WeakPolarHBondContact O-CB 3.36Å; S452-A456 PolarHBondContact O-N 3.42Å; G453-A456 PolarHBondContact O-N 2.9Å; A456-A459 PolarHBondContact O-N 2.91Å; A456-A460 WeakPolarHBondContact O-CB 3.49Å; A456-A460 PolarHBondContact O-N 3.09Å
457	A	45.8	Very low	45	Very low	62 Å²	62	80.3 Å²	80.3	51%	0.512	55%	0.545	S	S	.	.	H	α-helix	trans	-65.7	-40.7	175.1	0	0	0	0	0	112.4	G453 I454 A460 A461	G453-A457 WeakPolarHBondContact O-CB 3.37Å; G453-A457 PolarHBondContact O-N 2.85Å; I454-A457 PolarHBondContact O-N 2.86Å; A457-A460 PolarHBondContact O-N 2.92Å; A457-A461 WeakPolarHBondContact O-CB 3.42Å; A457-A461 PolarHBondContact O-N 2.6Å
458	A	47.8	Very low	44.9	Very low	60 Å²	60	85.8 Å²	85.8	50%	0.496	57%	0.566	S	S	.	*	H	α-helix	trans	-65.2	-40.5	175.1	0	0	0	0	0	112.1	I454 A455 A461 A462	I454-A458 WeakPolarHBondContact O-CB 3.46Å; I454-A458 PolarHBondContact O-N 3.17Å; A455-A458 PolarHBondContact O-N 3.4Å; A458-A461 PolarHBondContact O-N 3.14Å; A458-A462 WeakPolarHBondContact O-CB 3.35Å; A458-A462 PolarHBondContact O-N 3.42Å
459	A	48.5	Very low	44.6	Very low	60 Å²	60	90.4 Å²	90.4	50%	0.496	58%	0.582	S	S	.	*	H	α-helix	trans	-64.6	-39.7	174.4	0	0	0	0	0	112.3	A455 A456 A462 A463	A455-A459 WeakPolarHBondContact O-CB 3.47Å; A455-A459 PolarHBondContact O-N 3.45Å; A456-A459 PolarHBondContact O-N 2.91Å; A459-A462 PolarHBondContact O-N 3.1Å; A459-A463 WeakPolarHBondContact O-CB 3.42Å; A459-A463 PolarHBondContact O-N 3.28Å
460	A	49.5	Very low	44.2	Very low	62 Å²	62	86.9 Å²	86.9	51%	0.512	58%	0.582	S	S	.	*	H	α-helix	trans	-64.9	-41.9	174.7	0	0	0	0	0	112.3	A456 A457 A463 A464	A456-A460 WeakPolarHBondContact O-CB 3.49Å; A456-A460 PolarHBondContact O-N 3.09Å; A457-A460 PolarHBondContact O-N 2.92Å; A460-A463 PolarHBondContact O-N 3.38Å; A460-A464 PolarHBondContact O-N 2.94Å
461	A	48.8	Very low	44	Very low	57 Å²	57	86.2 Å²	86.2	47%	0.471	60%	0.595	S	S	.	*	H	α-helix	trans	-65.9	-38.8	175.5	0	0	0	0	0	112.6	A457 A458 A464 S465	A457-A461 WeakPolarHBondContact O-CB 3.42Å; A457-A461 PolarHBondContact O-N 2.6Å; A458-A461 PolarHBondContact O-N 3.14Å; A461-A464 PolarHBondContact O-N 3.39Å; A461-S465 PolarHBondContact O-N 3.36Å; A461-S465 PolarHBondContact O-OG 3.13Å
462	A	46.7	Very low	43.5	Very low	60 Å²	60	87.4 Å²	87.4	50%	0.496	62%	0.615	S	S	.	*	H	α-helix	trans	-65.9	-41	174.4	0	0	0	0	0	111.9	A458 A459 A464 S465	A458-A462 WeakPolarHBondContact O-CB 3.35Å; A458-A462 PolarHBondContact O-N 3.42Å; A459-A462 PolarHBondContact O-N 3.1Å; A462-A464 VanDerWaalsContact C-N 3.35Å; A462-A464 PolarHBondContact O-N 2.67Å; A462-S465 WeakPolarHBondContact O-CB 3.01Å; A462-S465 PolarHBondContact O-N 3.12Å; A462-S465 VanDerWaalsContact O-N 3.09Å
463	A	47.8	Very low	43.3	Very low	65 Å²	65	89.4 Å²	89.4	54%	0.537	63%	0.626	S	S	.	*	H	α-helix	trans	-64.8	-36.1	175.7	0	0	0	0	0	112.7	A459 A460 S465 T466	A459-A463 WeakPolarHBondContact O-CB 3.42Å; A459-A463 PolarHBondContact O-N 3.28Å; A460-A463 PolarHBondContact O-N 3.38Å; A463-S465 PolarHBondContact O-N 3.46Å; A463-T466 PolarHBondContact O-OG1 3.42Å; A463-T466 VanDerWaalsContact O-OG1 3.07Å
464	A	45.8	Very low	43.1	Very low	91 Å²	91	96.6 Å²	96.6	75%	0.752	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-8.9	173.5	0	0	0	0	0	114	A460 A461 A462	A460-A464 PolarHBondContact O-N 2.94Å; A461-A464 PolarHBondContact O-N 3.39Å; A462-A464 VanDerWaalsContact C-N 3.35Å; A462-A464 PolarHBondContact O-N 2.67Å
465	S	48.7	Very low	42.6	Very low	95 Å²	95	95.6 Å²	95.6	66%	0.664	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	2.2	-176.5	-56.8	0	0	0	0	113.8	A461 A462 A463	A461-S465 PolarHBondContact O-N 3.36Å; A461-S465 PolarHBondContact O-OG 3.13Å; A462-S465 WeakPolarHBondContact O-CB 3.01Å; A462-S465 PolarHBondContact O-N 3.12Å; A462-S465 VanDerWaalsContact O-N 3.09Å; A463-S465 PolarHBondContact O-N 3.46Å
466	T	40.6	Very low	42.3	Very low	95 Å²	95	99 Å²	99	58%	0.583	67%	0.674	S	S	*	*			trans	-92.2	119.1	178.6	49.9	0	0	0	0	111.6	A463 I468	A463-T466 PolarHBondContact O-OG1 3.42Å; A463-T466 VanDerWaalsContact O-OG1 3.07Å; T466-I468 PolarHBondContact O-N 3.19Å
467	P	36.2	Very low	41.6	Very low	116 Å²	116	99.6 Å²	99.6	75%	0.753	69%	0.686	S	S	*	*			trans	-77.5	106.2	179.8	30.2	-32.8	0	0	0	110.5	F469	P467-F469 PolarHBondContact O-N 3.45Å
468	I	34.8	Very low	41.2	Very low	163 Å²	163	101.8 Å²	101.8	84%	0.836	70%	0.697	S	S	*	*			trans	-72.1	107	169.7	-60.7	178.1	0	0	0	108.3	T466 G470	T466-I468 PolarHBondContact O-N 3.19Å; I468-G470 PolarHBondContact O-N 2.8Å
469	F	31.6	Very low	40.4	Very low	209 Å²	209	104.3 Å²	104.3	92%	0.917	71%	0.712	S	S	*	*			trans	-69.7	114	169.9	-111.9	-98.3	0	0	0	109.6	P467	P467-F469 PolarHBondContact O-N 3.45Å
470	G	33.2	Very low	39.8	Very low	60 Å²	60	109 Å²	109	62%	0.619	73%	0.727	S	S	*	*			trans	165.3	95.6	172.8	0	0	0	0	0	115.8	I468	I468-G470 PolarHBondContact O-N 2.8Å
471	S	37.9	Very low	39.4	Very low	131 Å²	131	111.6 Å²	111.6	92%	0.916	74%	0.742	S	S	*	*			trans	69.6	106.2	155.4	-50.3	0	0	0	0	119.2
472	A	36.9	Very low	39.7	Very low	95 Å²	95	114.5 Å²	114.5	79%	0.785	75%	0.747	S	S	*	*			trans	-78.6	-177	162.5	0	0	0	0	0	110.9
473	P	45.2	Very low	40.2	Very low	120 Å²	120	116.3 Å²	116.3	78%	0.779	75%	0.748	S	S	*	*			cis	-126.1	-164	4.5	38.3	-15.9	0	0	0	112
474	E	38.3	Very low	41.1	Very low	192 Å²	192	120.9 Å²	120.9	90%	0.897	76%	0.76	S	S	*	*			cis	-131.9	-148.2	12.2	-60.1	-173.5	87.3	0	0	112.7
475	A	38.1	Very low	42.5	Very low	90 Å²	90	124.2 Å²	124.2	74%	0.744	76%	0.758	S	S	*	*			trans	-138.1	170	177.7	0	0	0	0	0	109.5
476	P	40.5	Very low	43.5	Very low	134 Å²	134	125.3 Å²	125.3	87%	0.87	75%	0.752	S	S	*	*				-130.4	167.5	59.3	31.8	-12.8	0	0	0	112.5
477	G	31.5	Very low	45.1	Very low	74 Å²	74	124.2 Å²	124.2	76%	0.763	75%	0.746	S	S	*	*			cis	136.3	71.9	18.4	0	0	0	0	0	109.3
478	S	37.7	Very low	47.1	Very low	108 Å²	108	125.5 Å²	125.5	76%	0.755	74%	0.739	S	S	*	*			trans	-150	121.5	172.1	53.1	0	0	0	0	112.2	L480	S478-L480 PolarHBondContact O-N 3.27Å
479	S	29.9	Very low	49.3	Very low	114 Å²	114	120.1 Å²	120.1	80%	0.797	72%	0.719	S	S	*	*			trans	-7	102.7	163.7	55	0	0	0	0	118.4
480	L	35.7	Very low	51.4	Low	158 Å²	158	113.1 Å²	113.1	83%	0.827	70%	0.697	S	S	*	*			trans	-126.9	69.2	156.7	-86.3	169.7	0	0	0	110.3	S478 M482	S478-L480 PolarHBondContact O-N 3.27Å; L480-M482 PolarHBondContact O-N 3.38Å
481	S	40.7	Very low	53.6	Low	116 Å²	116	114.8 Å²	114.8	81%	0.811	69%	0.691	S	S	*	*			trans	-73.9	78.2	160.4	57.6	0	0	0	0	108.8	D483	S481-D483 PolarHBondContact O-N 2.96Å
482	M	56.3	Low	55.6	Low	118 Å²	118	114.9 Å²	114.9	58%	0.581	68%	0.678	S	S	*	*			trans	-59	124.2	167.9	-77.5	-175.9	68.8	0	0	108.5	L480 M484 V487	L480-M482 PolarHBondContact O-N 3.38Å; M482-M484 PolarHBondContact O-N 3.03Å; M482-V487 HydrophobicContact CB-CG2 4.44Å; M482-V487 HydrophobicContact CE-CG2 4.28Å
483	D	56.8	Low	57.6	Low	98 Å²	98	116.7 Å²	116.7	52%	0.524	67%	0.671	S	S	.	*			trans	-64.4	129.7	-175	-150.1	-32.3	0	0	0	109.1	S481 K485 E486 V487	S481-D483 PolarHBondContact O-N 2.96Å; D483-K485 PolarHBondContact O-N 3.3Å; D483-E486 WeakPolarHBondContact O-CB 3.14Å; D483-E486 PolarHBondContact O-N 3.27Å; D483-V487 PolarHBondContact O-N 3.01Å
484	M	66.1	Low	59	Low	161 Å²	161	116.7 Å²	116.7	79%	0.793	66%	0.663	S	S	*	*	H	α-helix	trans	-63.7	-19.2	-172.1	-152.9	-150	177.2	0	0	112.2	M482 K488	M482-M484 PolarHBondContact O-N 3.03Å; M484-K488 WeakPolarHBondContact O-CB 3.37Å; M484-K488 PolarHBondContact O-N 2.94Å; M484-K488 VanDerWaalsContact O-N 3.12Å
485	K	76.3	Confident	61.1	Low	162 Å²	162	114.5 Å²	114.5	70%	0.704	65%	0.651	S	S	*	*	H	α-helix	trans	-64	-39.3	170.1	-65.6	172.9	-176.4	165.4	0	112.6	D483 K488 A489	D483-K485 PolarHBondContact O-N 3.3Å; K485-K488 PolarHBondContact O-N 3.38Å; K485-A489 WeakPolarHBondContact O-CB 3.46Å; K485-A489 PolarHBondContact O-N 2.95Å
486	E	69.4	Low	63.2	Low	117 Å²	117	115.9 Å²	115.9	55%	0.547	64%	0.642	S	S	.	*	H	α-helix	trans	-73.2	-43.7	-177.6	-167.4	159.7	-147.9	0	0	110.7	D483 K488 A489 S490	D483-E486 WeakPolarHBondContact O-CB 3.14Å; D483-E486 PolarHBondContact O-N 3.27Å; E486-K488 VanDerWaalsContact C-N 3.27Å; E486-K488 PolarHBondContact O-N 3.47Å; E486-A489 WeakPolarHBondContact O-CB 3.46Å; E486-A489 PolarHBondContact O-N 3.49Å; E486-A489 VanDerWaalsContact O-N 3.12Å; E486-S490 PolarHBondContact O-N 3.42Å; E486-S490 PolarHBondContact O-OG 2.99Å; E486-S490 VanDerWaalsContact O-OG 3.09Å
487	V	73.3	Confident	64.8	Low	73 Å²	73	113.2 Å²	113.2	44%	0.442	62%	0.623	S	S	.	*	H	α-helix	trans	-56.9	-41.6	170	-178.9	0	0	0	0	111.3	M482 D483 L491	M482-V487 HydrophobicContact CB-CG2 4.44Å; M482-V487 HydrophobicContact CE-CG2 4.28Å; D483-V487 PolarHBondContact O-N 3.01Å; V487-L491 WeakPolarHBondContact O-CB 3.4Å; V487-L491 PolarHBondContact O-N 3.34Å
488	K	79.4	Confident	66.7	Low	142 Å²	142	112.3 Å²	112.3	62%	0.617	61%	0.608	S	S	*	*	H	α-helix	trans	-68.7	-35.5	177.2	-171.6	174.9	-179.4	178.4	0	112.8	M484 K485 E486 M492	M484-K488 WeakPolarHBondContact O-CB 3.37Å; M484-K488 PolarHBondContact O-N 2.94Å; M484-K488 VanDerWaalsContact O-N 3.12Å; K485-K488 PolarHBondContact O-N 3.38Å; E486-K488 VanDerWaalsContact C-N 3.27Å; E486-K488 PolarHBondContact O-N 3.47Å; K488-M492 PolarHBondContact O-N 2.87Å; K488-M492 VanDerWaalsContact O-N 3.1Å
489	A	81.4	Confident	68.9	Low	50 Å²	50	112.8 Å²	112.8	41%	0.413	60%	0.602	S	S	.	*	H	α-helix	trans	-67	-46.8	174.3	0	0	0	0	0	111.3	K485 E486 L491 M492 Q493	K485-A489 WeakPolarHBondContact O-CB 3.46Å; K485-A489 PolarHBondContact O-N 2.95Å; E486-A489 WeakPolarHBondContact O-CB 3.46Å; E486-A489 PolarHBondContact O-N 3.49Å; E486-A489 VanDerWaalsContact O-N 3.12Å; A489-L491 VanDerWaalsContact C-N 3.3Å; A489-L491 PolarHBondContact O-N 3.3Å; A489-M492 PolarHBondContact O-N 2.92Å; A489-M492 VanDerWaalsContact O-N 3.12Å; A489-Q493 PolarHBondContact O-N 3.11Å
490	S	74.7	Confident	71.3	Confident	63 Å²	63	112.4 Å²	112.4	44%	0.441	59%	0.588	S	S	.	*	H	α-helix	trans	-58.6	-40.5	174.2	-55	0	0	0	0	111.9	E486 M492 Q493 L494	E486-S490 PolarHBondContact O-N 3.42Å; E486-S490 PolarHBondContact O-OG 2.99Å; E486-S490 VanDerWaalsContact O-OG 3.09Å; S490-M492 PolarHBondContact O-N 2.94Å; S490-Q493 PolarHBondContact O-N 3.13Å; S490-L494 WeakPolarHBondContact O-CB 3.4Å; S490-L494 PolarHBondContact O-N 3.27Å
491	L	79	Confident	73.2	Confident	95 Å²	95	107.7 Å²	107.7	50%	0.497	57%	0.569	S	S	.	*	H	α-helix	trans	-65.7	-34.8	175.8	-176.2	62.8	0	0	0	113.1	V487 A489 K495	V487-L491 WeakPolarHBondContact O-CB 3.4Å; V487-L491 PolarHBondContact O-N 3.34Å; A489-L491 VanDerWaalsContact C-N 3.3Å; A489-L491 PolarHBondContact O-N 3.3Å; L491-K495 WeakPolarHBondContact O-CG 3.47Å; L491-K495 PolarHBondContact O-N 3.22Å; L491-K495 VanDerWaalsContact O-N 3.15Å
492	M	80.9	Confident	75	Confident	133 Å²	133	104.9 Å²	104.9	66%	0.655	55%	0.552	S	S	*	*	H	α-helix	trans	-68.3	-42.8	172.7	-82.3	-164.8	167.5	0	0	111.9	K488 A489 S490 L494 K495 Q496	K488-M492 PolarHBondContact O-N 2.87Å; K488-M492 VanDerWaalsContact O-N 3.1Å; A489-M492 PolarHBondContact O-N 2.92Å; A489-M492 VanDerWaalsContact O-N 3.12Å; S490-M492 PolarHBondContact O-N 2.94Å; M492-L494 VanDerWaalsContact C-N 3.34Å; M492-L494 PolarHBondContact O-N 2.86Å; M492-K495 PolarHBondContact O-N 3.04Å; M492-Q496 PolarHBondContact O-N 3.37Å
493	Q	79.3	Confident	76.3	Confident	133 Å²	133	106.8 Å²	106.8	62%	0.621	56%	0.557	S	S	*	*	H	α-helix	trans	-60.3	-43.3	174.6	-71.6	-178.9	-16.7	0	0	111.4	A489 S490 K495 Q496 T497	A489-Q493 PolarHBondContact O-N 3.11Å; S490-Q493 PolarHBondContact O-N 3.13Å; Q493-K495 VanDerWaalsContact C-N 3.33Å; Q493-K495 PolarHBondContact O-N 2.92Å; Q493-Q496 PolarHBondContact O-N 3.47Å; Q493-Q496 VanDerWaalsContact O-N 3.14Å; Q493-T497 PolarHBondContact O-N 3.03Å; Q493-T497 PolarHBondContact O-OG1 3.45Å; Q493-T497 VanDerWaalsContact O-OG1 3.12Å
494	L	73	Confident	77.3	Confident	119 Å²	119	105.5 Å²	105.5	62%	0.623	55%	0.55	S	S	*	.	H	α-helix	trans	-60.4	-41.1	177.2	-157.5	81.4	0	0	0	112.3	S490 M492 T497 A498	S490-L494 WeakPolarHBondContact O-CB 3.4Å; S490-L494 PolarHBondContact O-N 3.27Å; M492-L494 VanDerWaalsContact C-N 3.34Å; M492-L494 PolarHBondContact O-N 2.86Å; L494-T497 WeakPolarHBondContact CA-OG1 3.31Å; L494-T497 PolarHBondContact O-OG1 3.36Å; L494-A498 WeakPolarHBondContact O-CB 3.36Å; L494-A498 PolarHBondContact O-N 3.31Å
495	K	82.5	Confident	77.9	Confident	147 Å²	147	102.9 Å²	102.9	64%	0.639	54%	0.536	S	S	*	.	H	α-helix	trans	-66.6	-37.1	174.8	-75.5	-176	177.9	-171.9	0	112.7	L491 M492 Q493 N499	L491-K495 WeakPolarHBondContact O-CG 3.47Å; L491-K495 PolarHBondContact O-N 3.22Å; L491-K495 VanDerWaalsContact O-N 3.15Å; M492-K495 PolarHBondContact O-N 3.04Å; Q493-K495 VanDerWaalsContact C-N 3.33Å; Q493-K495 PolarHBondContact O-N 2.92Å; K495-N499 PolarHBondContact O-N 2.99Å
496	Q	82.3	Confident	78.2	Confident	118 Å²	118	97.4 Å²	97.4	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-67.3	-47.5	176.3	-176.9	173.7	-19.9	0	0	111.1	M492 Q493 A498 N499 E500	M492-Q496 PolarHBondContact O-N 3.37Å; Q493-Q496 PolarHBondContact O-N 3.47Å; Q493-Q496 VanDerWaalsContact O-N 3.14Å; Q496-A498 VanDerWaalsContact C-N 3.27Å; Q496-A498 PolarHBondContact O-N 3.23Å; Q496-N499 PolarHBondContact O-N 3.3Å; Q496-N499 VanDerWaalsContact O-N 3.08Å; Q496-E500 WeakPolarHBondContact CG-OE1 3.22Å; Q496-E500 PolarHBondContact NE2-OE1 2.97Å; Q496-E500 WeakPolarHBondContact O-CG 3.38Å; Q496-E500 PolarHBondContact O-N 2.99Å
497	T	73.8	Confident	78.6	Confident	78 Å²	78	96.5 Å²	96.5	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-61.2	-34.5	177.2	49.5	0	0	0	0	112.7	Q493 L494 E500 S501	Q493-T497 PolarHBondContact O-N 3.03Å; Q493-T497 PolarHBondContact O-OG1 3.45Å; Q493-T497 VanDerWaalsContact O-OG1 3.12Å; L494-T497 WeakPolarHBondContact CA-OG1 3.31Å; L494-T497 PolarHBondContact O-OG1 3.36Å; T497-E500 PolarHBondContact O-N 2.9Å; T497-S501 PolarHBondContact O-N 3.47Å; T497-S501 PolarHBondContact O-OG 3.39Å
498	A	72.9	Confident	79	Confident	55 Å²	55	96.7 Å²	96.7	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-69	-31	175.2	0	0	0	0	0	113.5	L494 Q496 S501 A502	L494-A498 WeakPolarHBondContact O-CB 3.36Å; L494-A498 PolarHBondContact O-N 3.31Å; Q496-A498 VanDerWaalsContact C-N 3.27Å; Q496-A498 PolarHBondContact O-N 3.23Å; A498-S501 WeakPolarHBondContact CA-OG 3.26Å; A498-S501 PolarHBondContact O-OG 2.88Å; A498-A502 PolarHBondContact O-N 2.85Å
499	N	82.5	Confident	79.3	Confident	118 Å²	118	95.8 Å²	95.8	63%	0.631	52%	0.517	S	S	*	.	H	α-helix	trans	-76.2	-38.1	174.2	-165.4	16.1	0	0	0	111.2	K495 Q496 A502 K503	K495-N499 PolarHBondContact O-N 2.99Å; Q496-N499 PolarHBondContact O-N 3.3Å; Q496-N499 VanDerWaalsContact O-N 3.08Å; N499-A502 PolarHBondContact O-N 2.9Å; N499-K503 PolarHBondContact O-N 2.83Å
500	E	81.1	Confident	79.2	Confident	106 Å²	106	94.8 Å²	94.8	50%	0.495	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-38.7	173.8	-70.9	173	-169.9	0	0	111.9	Q496 T497 K503 L504	Q496-E500 WeakPolarHBondContact CG-OE1 3.22Å; Q496-E500 PolarHBondContact NE2-OE1 2.97Å; Q496-E500 WeakPolarHBondContact O-CG 3.38Å; Q496-E500 PolarHBondContact O-N 2.99Å; T497-E500 PolarHBondContact O-N 2.9Å; E500-K503 PolarHBondContact O-N 3.24Å; E500-L504 WeakPolarHBondContact O-CB 3.19Å; E500-L504 PolarHBondContact O-N 3.28Å
501	S	75.1	Confident	79.3	Confident	60 Å²	60	95.6 Å²	95.6	42%	0.42	51%	0.511	S	S	.	.	H	α-helix	trans	-66.5	-41	174	64.5	0	0	0	0	112.5	T497 A498 K503 L504 E505	T497-S501 PolarHBondContact O-N 3.47Å; T497-S501 PolarHBondContact O-OG 3.39Å; A498-S501 WeakPolarHBondContact CA-OG 3.26Å; A498-S501 PolarHBondContact O-OG 2.88Å; S501-K503 VanDerWaalsContact C-N 3.32Å; S501-K503 PolarHBondContact O-N 3.15Å; S501-L504 WeakPolarHBondContact O-CB 3.26Å; S501-L504 PolarHBondContact O-N 2.89Å; S501-L504 VanDerWaalsContact O-N 3.14Å; S501-E505 PolarHBondContact O-N 2.94Å
502	A	79.7	Confident	79.4	Confident	56 Å²	56	96.6 Å²	96.6	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-39.5	174.5	0	0	0	0	0	112.2	A498 N499 L504 E505 G506	A498-A502 PolarHBondContact O-N 2.85Å; N499-A502 PolarHBondContact O-N 2.9Å; A502-L504 VanDerWaalsContact C-N 3.34Å; A502-E505 PolarHBondContact O-N 3.49Å; A502-G506 PolarHBondContact O-N 3.33Å; A502-G506 VanDerWaalsContact O-N 3.13Å
503	K	82.7	Confident	79.4	Confident	158 Å²	158	93.3 Å²	93.3	69%	0.687	51%	0.507	S	S	*	.	H	α-helix	trans	-64.7	-38.2	173.1	-167.9	174.5	-176.1	175.8	0	111.8	N499 E500 S501 G506 L507	N499-K503 PolarHBondContact O-N 2.83Å; E500-K503 PolarHBondContact O-N 3.24Å; S501-K503 VanDerWaalsContact C-N 3.32Å; S501-K503 PolarHBondContact O-N 3.15Å; K503-G506 PolarHBondContact O-N 3.15Å; K503-L507 WeakPolarHBondContact O-CG 3.13Å; K503-L507 PolarHBondContact O-N 2.74Å; K503-L507 VanDerWaalsContact O-N 3.15Å
504	L	78.6	Confident	79.1	Confident	71 Å²	71	93.9 Å²	93.9	37%	0.372	50%	0.504	S	S	.	.	H	α-helix	trans	-66.9	-43.5	176.5	-163.9	76.6	0	0	0	112	L451 E500 S501 A502 G506 L507 I508	L451-L504 HydrophobicContact CD1-CD2 4.48Å; L451-L504 HydrophobicContact CD2-CD2 3.69Å; E500-L504 WeakPolarHBondContact O-CB 3.19Å; E500-L504 PolarHBondContact O-N 3.28Å; S501-L504 WeakPolarHBondContact O-CB 3.26Å; S501-L504 PolarHBondContact O-N 2.89Å; S501-L504 VanDerWaalsContact O-N 3.14Å; A502-L504 VanDerWaalsContact C-N 3.34Å; L504-G506 VanDerWaalsContact C-N 3.31Å; L504-G506 PolarHBondContact O-N 3.35Å; L504-L507 WeakPolarHBondContact O-CB 3.32Å; L504-L507 PolarHBondContact O-N 2.91Å; L504-L507 VanDerWaalsContact O-N 3.14Å; L504-I508 HydrophobicContact CG-CD1 4.27Å; L504-I508 WeakPolarHBondContact O-CG1 3.39Å; L504-I508 PolarHBondContact O-N 3.29Å
505	E	77.9	Confident	79.1	Confident	107 Å²	107	94 Å²	94	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-59.2	-40.7	174	-76.7	-170.4	-162.7	0	0	112.5	S501 A502 L507 I508 K509	S501-E505 PolarHBondContact O-N 2.94Å; A502-E505 PolarHBondContact O-N 3.49Å; E505-L507 VanDerWaalsContact C-N 3.33Å; E505-L507 PolarHBondContact O-N 3.37Å; E505-I508 PolarHBondContact O-N 3.12Å; E505-K509 WeakPolarHBondContact O-CG 3.46Å; E505-K509 PolarHBondContact O-N 3.41Å; E505-K509 IonicContact OE2-NZ 3.5Å
506	G	82.2	Confident	78.9	Confident	46 Å²	46	88.5 Å²	88.5	47%	0.474	48%	0.481	S	S	.	.	H	α-helix	trans	-60.6	-41.2	174.1	0	0	0	0	0	112.5	A502 K503 L504 G510	A502-G506 PolarHBondContact O-N 3.33Å; A502-G506 VanDerWaalsContact O-N 3.13Å; K503-G506 PolarHBondContact O-N 3.15Å; L504-G506 VanDerWaalsContact C-N 3.31Å; L504-G506 PolarHBondContact O-N 3.35Å; G506-G510 PolarHBondContact O-N 3.15Å
507	L	79.2	Confident	78.7	Confident	99 Å²	99	87.6 Å²	87.6	52%	0.518	48%	0.477	S	S	.	.	H	α-helix	trans	-67.5	-37.4	175.2	-70.5	171.4	0	0	0	112.7	K503 L504 E505 G510 L511	K503-L507 WeakPolarHBondContact O-CG 3.13Å; K503-L507 PolarHBondContact O-N 2.74Å; K503-L507 VanDerWaalsContact O-N 3.15Å; L504-L507 WeakPolarHBondContact O-CB 3.32Å; L504-L507 PolarHBondContact O-N 2.91Å; L504-L507 VanDerWaalsContact O-N 3.14Å; E505-L507 VanDerWaalsContact C-N 3.33Å; E505-L507 PolarHBondContact O-N 3.37Å; L507-G510 CarbonylContact O-C 3.6Å; L507-G510 PolarHBondContact O-N 2.94Å; L507-L511 WeakPolarHBondContact O-CG 3.37Å; L507-L511 PolarHBondContact O-N 3.11Å
508	I	81.3	Confident	78.8	Confident	76 Å²	76	87.9 Å²	87.9	39%	0.39	47%	0.474	S	S	.	.	H	α-helix	trans	-64.3	-51.9	175.7	-68.7	164.7	0	0	0	110.2	L504 E505 G510 L511 E512	L504-I508 HydrophobicContact CG-CD1 4.27Å; L504-I508 WeakPolarHBondContact O-CG1 3.39Å; L504-I508 PolarHBondContact O-N 3.29Å; E505-I508 PolarHBondContact O-N 3.12Å; I508-G510 VanDerWaalsContact C-N 3.25Å; I508-G510 PolarHBondContact O-N 3.29Å; I508-L511 CarbonylContact O-C 3.59Å; I508-L511 WeakPolarHBondContact O-CA 3.47Å; I508-L511 WeakPolarHBondContact O-CB 3.47Å; I508-L511 PolarHBondContact O-N 3.38Å; I508-E512 HydrophobicContact CG2-CG 4.41Å; I508-E512 WeakPolarHBondContact O-CG 3.39Å; I508-E512 PolarHBondContact O-N 2.83Å
509	K	84.9	Confident	79	Confident	123 Å²	123	89.8 Å²	89.8	54%	0.535	47%	0.473	S	S	.	.	H	α-helix	trans	-57.6	-38.7	175.7	-71.4	167	-179.1	158.1	0	111.9	E505 L511 E512 A513	E505-K509 WeakPolarHBondContact O-CG 3.46Å; E505-K509 PolarHBondContact O-N 3.41Å; E505-K509 IonicContact OE2-NZ 3.5Å; K509-L511 VanDerWaalsContact C-N 3.32Å; K509-L511 PolarHBondContact O-N 2.87Å; K509-E512 PolarHBondContact O-N 2.74Å; K509-A513 WeakPolarHBondContact O-CB 3.37Å; K509-A513 PolarHBondContact O-N 2.83Å
510	G	80	Confident	78.8	Confident	30 Å²	30	91.9 Å²	91.9	31%	0.309	47%	0.472	S	S	.	.	H	α-helix	trans	-70.2	-20.1	173.7	0	0	0	0	0	114.9	G506 L507 I508 R514	G506-G510 PolarHBondContact O-N 3.15Å; L507-G510 CarbonylContact O-C 3.6Å; L507-G510 PolarHBondContact O-N 2.94Å; I508-G510 VanDerWaalsContact C-N 3.25Å; I508-G510 PolarHBondContact O-N 3.29Å; G510-R514 WeakPolarHBondContact O-CG 3.42Å; G510-R514 PolarHBondContact O-NE 2.74Å
511	L	77.4	Confident	78.3	Confident	79 Å²	79	91.8 Å²	91.8	41%	0.414	47%	0.472	S	S	.	.	H	α-helix	trans	-83.5	-45.7	170	-77.5	164.4	0	0	0	110.8	L507 I508 K509 A513 R514 F515	L507-L511 WeakPolarHBondContact O-CG 3.37Å; L507-L511 PolarHBondContact O-N 3.11Å; I508-L511 CarbonylContact O-C 3.59Å; I508-L511 WeakPolarHBondContact O-CA 3.47Å; I508-L511 WeakPolarHBondContact O-CB 3.47Å; I508-L511 PolarHBondContact O-N 3.38Å; K509-L511 VanDerWaalsContact C-N 3.32Å; K509-L511 PolarHBondContact O-N 2.87Å; L511-A513 VanDerWaalsContact C-N 3.32Å; L511-A513 PolarHBondContact O-N 3.5Å; L511-R514 CarbonylContact O-C 3.59Å; L511-R514 WeakPolarHBondContact O-CA 3.28Å; L511-R514 WeakPolarHBondContact O-CB 3.4Å; L511-R514 PolarHBondContact O-N 3.03Å; L511-F515 HydrophobicContact CB-CD2 4.49Å; L511-F515 HydrophobicContact CB-CE2 4.34Å; L511-F515 WeakPolarHBondContact O-CD2 3.34Å; L511-F515 PolarHBondContact O-N 2.85Å
512	E	79.8	Confident	78.3	Confident	116 Å²	116	91.6 Å²	91.6	54%	0.542	47%	0.468	S	S	.	.	H	α-helix	trans	-54.4	-45.8	175.6	-69.6	172.4	158.9	0	0	111.8	I508 K509 R514 F515 A516	I508-E512 HydrophobicContact CG2-CG 4.41Å; I508-E512 WeakPolarHBondContact O-CG 3.39Å; I508-E512 PolarHBondContact O-N 2.83Å; K509-E512 PolarHBondContact O-N 2.74Å; E512-R514 VanDerWaalsContact C-N 3.29Å; E512-R514 PolarHBondContact O-N 3.28Å; E512-F515 PolarHBondContact O-N 2.67Å; E512-A516 WeakPolarHBondContact O-CB 3.39Å; E512-A516 PolarHBondContact O-N 3.39Å
513	A	80.8	Confident	78.1	Confident	65 Å²	65	93 Å²	93	54%	0.537	47%	0.465	S	S	.	.	H	α-helix	trans	-60.7	-35.5	175.2	0	0	0	0	0	113.2	K509 L511 H517	K509-A513 WeakPolarHBondContact O-CB 3.37Å; K509-A513 PolarHBondContact O-N 2.83Å; L511-A513 VanDerWaalsContact C-N 3.32Å; L511-A513 PolarHBondContact O-N 3.5Å; A513-H517 PolarHBondContact O-N 3.24Å; A513-H517 VanDerWaalsContact O-N 3.09Å
514	R	74.3	Confident	77.7	Confident	145 Å²	145	88.6 Å²	88.6	55%	0.547	45%	0.451	S	S	.	.	H	α-helix	trans	-73.4	-37.6	175.8	-78.3	-179	-76.5	178.8	-4.8	112.2	G510 L511 E512 H517 M518	G510-R514 WeakPolarHBondContact O-CG 3.42Å; G510-R514 PolarHBondContact O-NE 2.74Å; L511-R514 CarbonylContact O-C 3.59Å; L511-R514 WeakPolarHBondContact O-CA 3.28Å; L511-R514 WeakPolarHBondContact O-CB 3.4Å; L511-R514 PolarHBondContact O-N 3.03Å; E512-R514 VanDerWaalsContact C-N 3.29Å; E512-R514 PolarHBondContact O-N 3.28Å; R514-H517 PolarHBondContact O-N 2.94Å; R514-M518 WeakPolarHBondContact O-CG 3.27Å; R514-M518 PolarHBondContact O-N 3.3Å
515	F	71.8	Confident	77.6	Confident	122 Å²	122	88 Å²	88	54%	0.535	45%	0.451	S	S	.	.	H	α-helix	trans	-62.4	-50.7	171.6	-76	-67.7	0	0	0	111	L511 E512 H517 M518 E519	L511-F515 HydrophobicContact CB-CD2 4.49Å; L511-F515 HydrophobicContact CB-CE2 4.34Å; L511-F515 WeakPolarHBondContact O-CD2 3.34Å; L511-F515 PolarHBondContact O-N 2.85Å; E512-F515 PolarHBondContact O-N 2.67Å; F515-H517 PolarHBondContact O-N 3.43Å; F515-M518 HydrophobicContact CD1-CE 3.55Å; F515-M518 HydrophobicContact CE1-CE 3.87Å; F515-M518 HydrophobicContact CG-CE 4.26Å; F515-M518 WeakPolarHBondContact O-CA 3.44Å; F515-M518 PolarHBondContact O-N 2.92Å; F515-E519 WeakPolarHBondContact O-CG 3.37Å; F515-E519 PolarHBondContact O-N 3.04Å
516	A	79.9	Confident	77.4	Confident	31 Å²	31	85.1 Å²	85.1	26%	0.256	44%	0.442	S	S	.	.	H	α-helix	trans	-59.5	-30.5	177.1	0	0	0	0	0	113.4	E512 R520	E512-A516 WeakPolarHBondContact O-CB 3.39Å; E512-A516 PolarHBondContact O-N 3.39Å; A516-R520 WeakPolarHBondContact O-CG 3.44Å; A516-R520 PolarHBondContact O-N 3.02Å; A516-R520 PolarHBondContact O-NE 3.43Å
517	H	77.9	Confident	77.1	Confident	99 Å²	99	87.7 Å²	87.7	46%	0.458	45%	0.445	S	S	.	.	H	α-helix	trans	-69	-46	170.8	180	-85.3	0	0	0	112.1	A513 R514 F515 E519 R520 Q521	A513-H517 PolarHBondContact O-N 3.24Å; A513-H517 VanDerWaalsContact O-N 3.09Å; R514-H517 PolarHBondContact O-N 2.94Å; F515-H517 PolarHBondContact O-N 3.43Å; H517-E519 VanDerWaalsContact C-N 3.33Å; H517-E519 PolarHBondContact O-N 3.47Å; H517-R520 PolarHBondContact O-N 2.99Å; H517-Q521 PolarHBondContact CE1-NE2 3.21Å; H517-Q521 PolarHBondContact ND1-OE1 3.48Å; H517-Q521 PolarHBondContact O-N 2.91Å; H517-Q521 VanDerWaalsContact O-N 3.11Å
518	M	75.4	Confident	77	Confident	83 Å²	83	85.2 Å²	85.2	41%	0.409	43%	0.434	S	S	.	.	H	α-helix	trans	-62.2	-38.5	176.5	-73.7	-172.8	-67.3	0	0	112.2	R514 F515 R520 Q521 V522	R514-M518 WeakPolarHBondContact O-CG 3.27Å; R514-M518 PolarHBondContact O-N 3.3Å; F515-M518 HydrophobicContact CD1-CE 3.55Å; F515-M518 HydrophobicContact CE1-CE 3.87Å; F515-M518 HydrophobicContact CG-CE 4.26Å; F515-M518 WeakPolarHBondContact O-CA 3.44Å; F515-M518 PolarHBondContact O-N 2.92Å; M518-R520 PolarHBondContact O-N 3.34Å; M518-Q521 CarbonylContact O-C 3.51Å; M518-Q521 WeakPolarHBondContact O-CA 3.44Å; M518-Q521 WeakPolarHBondContact O-CB 3.32Å; M518-Q521 PolarHBondContact O-N 3.43Å; M518-Q521 VanDerWaalsContact O-N 3.09Å; M518-V522 WeakPolarHBondContact O-CG2 3.3Å; M518-V522 PolarHBondContact O-N 2.93Å
519	E	77.1	Confident	76.7	Confident	96 Å²	96	84.1 Å²	84.1	45%	0.449	43%	0.429	S	S	.	.	H	α-helix	trans	-59.2	-44.3	176.1	-69.3	-179.3	158.8	0	0	112.2	F435 F515 H517 Q521 V522 E523	F435-E519 HydrophobicContact CE1-CG 4.42Å; F435-E519 WeakPolarHBondContact CE1-OE1 3.44Å; F435-E519 HydrophobicContact CZ-CG 3.88Å; F435-E519 VanDerWaalsContact CZ-OE1 3.25Å; F435-E519 WeakPolarHBondContact CZ-OE1 3.45Å; F515-E519 WeakPolarHBondContact O-CG 3.37Å; F515-E519 PolarHBondContact O-N 3.04Å; H517-E519 VanDerWaalsContact C-N 3.33Å; H517-E519 PolarHBondContact O-N 3.47Å; E519-Q521 VanDerWaalsContact C-N 3.3Å; E519-Q521 PolarHBondContact O-N 2.85Å; E519-V522 PolarHBondContact O-N 3.29Å; E519-E523 PolarHBondContact O-N 3.27Å
520	R	77.7	Confident	76.2	Confident	162 Å²	162	85 Å²	85	61%	0.611	43%	0.433	S	S	*	.	H	α-helix	trans	-64.4	-34.6	174.1	-64.4	175.2	-145.9	157.5	5	112.2	A516 H517 M518 T524	A516-R520 WeakPolarHBondContact O-CG 3.44Å; A516-R520 PolarHBondContact O-N 3.02Å; A516-R520 PolarHBondContact O-NE 3.43Å; H517-R520 PolarHBondContact O-N 2.99Å; M518-R520 PolarHBondContact O-N 3.34Å; R520-T524 WeakPolarHBondContact O-CB 3.36Å; R520-T524 WeakPolarHBondContact O-CG2 3.37Å; R520-T524 PolarHBondContact O-N 3.21Å; R520-T524 PolarHBondContact O-OG1 3.07Å
521	Q	71.7	Confident	76	Confident	103 Å²	103	85.8 Å²	85.8	48%	0.481	44%	0.437	S	S	.	.	H	α-helix	trans	-67.5	-39.4	173.8	-71.3	-173.6	-51.1	0	0	111.9	H517 M518 E519 T524 T525	H517-Q521 PolarHBondContact CE1-NE2 3.21Å; H517-Q521 PolarHBondContact ND1-OE1 3.48Å; H517-Q521 PolarHBondContact O-N 2.91Å; H517-Q521 VanDerWaalsContact O-N 3.11Å; M518-Q521 CarbonylContact O-C 3.51Å; M518-Q521 WeakPolarHBondContact O-CA 3.44Å; M518-Q521 WeakPolarHBondContact O-CB 3.32Å; M518-Q521 PolarHBondContact O-N 3.43Å; M518-Q521 VanDerWaalsContact O-N 3.09Å; E519-Q521 VanDerWaalsContact C-N 3.3Å; E519-Q521 PolarHBondContact O-N 2.85Å; Q521-T524 WeakPolarHBondContact CA-OG1 3.34Å; Q521-T524 PolarHBondContact O-OG1 2.82Å; Q521-T525 WeakPolarHBondContact O-CB 3.47Å; Q521-T525 VanDerWaalsContact O-CG2 3.32Å; Q521-T525 WeakPolarHBondContact O-CG2 3.26Å; Q521-T525 PolarHBondContact O-N 3.03Å; Q521-T525 PolarHBondContact O-OG1 2.77Å
522	V	75.2	Confident	76.1	Confident	57 Å²	57	86.3 Å²	86.3	35%	0.345	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-42.3	175.1	172.6	0	0	0	0	111.2	L434 M518 E519 T525 S526	L434-V522 HydrophobicContact CD1-CG1 3.89Å; M518-V522 WeakPolarHBondContact O-CG2 3.3Å; M518-V522 PolarHBondContact O-N 2.93Å; E519-V522 PolarHBondContact O-N 3.29Å; V522-T525 WeakPolarHBondContact CA-OG1 3.26Å; V522-T525 PolarHBondContact O-OG1 3.33Å; V522-T525 VanDerWaalsContact O-OG1 3.07Å; V522-S526 VanDerWaalsContact O-CB 3.25Å; V522-S526 WeakPolarHBondContact O-CB 3.4Å; V522-S526 PolarHBondContact O-N 3.3Å
523	E	73.6	Confident	75.9	Confident	85 Å²	85	84.8 Å²	84.8	40%	0.397	44%	0.435	S	S	.	.	H	α-helix	trans	-68	-42.2	177.5	-174	158	-116.1	0	0	112.5	K431 E519 S526 N527	K431-E523 IonicContact NZ-OE1 3.28Å; K431-E523 PolarHBondContact NZ-OE1 3.47Å; E519-E523 PolarHBondContact O-N 3.27Å; E523-S526 PolarHBondContact O-N 3Å; E523-N527 WeakPolarHBondContact O-CB 3.37Å; E523-N527 PolarHBondContact O-N 3.17Å; E523-N527 PolarHBondContact O-ND2 3.32Å
524	T	75.6	Confident	75.6	Confident	65 Å²	65	86.5 Å²	86.5	40%	0.399	43%	0.432	S	S	.	.	H	α-helix	trans	-66.6	-39.7	176	47.2	0	0	0	0	112.5	R520 Q521 N527 T528	R520-T524 WeakPolarHBondContact O-CB 3.36Å; R520-T524 WeakPolarHBondContact O-CG2 3.37Å; R520-T524 PolarHBondContact O-N 3.21Å; R520-T524 PolarHBondContact O-OG1 3.07Å; Q521-T524 WeakPolarHBondContact CA-OG1 3.34Å; Q521-T524 PolarHBondContact O-OG1 2.82Å; T524-N527 PolarHBondContact O-N 3.21Å; T524-T528 WeakPolarHBondContact O-CG2 3.42Å; T524-T528 PolarHBondContact O-N 3.37Å; T524-T528 PolarHBondContact O-OG1 2.88Å
525	T	75.2	Confident	75.6	Confident	58 Å²	58	83.6 Å²	83.6	36%	0.356	43%	0.425	S	S	.	.	H	α-helix	trans	-68.9	-37.7	174.1	50.2	0	0	0	0	112.6	Q521 V522 N527 T528 L529	Q521-T525 WeakPolarHBondContact O-CB 3.47Å; Q521-T525 VanDerWaalsContact O-CG2 3.32Å; Q521-T525 WeakPolarHBondContact O-CG2 3.26Å; Q521-T525 PolarHBondContact O-N 3.03Å; Q521-T525 PolarHBondContact O-OG1 2.77Å; V522-T525 WeakPolarHBondContact CA-OG1 3.26Å; V522-T525 PolarHBondContact O-OG1 3.33Å; V522-T525 VanDerWaalsContact O-OG1 3.07Å; T525-N527 VanDerWaalsContact C-N 3.33Å; T525-N527 PolarHBondContact O-N 2.87Å; T525-T528 WeakPolarHBondContact CA-OG1 3.49Å; T525-T528 PolarHBondContact O-N 3.36Å; T525-T528 PolarHBondContact O-OG1 2.98Å; T525-T528 VanDerWaalsContact O-OG1 3.06Å; T525-L529 WeakPolarHBondContact O-CB 3.49Å; T525-L529 WeakPolarHBondContact O-CG 3.22Å; T525-L529 PolarHBondContact O-N 3.4Å
526	S	73.9	Confident	75.7	Confident	47 Å²	47	83.4 Å²	83.4	33%	0.329	43%	0.426	S	S	.	.	H	α-helix	trans	-60.2	-43.2	172.6	-173.2	0	0	0	0	111.8	V522 E523 L529 F530	V522-S526 VanDerWaalsContact O-CB 3.25Å; V522-S526 WeakPolarHBondContact O-CB 3.4Å; V522-S526 PolarHBondContact O-N 3.3Å; E523-S526 PolarHBondContact O-N 3Å; S526-L529 PolarHBondContact O-N 2.79Å; S526-F530 WeakPolarHBondContact O-CB 3.46Å; S526-F530 PolarHBondContact O-N 2.88Å
527	N	76	Confident	75.5	Confident	100 Å²	100	85.8 Å²	85.8	54%	0.535	44%	0.437	S	S	.	.	H	α-helix	trans	-70	-37.9	-179.9	-69.6	-18.7	0	0	0	112.6	E523 T524 T525 A531	E523-N527 WeakPolarHBondContact O-CB 3.37Å; E523-N527 PolarHBondContact O-N 3.17Å; E523-N527 PolarHBondContact O-ND2 3.32Å; T524-N527 PolarHBondContact O-N 3.21Å; T525-N527 VanDerWaalsContact C-N 3.33Å; T525-N527 PolarHBondContact O-N 2.87Å; N527-A531 PolarHBondContact O-N 3.27Å; N527-A531 VanDerWaalsContact O-N 3.12Å
528	T	76.7	Confident	75.3	Confident	47 Å²	47	85 Å²	85	29%	0.288	43%	0.434	S	S	.	.	H	α-helix	trans	-69.3	-38.2	174.5	54.8	0	0	0	0	111.9	L383 T524 T525 A531 V532	L383-T528 HydrophobicContact CD2-CG2 4.17Å; T524-T528 WeakPolarHBondContact O-CG2 3.42Å; T524-T528 PolarHBondContact O-N 3.37Å; T524-T528 PolarHBondContact O-OG1 2.88Å; T525-T528 WeakPolarHBondContact CA-OG1 3.49Å; T525-T528 PolarHBondContact O-N 3.36Å; T525-T528 PolarHBondContact O-OG1 2.98Å; T525-T528 VanDerWaalsContact O-OG1 3.06Å; T528-A531 PolarHBondContact O-N 2.88Å; T528-V532 WeakPolarHBondContact O-CG2 3.25Å; T528-V532 PolarHBondContact O-N 2.88Å
529	L	75.7	Confident	75.2	Confident	54 Å²	54	86.7 Å²	86.7	28%	0.283	44%	0.442	S	S	.	.	H	α-helix	trans	-62.6	-45	173.3	-72.5	175.8	0	0	0	111.9	L417 T525 S526 A531 V532 F533	L417-L529 HydrophobicContact CD1-CD1 4.35Å; L417-L529 HydrophobicContact CD1-CD2 4.01Å; L417-L529 HydrophobicContact CD2-CD1 3.91Å; L417-L529 HydrophobicContact CD2-CD2 3.44Å; L417-L529 VanDerWaalsContact CD2-CD2 3.44Å; L417-L529 HydrophobicContact CD2-CG 4.25Å; L417-L529 HydrophobicContact CG-CD1 4.47Å; L417-L529 HydrophobicContact CG-CD2 4.36Å; T525-L529 WeakPolarHBondContact O-CB 3.49Å; T525-L529 WeakPolarHBondContact O-CG 3.22Å; T525-L529 PolarHBondContact O-N 3.4Å; S526-L529 PolarHBondContact O-N 2.79Å; L529-A531 VanDerWaalsContact C-N 3.3Å; L529-A531 PolarHBondContact O-N 3.17Å; L529-V532 PolarHBondContact O-N 2.91Å; L529-V532 VanDerWaalsContact O-N 3.1Å; L529-F533 HydrophobicContact CB-CE2 4.39Å; L529-F533 WeakPolarHBondContact O-CD2 3.38Å; L529-F533 PolarHBondContact O-N 2.92Å
530	F	74.3	Confident	75	Confident	140 Å²	140	87.6 Å²	87.6	61%	0.614	45%	0.446	S	S	*	.	H	α-helix	trans	-58.1	-42.5	175.7	-173.3	-95.6	0	0	0	112.1	S526 V532 F533 H534	S526-F530 WeakPolarHBondContact O-CB 3.46Å; S526-F530 PolarHBondContact O-N 2.88Å; F530-V532 PolarHBondContact O-N 3.39Å; F530-F533 PolarHBondContact O-N 2.95Å; F530-H534 WeakPolarHBondContact O-CB 3.39Å; F530-H534 PolarHBondContact O-N 3.19Å
531	A	76.1	Confident	74.7	Confident	47 Å²	47	84 Å²	84	39%	0.388	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-37.6	174.9	0	0	0	0	0	113	N527 T528 L529 M535	N527-A531 PolarHBondContact O-N 3.27Å; N527-A531 VanDerWaalsContact O-N 3.12Å; T528-A531 PolarHBondContact O-N 2.88Å; L529-A531 VanDerWaalsContact C-N 3.3Å; L529-A531 PolarHBondContact O-N 3.17Å; A531-M535 VanDerWaalsContact O-CG 3.29Å; A531-M535 WeakPolarHBondContact O-CG 3.38Å; A531-M535 PolarHBondContact O-N 2.94Å
532	V	79.8	Confident	74.7	Confident	90 Å²	90	82 Å²	82	55%	0.545	44%	0.441	S	S	.	.	H	α-helix	trans	-67.4	-42.9	174.7	171.3	0	0	0	0	111.4	T528 L529 F530 M535 Q536	T528-V532 WeakPolarHBondContact O-CG2 3.25Å; T528-V532 PolarHBondContact O-N 2.88Å; L529-V532 PolarHBondContact O-N 2.91Å; L529-V532 VanDerWaalsContact O-N 3.1Å; F530-V532 PolarHBondContact O-N 3.39Å; V532-M535 PolarHBondContact O-N 2.82Å; V532-Q536 WeakPolarHBondContact O-CB 3.44Å; V532-Q536 PolarHBondContact O-N 2.76Å
533	F	74.4	Confident	74.5	Confident	84 Å²	84	84.9 Å²	84.9	37%	0.368	45%	0.448	S	S	.	.	H	α-helix	trans	-63.2	-41.9	175.1	-76.4	-65.8	0	0	0	112.1	L417 A420 L529 F530 Q536 T537	L417-F533 HydrophobicContact CD2-CE2 4.43Å; L417-F533 HydrophobicContact CD2-CZ 4.32Å; A420-F533 HydrophobicContact CB-CE1 3.9Å; A420-F533 HydrophobicContact CB-CZ 3.6Å; L529-F533 HydrophobicContact CB-CE2 4.39Å; L529-F533 WeakPolarHBondContact O-CD2 3.38Å; L529-F533 PolarHBondContact O-N 2.92Å; F530-F533 PolarHBondContact O-N 2.95Å; F533-Q536 PolarHBondContact O-N 3.02Å; F533-T537 PolarHBondContact O-N 2.8Å; F533-T537 PolarHBondContact O-OG1 3.4Å
534	H	74.9	Confident	74.3	Confident	101 Å²	101	83.6 Å²	83.6	47%	0.468	45%	0.448	S	S	.	.	H	α-helix	trans	-59.3	-49.1	175	-169.2	-80.7	0	0	0	111.7	F530 Q536 T537 E538	F530-H534 WeakPolarHBondContact O-CB 3.39Å; F530-H534 PolarHBondContact O-N 3.19Å; H534-Q536 VanDerWaalsContact C-N 3.32Å; H534-Q536 PolarHBondContact O-N 2.76Å; H534-T537 PolarHBondContact O-N 3.09Å; H534-E538 VanDerWaalsContact CE1-CD 3.43Å; H534-E538 IonicContact CE1-OE1 2.68Å; H534-E538 PolarHBondContact CE1-OE1 3.2Å; H534-E538 IonicContact CE1-OE2 3.1Å; H534-E538 IonicContact ND1-OE1 3.87Å; H534-E538 IonicContact ND1-OE2 3.88Å; H534-E538 PolarHBondContact O-N 3.32Å
535	M	75.5	Confident	74.1	Confident	84 Å²	84	85.7 Å²	85.7	41%	0.414	46%	0.457	S	S	.	.	H	α-helix	trans	-57.6	-42.5	175.6	-75.7	-76.9	-164.1	0	0	112.4	L379 A531 V532 E538 M539	L379-M535 HydrophobicContact CD2-CE 3.57Å; A531-M535 VanDerWaalsContact O-CG 3.29Å; A531-M535 WeakPolarHBondContact O-CG 3.38Å; A531-M535 PolarHBondContact O-N 2.94Å; V532-M535 PolarHBondContact O-N 2.82Å; M535-E538 PolarHBondContact O-N 3.48Å; M535-M539 WeakPolarHBondContact O-CB 3.47Å; M535-M539 WeakPolarHBondContact O-CG 3.28Å; M535-M539 PolarHBondContact O-N 3.32Å
536	Q	74.2	Confident	73.9	Confident	119 Å²	119	88.5 Å²	88.5	56%	0.556	47%	0.465	S	S	*	.	H	α-helix	trans	-66.1	-38.5	178.4	-172.2	65.5	12.3	0	0	111.8	V532 F533 H534 M539 H540	V532-Q536 WeakPolarHBondContact O-CB 3.44Å; V532-Q536 PolarHBondContact O-N 2.76Å; F533-Q536 PolarHBondContact O-N 3.02Å; H534-Q536 VanDerWaalsContact C-N 3.32Å; H534-Q536 PolarHBondContact O-N 2.76Å; Q536-M539 PolarHBondContact O-N 2.96Å; Q536-H540 WeakPolarHBondContact O-CB 3.34Å; Q536-H540 PolarHBondContact O-N 3.26Å
537	T	74	Confident	73.7	Confident	80 Å²	80	91.8 Å²	91.8	49%	0.491	47%	0.473	S	S	.	.	H	α-helix	trans	-68.8	-41.8	175.5	-62.6	0	0	0	0	111.7	F533 H534 M539 H540 N541	F533-T537 PolarHBondContact O-N 2.8Å; F533-T537 PolarHBondContact O-OG1 3.4Å; H534-T537 PolarHBondContact O-N 3.09Å; T537-M539 PolarHBondContact O-N 3.25Å; T537-H540 PolarHBondContact O-N 3Å; T537-N541 WeakPolarHBondContact O-CB 3.19Å; T537-N541 VanDerWaalsContact O-CG 3.3Å; T537-N541 PolarHBondContact O-N 3.21Å
538	E	73.9	Confident	73.6	Confident	82 Å²	82	89 Å²	89	38%	0.383	47%	0.467	S	S	.	.	H	α-helix	trans	-61	-43	172.8	-73.5	-172.9	138.4	0	0	111.8	H534 M535 N541 A542	H534-E538 VanDerWaalsContact CE1-CD 3.43Å; H534-E538 IonicContact CE1-OE1 2.68Å; H534-E538 PolarHBondContact CE1-OE1 3.2Å; H534-E538 IonicContact CE1-OE2 3.1Å; H534-E538 IonicContact ND1-OE1 3.87Å; H534-E538 IonicContact ND1-OE2 3.88Å; H534-E538 PolarHBondContact O-N 3.32Å; M535-E538 PolarHBondContact O-N 3.48Å; E538-N541 PolarHBondContact O-N 3.03Å; E538-A542 WeakPolarHBondContact O-CB 3.23Å; E538-A542 PolarHBondContact O-N 3.07Å
539	M	74.2	Confident	73.4	Confident	119 Å²	119	91.6 Å²	91.6	59%	0.586	48%	0.479	S	S	*	.	H	α-helix	trans	-62.5	-40.8	174	-78.8	-167.7	154.2	0	0	112.6	M535 Q536 T537 F543	M535-M539 WeakPolarHBondContact O-CB 3.47Å; M535-M539 WeakPolarHBondContact O-CG 3.28Å; M535-M539 PolarHBondContact O-N 3.32Å; Q536-M539 PolarHBondContact O-N 2.96Å; T537-M539 PolarHBondContact O-N 3.25Å; M539-F543 WeakPolarHBondContact O-CB 3.4Å; M539-F543 PolarHBondContact O-N 3.14Å
540	H	71.4	Confident	73.3	Confident	115 Å²	115	93 Å²	93	53%	0.532	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-46.1	176.6	-163.3	104.6	0	0	0	111.4	Q536 T537 F543 C544	Q536-H540 WeakPolarHBondContact O-CB 3.34Å; Q536-H540 PolarHBondContact O-N 3.26Å; T537-H540 PolarHBondContact O-N 3Å; H540-F543 PolarHBondContact O-N 3.32Å; H540-C544 VanDerWaalsContact CD2-SG 3.58Å; H540-C544 WeakPolarHBondContact O-CB 3.31Å; H540-C544 PolarHBondContact O-N 3.37Å
541	N	72	Confident	73.6	Confident	88 Å²	88	90.1 Å²	90.1	47%	0.471	48%	0.48	S	S	.	.	H	α-helix	trans	-62.8	-44	178.3	-72.4	-12.4	0	0	0	111.6	T537 E538 F543 C544 N545	T537-N541 WeakPolarHBondContact O-CB 3.19Å; T537-N541 VanDerWaalsContact O-CG 3.3Å; T537-N541 PolarHBondContact O-N 3.21Å; E538-N541 PolarHBondContact O-N 3.03Å; N541-F543 VanDerWaalsContact C-N 3.32Å; N541-F543 PolarHBondContact O-N 2.89Å; N541-C544 PolarHBondContact O-N 3.06Å; N541-N545 WeakPolarHBondContact O-CB 3.49Å; N541-N545 VanDerWaalsContact O-CG 3.27Å; N541-N545 PolarHBondContact O-N 2.89Å
542	A	72.3	Confident	73.8	Confident	61 Å²	61	91.5 Å²	91.5	50%	0.504	48%	0.478	S	S	.	.	H	α-helix	trans	-60.4	-40.1	174.7	0	0	0	0	0	112.3	E538 F546	E538-A542 WeakPolarHBondContact O-CB 3.23Å; E538-A542 PolarHBondContact O-N 3.07Å; A542-F546 WeakPolarHBondContact O-CB 3.28Å; A542-F546 PolarHBondContact O-N 3.48Å
543	F	70.2	Confident	73.7	Confident	116 Å²	116	93.7 Å²	93.7	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-72	-35.1	177.6	-171.4	-110.8	0	0	0	113.2	M539 H540 N541 K547	M539-F543 WeakPolarHBondContact O-CB 3.4Å; M539-F543 PolarHBondContact O-N 3.14Å; H540-F543 PolarHBondContact O-N 3.32Å; N541-F543 VanDerWaalsContact C-N 3.32Å; N541-F543 PolarHBondContact O-N 2.89Å; F543-K547 HydrophobicContact CD1-CD 4.43Å; F543-K547 HydrophobicContact CE1-CD 4.1Å; F543-K547 PolarHBondContact O-N 2.9Å
544	C	70.3	Confident	74	Confident	59 Å²	59	94.4 Å²	94.4	40%	0.399	49%	0.489	S	S	.	.	H	α-helix	trans	-66.3	-43.4	172.6	-81.7	0	0	0	0	112	H540 N541 K547 G548	H540-C544 VanDerWaalsContact CD2-SG 3.58Å; H540-C544 WeakPolarHBondContact O-CB 3.31Å; H540-C544 PolarHBondContact O-N 3.37Å; N541-C544 PolarHBondContact O-N 3.06Å; C544-K547 PolarHBondContact O-N 2.87Å; C544-G548 PolarHBondContact O-N 3.35Å
545	N	72.2	Confident	74.5	Confident	109 Å²	109	94.2 Å²	94.2	58%	0.583	49%	0.487	S	S	*	.	H	α-helix	trans	-61.8	-46.2	174.3	-68.7	-7.2	0	0	0	110.9	N541 K547 G548 D549	N541-N545 WeakPolarHBondContact O-CB 3.49Å; N541-N545 VanDerWaalsContact O-CG 3.27Å; N541-N545 PolarHBondContact O-N 2.89Å; N545-K547 VanDerWaalsContact C-N 3.3Å; N545-K547 PolarHBondContact O-N 3.28Å; N545-G548 WeakPolarHBondContact O-CA 3.15Å; N545-G548 PolarHBondContact O-N 3.42Å; N545-D549 PolarHBondContact O-N 3.48Å
546	F	70.8	Confident	75	Confident	117 Å²	117	93.7 Å²	93.7	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-58.1	-38.7	175.3	180	-105	0	0	0	113.3	A542 M550	A542-F546 WeakPolarHBondContact O-CB 3.28Å; A542-F546 PolarHBondContact O-N 3.48Å; F546-M550 HydrophobicContact CD1-CE 4.25Å; F546-M550 HydrophobicContact CE1-CE 3.4Å; F546-M550 HydrophobicContact CZ-CE 3.63Å; F546-M550 WeakPolarHBondContact O-CB 3.36Å; F546-M550 PolarHBondContact O-N 3.06Å
547	K	68.7	Low	75.4	Confident	116 Å²	116	92.5 Å²	92.5	50%	0.504	49%	0.486	S	S	.	.	H	α-helix	trans	-66.1	-40	171.9	-82	-177.5	170.7	-180	0	112.5	F543 C544 N545 V551	F543-K547 HydrophobicContact CD1-CD 4.43Å; F543-K547 HydrophobicContact CE1-CD 4.1Å; F543-K547 PolarHBondContact O-N 2.9Å; C544-K547 PolarHBondContact O-N 2.87Å; N545-K547 VanDerWaalsContact C-N 3.3Å; N545-K547 PolarHBondContact O-N 3.28Å; K547-V551 WeakPolarHBondContact O-CB 3.07Å; K547-V551 VanDerWaalsContact O-CG2 3.27Å; K547-V551 WeakPolarHBondContact O-CG2 3.37Å; K547-V551 PolarHBondContact O-N 3.5Å
548	G	73.1	Confident	75.9	Confident	40 Å²	40	93.8 Å²	93.8	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-59.3	-51.6	174.7	0	0	0	0	0	111.9	C544 N545 M550 V551 E552	C544-G548 PolarHBondContact O-N 3.35Å; N545-G548 WeakPolarHBondContact O-CA 3.15Å; N545-G548 PolarHBondContact O-N 3.42Å; G548-M550 PolarHBondContact O-N 2.83Å; G548-V551 PolarHBondContact O-N 2.96Å; G548-E552 PolarHBondContact O-N 3.26Å
549	D	74.4	Confident	76.4	Confident	102 Å²	102	95.2 Å²	95.2	55%	0.545	49%	0.491	S	S	.	.	H	α-helix	trans	-60.5	-45.2	179	-67.2	-21.8	0	0	0	111.8	N545 V551 E552 Q553	N545-D549 PolarHBondContact O-N 3.48Å; D549-V551 VanDerWaalsContact C-N 3.33Å; D549-V551 PolarHBondContact O-N 3.31Å; D549-E552 PolarHBondContact O-N 2.8Å; D549-Q553 WeakPolarHBondContact O-CB 3.43Å; D549-Q553 WeakPolarHBondContact O-CG 3.42Å; D549-Q553 PolarHBondContact O-N 2.61Å
550	M	73.2	Confident	76.7	Confident	85 Å²	85	96 Å²	96	42%	0.419	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-40.3	177.1	-172.4	-170.5	-62.7	0	0	111.9	F546 G548 L554	F546-M550 HydrophobicContact CD1-CE 4.25Å; F546-M550 HydrophobicContact CE1-CE 3.4Å; F546-M550 HydrophobicContact CZ-CE 3.63Å; F546-M550 WeakPolarHBondContact O-CB 3.36Å; F546-M550 PolarHBondContact O-N 3.06Å; G548-M550 PolarHBondContact O-N 2.83Å; M550-L554 HydrophobicContact CG-CD1 4.13Å; M550-L554 WeakPolarHBondContact O-CD1 3.33Å; M550-L554 PolarHBondContact O-N 3.05Å
551	V	80.3	Confident	77	Confident	79 Å²	79	96.2 Å²	96.2	48%	0.479	49%	0.491	S	S	.	.	H	α-helix	trans	-65.6	-40.3	176	165	0	0	0	0	111.2	K547 G548 D549 L554 K555	K547-V551 WeakPolarHBondContact O-CB 3.07Å; K547-V551 VanDerWaalsContact O-CG2 3.27Å; K547-V551 WeakPolarHBondContact O-CG2 3.37Å; K547-V551 PolarHBondContact O-N 3.5Å; G548-V551 PolarHBondContact O-N 2.96Å; D549-V551 VanDerWaalsContact C-N 3.33Å; D549-V551 PolarHBondContact O-N 3.31Å; V551-L554 PolarHBondContact O-N 2.74Å; V551-K555 WeakPolarHBondContact O-CG 3.41Å; V551-K555 PolarHBondContact O-N 3.46Å
552	E	79.3	Confident	77.5	Confident	76 Å²	76	100.5 Å²	100.5	36%	0.355	50%	0.501	S	S	.	.	H	α-helix	trans	-74	-32.6	178.7	-158.5	57.7	-133.6	0	0	112.6	G548 D549 K555 T556 R559	G548-E552 PolarHBondContact O-N 3.26Å; D549-E552 PolarHBondContact O-N 2.8Å; E552-K555 PolarHBondContact O-N 3.32Å; E552-K555 WeakPolarHBondContact OE2-CD 3.37Å; E552-K555 WeakPolarHBondContact OE2-CE 3.43Å; E552-K555 IonicContact OE2-NZ 2.74Å; E552-K555 PolarHBondContact OE2-NZ 2.98Å; E552-T556 WeakPolarHBondContact O-CB 3.45Å; E552-T556 PolarHBondContact O-N 3.27Å; E552-T556 PolarHBondContact O-OG1 3.43Å; E552-R559 IonicContact OE1-CZ 2.67Å; E552-R559 IonicContact OE1-NH1 3.94Å; E552-R559 PolarHBondContact OE1-NH1 3.21Å; E552-R559 IonicContact OE1-NH2 3.59Å; E552-R559 PolarHBondContact OE1-NH2 3.05Å
553	Q	78.7	Confident	77.9	Confident	136 Å²	136	104 Å²	104	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-46.2	167.9	-75	179.2	2.1	0	0	111.3	D549 T556 L557	D549-Q553 WeakPolarHBondContact O-CB 3.43Å; D549-Q553 WeakPolarHBondContact O-CG 3.42Å; D549-Q553 PolarHBondContact O-N 2.61Å; Q553-T556 PolarHBondContact O-N 2.83Å; Q553-T556 VanDerWaalsContact O-N 3.17Å; Q553-L557 PolarHBondContact O-N 2.81Å
554	L	81.4	Confident	78.3	Confident	99 Å²	99	105 Å²	105	52%	0.518	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-42.7	175	-104.9	114.3	0	0	0	112.4	M550 V551 T556 L557 L558	M550-L554 HydrophobicContact CG-CD1 4.13Å; M550-L554 WeakPolarHBondContact O-CD1 3.33Å; M550-L554 PolarHBondContact O-N 3.05Å; V551-L554 PolarHBondContact O-N 2.74Å; L554-T556 VanDerWaalsContact C-N 3.27Å; L554-T556 PolarHBondContact O-N 3.41Å; L554-L557 PolarHBondContact O-N 2.8Å; L554-L558 WeakPolarHBondContact O-CB 3.36Å; L554-L558 VanDerWaalsContact O-CG 3.25Å; L554-L558 WeakPolarHBondContact O-CG 3.48Å; L554-L558 PolarHBondContact O-N 3.5Å
555	K	84.4	Confident	77.8	Confident	97 Å²	97	109 Å²	109	42%	0.422	55%	0.546	S	S	.	.	H	α-helix	trans	-59.5	-39.8	173	-72.8	-177.7	-150.5	153.6	0	111.6	V551 E552 L558 R559	V551-K555 WeakPolarHBondContact O-CG 3.41Å; V551-K555 PolarHBondContact O-N 3.46Å; E552-K555 PolarHBondContact O-N 3.32Å; E552-K555 WeakPolarHBondContact OE2-CD 3.37Å; E552-K555 WeakPolarHBondContact OE2-CE 3.43Å; E552-K555 IonicContact OE2-NZ 2.74Å; E552-K555 PolarHBondContact OE2-NZ 2.98Å; K555-L558 PolarHBondContact O-N 3.01Å; K555-R559 WeakPolarHBondContact O-CG 3.39Å; K555-R559 PolarHBondContact O-N 2.96Å
556	T	85.8	Confident	78.1	Confident	73 Å²	73	109.1 Å²	109.1	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-68.5	-41.5	179.6	-55	0	0	0	0	111.7	E552 Q553 L554 R559 Y560	E552-T556 WeakPolarHBondContact O-CB 3.45Å; E552-T556 PolarHBondContact O-N 3.27Å; E552-T556 PolarHBondContact O-OG1 3.43Å; Q553-T556 PolarHBondContact O-N 2.83Å; Q553-T556 VanDerWaalsContact O-N 3.17Å; L554-T556 VanDerWaalsContact C-N 3.27Å; L554-T556 PolarHBondContact O-N 3.41Å; T556-R559 PolarHBondContact O-N 2.96Å; T556-R559 PolarHBondContact OG1-NH2 2.81Å; T556-Y560 PolarHBondContact O-N 2.79Å
557	L	83.1	Confident	78.4	Confident	94 Å²	94	108.6 Å²	108.6	49%	0.492	55%	0.546	S	S	.	.	H	α-helix	trans	-62.1	-42.7	171.9	-165.4	80.6	0	0	0	111.6	Q553 L554 Y560 M561	Q553-L557 PolarHBondContact O-N 2.81Å; L554-L557 PolarHBondContact O-N 2.8Å; L557-Y560 PolarHBondContact O-N 2.92Å; L557-M561 WeakPolarHBondContact O-CB 3.34Å; L557-M561 VanDerWaalsContact O-CG 3.23Å; L557-M561 WeakPolarHBondContact O-CG 3.31Å; L557-M561 PolarHBondContact O-N 2.72Å
558	L	84.1	Confident	79	Confident	106 Å²	106	108.2 Å²	108.2	56%	0.555	55%	0.548	S	S	*	.	H	α-helix	trans	-68.5	-30.3	177.3	-72.1	170	0	0	0	113.3	L554 K555 R562	L554-L558 WeakPolarHBondContact O-CB 3.36Å; L554-L558 VanDerWaalsContact O-CG 3.25Å; L554-L558 WeakPolarHBondContact O-CG 3.48Å; L554-L558 PolarHBondContact O-N 3.5Å; K555-L558 PolarHBondContact O-N 3.01Å; L558-R562 WeakPolarHBondContact O-CB 3.46Å; L558-R562 PolarHBondContact O-N 3.23Å
559	R	84.2	Confident	79.3	Confident	112 Å²	112	112.2 Å²	112.2	42%	0.423	56%	0.556	S	S	.	*	H	α-helix	trans	-65.6	-53.5	169	-76.4	-180	-71.8	-120.3	-0.5	110	E552 K555 T556 M561 R562 D563	E552-R559 IonicContact OE1-CZ 2.67Å; E552-R559 IonicContact OE1-NH1 3.94Å; E552-R559 PolarHBondContact OE1-NH1 3.21Å; E552-R559 IonicContact OE1-NH2 3.59Å; E552-R559 PolarHBondContact OE1-NH2 3.05Å; K555-R559 WeakPolarHBondContact O-CG 3.39Å; K555-R559 PolarHBondContact O-N 2.96Å; T556-R559 PolarHBondContact O-N 2.96Å; T556-R559 PolarHBondContact OG1-NH2 2.81Å; R559-M561 VanDerWaalsContact C-N 3.34Å; R559-M561 PolarHBondContact O-N 3.1Å; R559-R562 WeakPolarHBondContact O-CA 3.33Å; R559-R562 WeakPolarHBondContact O-CB 3.42Å; R559-R562 PolarHBondContact O-N 2.91Å; R559-D563 PolarHBondContact O-N 3.31Å
560	Y	81.8	Confident	79.6	Confident	136 Å²	136	112.9 Å²	112.9	53%	0.533	56%	0.557	S	S	.	*	H	α-helix	trans	-56.7	-43.9	177.6	-178.4	-92.8	0	0	0	113.3	T556 L557 R562 D563 Q564	T556-Y560 PolarHBondContact O-N 2.79Å; L557-Y560 PolarHBondContact O-N 2.92Å; Y560-R562 PolarHBondContact O-N 3.33Å; Y560-D563 PolarHBondContact O-N 2.88Å; Y560-Q564 HydrophobicContact CD1-CG 4.04Å; Y560-Q564 HydrophobicContact CE1-CG 3.65Å; Y560-Q564 HydrophobicContact CE2-CG 4.46Å; Y560-Q564 WeakPolarHBondContact O-CB 3.25Å; Y560-Q564 WeakPolarHBondContact O-CG 3.38Å; Y560-Q564 PolarHBondContact O-N 3.26Å; Y560-Q564 PolarHBondContact OH-NE2 2.62Å
561	M	76.5	Confident	80.1	Confident	120 Å²	120	114.7 Å²	114.7	59%	0.591	57%	0.566	S	S	*	*	H	α-helix	trans	-63.6	-27.2	176.1	-73.5	-70.6	-60.4	0	0	113.3	L557 R559 S565	L557-M561 WeakPolarHBondContact O-CB 3.34Å; L557-M561 VanDerWaalsContact O-CG 3.23Å; L557-M561 WeakPolarHBondContact O-CG 3.31Å; L557-M561 PolarHBondContact O-N 2.72Å; R559-M561 VanDerWaalsContact C-N 3.34Å; R559-M561 PolarHBondContact O-N 3.1Å; M561-S565 PolarHBondContact O-OG 2.68Å
562	R	82.8	Confident	80.1	Confident	178 Å²	178	117.3 Å²	117.3	67%	0.672	57%	0.572	S	S	*	*	H	α-helix	trans	-82	-33.7	175.2	-179.6	-177.9	-62.7	164.2	1.5	112.2	L558 R559 Y560 Q564 S565	L558-R562 WeakPolarHBondContact O-CB 3.46Å; L558-R562 PolarHBondContact O-N 3.23Å; R559-R562 WeakPolarHBondContact O-CA 3.33Å; R559-R562 WeakPolarHBondContact O-CB 3.42Å; R559-R562 PolarHBondContact O-N 2.91Å; Y560-R562 PolarHBondContact O-N 3.33Å; R562-Q564 PolarHBondContact O-N 3.02Å; R562-S565 PolarHBondContact O-N 3.24Å; R562-S565 PolarHBondContact O-OG 3.03Å
563	D	81.7	Confident	80.1	Confident	134 Å²	134	120.5 Å²	120.5	72%	0.717	59%	0.589	S	S	*	*	H	α-helix	trans	-76.6	-15.2	176.9	-57.7	-25.7	0	0	0	111.9	R559 Y560	R559-D563 PolarHBondContact O-N 3.31Å; Y560-D563 PolarHBondContact O-N 2.88Å
564	Q	77.8	Confident	80.2	Confident	136 Å²	136	119.2 Å²	119.2	64%	0.636	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-11.7	172.5	-71.3	-91.3	-61	0	0	114	Y560 R562	Y560-Q564 HydrophobicContact CD1-CG 4.04Å; Y560-Q564 HydrophobicContact CE1-CG 3.65Å; Y560-Q564 HydrophobicContact CE2-CG 4.46Å; Y560-Q564 WeakPolarHBondContact O-CB 3.25Å; Y560-Q564 WeakPolarHBondContact O-CG 3.38Å; Y560-Q564 PolarHBondContact O-N 3.26Å; Y560-Q564 PolarHBondContact OH-NE2 2.62Å; R562-Q564 PolarHBondContact O-N 3.02Å
565	S	59.4	Low	80.1	Confident	145 Å²	145	121 Å²	121	100%	1.014	59%	0.591	S	S	*	*			trans	-109.3	0	-174	68.3	0	0	0	0	112.9	M561 R562	M561-S565 PolarHBondContact O-OG 2.68Å; R562-S565 PolarHBondContact O-N 3.24Å; R562-S565 PolarHBondContact O-OG 3.03Å

Retrieved 565 of 565 residues in 447.9 ms (Link to these results)

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