A0A3Q0KQK0_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A3Q0KQK0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 640 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.6	Very low	33.9	Very low	251 Å²	251	148.3 Å²	148.3	100%	1.236	88%	0.878	S	S	*	*				0	147	0	-62.7	171.9	-175.7	0	0	107.7
2	S	27.3	Very low	34	Very low	106 Å²	106	142.6 Å²	142.6	74%	0.741	87%	0.874	S	S	*	*			trans	-98.7	136.4	177.7	-172.5	0	0	0	0	110.5
3	L	36	Very low	34.3	Very low	172 Å²	172	141.7 Å²	141.7	90%	0.901	88%	0.877	S	S	*	*			trans	-141.7	95.8	170.3	-106.8	167.1	0	0	0	108.7
4	T	29.5	Very low	34.4	Very low	128 Å²	128	136.3 Å²	136.3	79%	0.785	86%	0.863	S	S	*	*			trans	-101.4	119.2	176	48.3	0	0	0	0	110.3
5	S	37.8	Very low	34.7	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	86%	0.857	S	S	*	*			trans	-146.9	100.7	168.8	62.1	0	0	0	0	114
6	R	35	Very low	34.9	Very low	250 Å²	250	135.6 Å²	135.6	94%	0.943	85%	0.848	S	S	*	*			trans	66.8	127.7	145.5	-59.7	-177.8	179.3	178.2	-0.2	119.6
7	I	29.8	Very low	35.2	Very low	166 Å²	166	137.3 Å²	137.3	85%	0.851	84%	0.843	S	S	*	*			trans	-92.8	136.3	163.8	-63.9	162.5	0	0	0	108.5
8	T	39.8	Very low	35.3	Very low	139 Å²	139	137.4 Å²	137.4	85%	0.853	84%	0.838	S	S	*	*			trans	-143	124.4	152	46.8	0	0	0	0	107.9
9	G	31.7	Very low	35.4	Very low	81 Å²	81	136.8 Å²	136.8	84%	0.835	83%	0.834	S	S	*	*			trans	-90.5	159.2	-176.3	0	0	0	0	0	114
10	G	34.9	Very low	35.6	Very low	84 Å²	84	137.4 Å²	137.4	87%	0.866	84%	0.837	S	S	*	*			trans	-166.9	109.8	176.8	0	0	0	0	0	112
11	T	37.3	Very low	35.6	Very low	151 Å²	151	138.2 Å²	138.2	93%	0.926	84%	0.837	S	S	*	*			trans	-59	149.5	-179.9	49.2	0	0	0	0	115.5
12	G	35.9	Very low	36.2	Very low	80 Å²	80	131.7 Å²	131.7	83%	0.825	81%	0.814	S	S	*	*			trans	163.6	89.6	158.1	0	0	0	0	0	119.3
13	S	37.7	Very low	36.7	Very low	131 Å²	131	130.8 Å²	130.8	92%	0.916	81%	0.812	S	S	*	*			trans	-24.8	156.3	166	-157.4	0	0	0	0	122
14	G	36	Very low	37.1	Very low	66 Å²	66	127.9 Å²	127.9	68%	0.68	80%	0.804	S	S	*	*			trans	110	118.1	160.2	0	0	0	0	0	115.2
15	V	37.7	Very low	37.4	Very low	128 Å²	128	131.2 Å²	131.2	78%	0.776	81%	0.807	S	S	*	*			cis	115.3	132.2	14.9	172.6	0	0	0	0	112.6
16	N	38.3	Very low	37.5	Very low	133 Å²	133	134.7 Å²	134.7	71%	0.711	82%	0.817	S	S	*	*			trans	85.4	95.3	168.3	-68.5	-9.8	0	0	0	123
17	H	39.3	Very low	37.7	Very low	165 Å²	165	128.3 Å²	128.3	76%	0.764	81%	0.811	S	S	*	*				67.2	148.8	112.6	-78.4	-71.2	0	0	0	125.9
18	N	37.3	Very low	38.3	Very low	140 Å²	140	123.7 Å²	123.7	75%	0.749	80%	0.804	S	S	*	*			trans	74.1	122.4	166.3	-60.3	-12.4	0	0	0	117.3
19	V	36.8	Very low	38.3	Very low	126 Å²	126	124.1 Å²	124.1	76%	0.764	80%	0.801	S	S	*	*			cis	86.8	101.5	34.8	-179.6	0	0	0	0	114.1
20	T	40.4	Very low	38.7	Very low	147 Å²	147	127.8 Å²	127.8	90%	0.902	80%	0.801	S	S	*	*			trans	-166.8	163.6	134.3	23.9	0	0	0	0	111.7
21	N	36	Very low	38.9	Very low	155 Å²	155	129.4 Å²	129.4	83%	0.829	80%	0.796	S	S	*	*			trans	-122.3	-179.8	-177.7	-126.5	-14.1	0	0	0	108
22	P	45.4	Very low	39.2	Very low	115 Å²	115	128.1 Å²	128.1	75%	0.747	79%	0.79	S	S	*	*			cis	-134.1	-156.8	-21	39.5	-18.9	0	0	0	113
23	A	37.8	Very low	39.4	Very low	86 Å²	86	130.3 Å²	130.3	71%	0.711	79%	0.788	S	S	*	*			trans	-81.3	-174.8	176.7	0	0	0	0	0	113.6
24	P	43.9	Very low	39.5	Very low	112 Å²	112	133.1 Å²	133.1	73%	0.727	79%	0.787	S	S	*	*			cis	-156.8	175.1	47.1	44.9	-22.5	0	0	0	121.2
25	K	37.2	Very low	39.4	Very low	197 Å²	197	137.5 Å²	137.5	86%	0.857	79%	0.794	S	S	*	*			trans	52.5	131.3	144.8	-75.3	174.6	178.7	-179.1	0	123.6
26	L	40.1	Very low	39.8	Very low	176 Å²	176	137.6 Å²	137.6	92%	0.921	80%	0.797	S	S	*	*			trans	-163.1	175.9	131.2	-108.9	164.2	0	0	0	111.5
27	S	39.1	Very low	39.6	Very low	116 Å²	116	135.9 Å²	135.9	81%	0.811	80%	0.802	S	S	*	*			trans	-150.3	154.1	-157.7	56.4	0	0	0	0	116.7
28	G	41.5	Very low	39.7	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	80%	0.802	S	S	*	*			trans	-179.8	117.3	164.5	0	0	0	0	0	118.9
29	N	40.7	Very low	39.8	Very low	148 Å²	148	133.3 Å²	133.3	79%	0.791	81%	0.805	S	S	*	*			trans	25.9	124.4	139.4	-59.9	-3.1	0	0	0	121.2
30	L	40.2	Very low	39.6	Very low	158 Å²	158	133 Å²	133	83%	0.827	80%	0.803	S	S	*	*				77	152.5	69.7	-72.6	166.4	0	0	0	115
31	P	38.5	Very low	39.4	Very low	119 Å²	119	132.3 Å²	132.3	77%	0.773	79%	0.794	S	S	*	*			cis	-133.5	-162.9	-19.6	40.7	-19.3	0	0	0	113.5
32	P	43.1	Very low	39.5	Very low	123 Å²	123	132.5 Å²	132.5	80%	0.799	79%	0.789	S	S	*	*			trans	-121.4	176.5	-163.3	44.3	-35	0	0	0	119.6
33	T	40.6	Very low	38.8	Very low	127 Å²	127	132.2 Å²	132.2	78%	0.779	79%	0.79	S	S	*	*			trans	-146	119.3	170.2	51.2	0	0	0	0	110.6
34	Q	39.9	Very low	38.8	Very low	190 Å²	190	134 Å²	134	89%	0.888	80%	0.797	S	S	*	*				78.2	126.3	85	-78.4	-169.3	-18.5	0	0	117.5
35	D	34.5	Very low	38.1	Very low	157 Å²	157	134 Å²	134	84%	0.84	80%	0.8	S	S	*	*			trans	-79.5	173.1	178.1	-49.1	-86.5	0	0	0	114
36	P	44.5	Very low	38.1	Very low	130 Å²	130	131.7 Å²	131.7	84%	0.844	80%	0.802	S	S	*	*				-148	170.1	94.4	39.7	-23.9	0	0	0	116.3
37	A	34.9	Very low	37.6	Very low	97 Å²	97	134.6 Å²	134.6	80%	0.802	80%	0.801	S	S	*	*			trans	-120.2	159.3	174.5	0	0	0	0	0	112.7
38	P	42.2	Very low	37.1	Very low	119 Å²	119	134.8 Å²	134.8	77%	0.773	80%	0.801	S	S	*	*			trans	-139.8	127.4	155.8	35.5	-18.9	0	0	0	117.1
39	V	38.8	Very low	36.9	Very low	132 Å²	132	136.8 Å²	136.8	80%	0.8	80%	0.804	S	S	*	*			trans	41.3	99.9	132.1	-165	0	0	0	0	121.5
40	V	33.3	Very low	36.9	Very low	120 Å²	120	133.8 Å²	133.8	73%	0.727	80%	0.795	S	S	*	*				28	121.4	123.1	-169.8	0	0	0	0	120.4
41	N	35.3	Very low	36.9	Very low	133 Å²	133	128.8 Å²	128.8	71%	0.711	78%	0.781	S	S	*	*				-168.7	142.1	119.5	-108.4	-22	0	0	0	118.7
42	H	37.8	Very low	37.4	Very low	158 Å²	158	126.4 Å²	126.4	73%	0.731	77%	0.772	S	S	*	*			trans	42.4	104.5	153	-69.6	-61.2	0	0	0	124.7
43	S	31.2	Very low	37.4	Very low	109 Å²	109	126.5 Å²	126.5	76%	0.762	77%	0.765	S	S	*	*				56	115.7	125	65.5	0	0	0	0	123
44	S	36.6	Very low	37.4	Very low	124 Å²	124	126 Å²	126	87%	0.867	76%	0.755	S	S	*	*			trans	-152.5	161.2	131.2	61.9	0	0	0	0	109.8
45	S	30.8	Very low	37.7	Very low	113 Å²	113	120.5 Å²	120.5	79%	0.79	74%	0.738	S	S	*	*			trans	-101.4	139.3	-173.6	73.5	0	0	0	0	113.5
46	T	36.1	Very low	38.1	Very low	147 Å²	147	117.5 Å²	117.5	90%	0.902	72%	0.721	S	S	*	*			trans	-149.5	150.4	151.6	5.9	0	0	0	0	111.8
47	R	29.9	Very low	38.2	Very low	237 Å²	237	116.6 Å²	116.6	89%	0.894	71%	0.708	S	S	*	*			trans	-80.6	146.8	176.9	-61.7	164.8	171.3	163	-6	110.3
48	C	29.1	Very low	38.6	Very low	120 Å²	120	118.9 Å²	118.9	81%	0.811	71%	0.707	S	S	*	*				153.5	113.2	122.9	-84	0	0	0	0	113.4
49	S	36	Very low	38.9	Very low	111 Å²	111	116.3 Å²	116.3	78%	0.776	69%	0.692	S	S	*	*			trans	-148.6	15.8	162.5	58	0	0	0	0	113.9	G51	S49-G51 VanDerWaalsContact C-N 3.27Å; S49-G51 PolarHBondContact O-N 3.15Å
50	S	42.4	Very low	39.2	Very low	86 Å²	86	113.6 Å²	113.6	60%	0.601	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-18.3	178.8	47.6	0	0	0	0	114.6	A52 L53 M54	S50-A52 VanDerWaalsContact C-N 3.35Å; S50-A52 PolarHBondContact O-N 2.78Å; S50-L53 PolarHBondContact O-N 2.83Å; S50-M54 PolarHBondContact O-N 2.94Å
51	G	40	Very low	40	Very low	52 Å²	52	113.3 Å²	113.3	54%	0.536	68%	0.684	S	S	.	*	H	α-helix	trans	-63.4	-33.6	-176.4	0	0	0	0	0	114.7	S49 L53 M54 S55	S49-G51 VanDerWaalsContact C-N 3.27Å; S49-G51 PolarHBondContact O-N 3.15Å; G51-L53 VanDerWaalsContact C-N 3.32Å; G51-L53 PolarHBondContact O-N 2.92Å; G51-M54 PolarHBondContact O-N 3.31Å; G51-S55 PolarHBondContact O-N 3.33Å; G51-S55 VanDerWaalsContact O-N 3.11Å
52	A	48.5	Very low	41.2	Very low	69 Å²	69	112.1 Å²	112.1	57%	0.57	69%	0.686	S	S	*	*	H	α-helix	trans	-71.1	-24.7	-177.9	0	0	0	0	0	113.7	S50 S55	S50-A52 VanDerWaalsContact C-N 3.35Å; S50-A52 PolarHBondContact O-N 2.78Å; A52-S55 PolarHBondContact O-OG 3.49Å
53	L	42.3	Very low	42.4	Very low	125 Å²	125	110 Å²	110	65%	0.654	68%	0.684	S	S	*	*	H	α-helix	trans	-80	-35.2	172	-88.1	162.5	0	0	0	111.7	S50 G51 L56 L57	S50-L53 PolarHBondContact O-N 2.83Å; G51-L53 VanDerWaalsContact C-N 3.32Å; G51-L53 PolarHBondContact O-N 2.92Å; L53-L56 PolarHBondContact O-N 3.25Å; L53-L57 PolarHBondContact O-N 2.78Å
54	M	42	Very low	44.4	Very low	118 Å²	118	108 Å²	108	58%	0.581	67%	0.669	S	S	*	*	H	α-helix	trans	-70	-31.9	177.9	-69.9	-66.7	-80.7	0	0	112.9	S50 G51 L56 L57 N58	S50-M54 PolarHBondContact O-N 2.94Å; G51-M54 PolarHBondContact O-N 3.31Å; M54-L56 VanDerWaalsContact C-N 3.33Å; M54-L56 PolarHBondContact O-N 3.1Å; M54-L57 PolarHBondContact O-N 2.96Å; M54-L57 HydrophobicContact SD-CD1 4.02Å; M54-N58 PolarHBondContact O-N 3.28Å
55	S	45.7	Very low	46.8	Very low	74 Å²	74	109 Å²	109	52%	0.517	65%	0.653	S	S	.	*	H	α-helix	trans	-69.4	-28.9	174.7	60.7	0	0	0	0	113.4	G51 A52 S59	G51-S55 PolarHBondContact O-N 3.33Å; G51-S55 VanDerWaalsContact O-N 3.11Å; A52-S55 PolarHBondContact O-OG 3.49Å; S55-S59 PolarHBondContact O-N 3.47Å; S55-S59 PolarHBondContact O-OG 3.09Å
56	L	43.5	Very low	49.6	Very low	94 Å²	94	109.5 Å²	109.5	49%	0.492	64%	0.643	S	S	.	*	H	α-helix	trans	-71.5	-38.8	172.5	-68.9	171.5	0	0	0	111.8	L53 M54 S59 L61	L53-L56 PolarHBondContact O-N 3.25Å; M54-L56 VanDerWaalsContact C-N 3.33Å; M54-L56 PolarHBondContact O-N 3.1Å; L56-S59 WeakPolarHBondContact CA-OG 3.45Å; L56-S59 PolarHBondContact O-N 3.03Å; L56-S59 PolarHBondContact O-OG 2.99Å; L56-S59 VanDerWaalsContact O-OG 3.07Å; L56-L61 HydrophobicContact CD2-CD1 4.39Å
57	L	44.8	Very low	52.2	Low	110 Å²	110	104.2 Å²	104.2	58%	0.576	61%	0.609	S	S	*	*	H	α-helix	trans	-66.3	-40.4	175.1	-67.9	168.3	0	0	0	112	L53 M54 S59	L53-L57 PolarHBondContact O-N 2.78Å; M54-L57 PolarHBondContact O-N 2.96Å; M54-L57 HydrophobicContact SD-CD1 4.02Å; L57-S59 VanDerWaalsContact C-N 3.28Å; L57-S59 PolarHBondContact O-N 2.56Å
58	N	45.1	Very low	55.2	Low	146 Å²	146	99 Å²	99	78%	0.781	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-7.2	178.3	-85.8	18.7	0	0	0	115.1	M54	M54-N58 PolarHBondContact O-N 3.28Å
59	S	48.3	Very low	58.3	Low	65 Å²	65	94 Å²	94	46%	0.455	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.9	7.6	-179.3	42.5	0	0	0	0	114.2	S55 L56 L57 L61	S55-S59 PolarHBondContact O-N 3.47Å; S55-S59 PolarHBondContact O-OG 3.09Å; L56-S59 WeakPolarHBondContact CA-OG 3.45Å; L56-S59 PolarHBondContact O-N 3.03Å; L56-S59 PolarHBondContact O-OG 2.99Å; L56-S59 VanDerWaalsContact O-OG 3.07Å; L57-S59 VanDerWaalsContact C-N 3.28Å; L57-S59 PolarHBondContact O-N 2.56Å; S59-L61 PolarHBondContact O-N 3.3Å; S59-L61 VanDerWaalsContact O-N 3.11Å
60	G	44.5	Very low	61.2	Low	74 Å²	74	92.3 Å²	92.3	76%	0.763	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	7.4	176.3	0	0	0	0	0	114.6	S62	G60-S62 PolarHBondContact O-N 3.01Å
61	L	50.6	Low	63.8	Low	114 Å²	114	88.2 Å²	88.2	60%	0.597	51%	0.513	S	S	*	.			trans	-74.8	112.8	177.4	-67	172	0	0	0	109.1	L56 S59 V63	L56-L61 HydrophobicContact CD2-CD1 4.39Å; S59-L61 PolarHBondContact O-N 3.3Å; S59-L61 VanDerWaalsContact O-N 3.11Å; L61-V63 PolarHBondContact O-N 2.98Å
62	S	60.4	Low	66.5	Low	108 Å²	108	87.5 Å²	87.5	76%	0.755	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-59.3	120.9	171.9	47.5	0	0	0	0	109.9	G60 P64	G60-S62 PolarHBondContact O-N 3.01Å; S62-P64 WeakPolarHBondContact O-CD 3.3Å
63	V	62.2	Low	68.7	Low	114 Å²	114	84.6 Å²	84.6	69%	0.691	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-56.4	125.3	175.4	179.7	0	0	0	0	108.4	L61 R65	L61-V63 PolarHBondContact O-N 2.98Å; V63-R65 PolarHBondContact O-N 2.86Å
64	P	72.9	Confident	71.1	Confident	66 Å²	66	78.8 Å²	78.8	43%	0.429	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-52.5	127.3	179.6	-30.1	36.8	0	0	0	111.3	S62 Q66 F86	S62-P64 WeakPolarHBondContact O-CD 3.3Å; P64-Q66 PolarHBondContact O-N 3.1Å; P64-F86 WeakPolarHBondContact CA-O 3.28Å; P64-F86 WeakPolarHBondContact CB-O 3.07Å
65	R	87.6	Confident	73.4	Confident	145 Å²	145	76 Å²	76	55%	0.547	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	106.3	179.8	176.1	-170.9	180	-156.5	1.7	108.5	V63 M67 F86	V63-R65 PolarHBondContact O-N 2.86Å; R65-M67 VanDerWaalsContact CZ-CE 3.45Å; R65-F86 HydrophobicContact CB-CB 4.2Å; R65-F86 PolarHBondContact N-O 3.17Å; R65-F86 WeakPolarHBondContact O-CB 3.27Å; R65-F86 WeakPolarHBondContact O-CD2 3.36Å; R65-F86 PolarHBondContact O-N 3.31Å
66	Q	90	Very high	75.6	Confident	125 Å²	125	76 Å²	76	58%	0.584	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	142.2	176.6	-74.3	176.8	-5.7	0	0	111.1	P64 L84 S85	P64-Q66 PolarHBondContact O-N 3.1Å; Q66-L84 WeakPolarHBondContact CA-O 3.29Å; Q66-S85 WeakPolarHBondContact CG-OG 3.15Å; Q66-S85 PolarHBondContact NE2-OG 2.73Å
67	M	91.3	Very high	77.9	Confident	35 Å²	35	73.4 Å²	73.4	17%	0.172	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	147.5	169.7	62.7	174.9	67.1	0	0	111	R65 V69 H83 L84 F86	R65-M67 VanDerWaalsContact CZ-CE 3.45Å; M67-V69 HydrophobicContact CG-CG1 4.16Å; M67-V69 HydrophobicContact SD-CG1 3.7Å; M67-H83 WeakPolarHBondContact O-CA 3.36Å; M67-H83 PolarHBondContact O-CD2 3.49Å; M67-H83 VanDerWaalsContact O-CD2 3.3Å; M67-L84 HydrophobicContact CG-CB 4.11Å; M67-L84 PolarHBondContact N-O 2.95Å; M67-L84 PolarHBondContact O-N 3.18Å; M67-F86 HydrophobicContact CE-CD2 4.37Å; M67-F86 HydrophobicContact CE-CE2 3.75Å; M67-F86 HydrophobicContact CE-CZ 4.25Å; M67-F86 HydrophobicContact CG-CD2 4.47Å; M67-F86 HydrophobicContact CG-CE2 3.85Å; M67-F86 HydrophobicContact SD-CE2 3.74Å; M67-F86 HydrophobicContact SD-CZ 4.25Å
68	M	92.8	Very high	80.2	Confident	128 Å²	128	74.1 Å²	74.1	63%	0.631	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.7	161.3	-170.3	178.4	-66.8	0	0	107.9	I82	M68-I82 WeakPolarHBondContact CA-O 3.27Å
69	V	93.9	Very high	82.6	Confident	14 Å²	14	72.2 Å²	72.2	9%	0.085	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	143.2	179.4	-64.7	0	0	0	0	110.5	M67 A71 I82 L84 Y167	M67-V69 HydrophobicContact CG-CG1 4.16Å; M67-V69 HydrophobicContact SD-CG1 3.7Å; V69-A71 PolarHBondContact O-N 3.32Å; V69-I82 HydrophobicContact CG2-CD1 4.06Å; V69-I82 HydrophobicContact CG2-CG1 3.57Å; V69-I82 PolarHBondContact N-O 2.88Å; V69-I82 PolarHBondContact O-N 2.86Å; V69-L84 HydrophobicContact CG2-CD1 4.35Å; V69-Y167 HydrophobicContact CB-CD2 4.25Å; V69-Y167 HydrophobicContact CB-CG 4.36Å; V69-Y167 HydrophobicContact CG1-CD2 4.26Å; V69-Y167 HydrophobicContact CG1-CE2 4.15Å; V69-Y167 HydrophobicContact CG2-CD1 3.82Å; V69-Y167 HydrophobicContact CG2-CD2 4.14Å; V69-Y167 HydrophobicContact CG2-CE1 3.98Å; V69-Y167 HydrophobicContact CG2-CE2 4.28Å; V69-Y167 HydrophobicContact CG2-CG 3.91Å
70	Q	95.5	Very high	84.8	Confident	77 Å²	77	71 Å²	71	36%	0.36	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	97.5	169.2	-162	68.9	11.1	0	0	108.7	H79 W455	Q70-H79 HydrophobicContact CG-CB 4.39Å; Q70-W455 HydrophobicContact CB-CZ2 4.06Å
71	A	96.9	Very high	87.2	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	178.1	176.4	0	0	0	0	0	111.5	V69 H79 I80 I82 Y166 Y167	V69-A71 PolarHBondContact O-N 3.32Å; A71-H79 CarbonylContact O-C 3.49Å; A71-H79 WeakPolarHBondContact O-CA 3.26Å; A71-I80 HydrophobicContact CB-CG2 4.49Å; A71-I80 PolarHBondContact N-O 3.37Å; A71-I80 PolarHBondContact O-N 3.13Å; A71-I82 HydrophobicContact CB-CD1 3.6Å; A71-I82 HydrophobicContact CB-CG1 3.8Å; A71-I82 HydrophobicContact CB-CG2 4.4Å; A71-Y166 CarbonylContact C-O 3.57Å; A71-Y166 WeakPolarHBondContact CA-O 3.33Å; A71-Y166 WeakPolarHBondContact CB-O 3.45Å; A71-Y167 HydrophobicContact CB-CD1 4.47Å
72	R	96.8	Very high	89.3	Confident	37 Å²	37	64 Å²	64	14%	0.14	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.4	168.3	-71.2	179.9	174.1	-178	-6	109.7	Q78 H79 Y165 Y166 D445	R72-Q78 CarbonylContact C-O 3.58Å; R72-Q78 VanDerWaalsContact CA-O 3.27Å; R72-Q78 WeakPolarHBondContact CA-O 3.43Å; R72-H79 PolarHBondContact NE-CE1 3.48Å; R72-H79 VanDerWaalsContact NE-CE1 3.3Å; R72-H79 PolarHBondContact NE-NE2 2.93Å; R72-H79 PolarHBondContact NH2-NE2 3.27Å; R72-Y165 CarbonylContact O-C 3.58Å; R72-Y165 VanDerWaalsContact O-CA 3.26Å; R72-Y165 WeakPolarHBondContact O-CA 3.37Å; R72-Y166 HydrophobicContact CB-CD1 4.13Å; R72-Y166 HydrophobicContact CB-CE1 3.66Å; R72-Y166 HydrophobicContact CB-CE2 4.2Å; R72-Y166 VanDerWaalsContact CD-OH 3.26Å; R72-Y166 WeakPolarHBondContact CD-OH 3.39Å; R72-Y166 PolarHBondContact N-O 3.48Å; R72-Y166 PolarHBondContact O-N 3.46Å; R72-D445 IonicContact NH2-OD2 2.74Å
73	G	95.4	Very high	91	Very high	7 Å²	7	61.1 Å²	61.1	7%	0.072	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	138	170	0	0	0	0	0	111.3	Q75 D76 N77 Q78	G73-Q75 VanDerWaalsContact C-N 3.27Å; G73-Q75 PolarHBondContact O-N 3.11Å; G73-D76 WeakPolarHBondContact CA-OD1 3.19Å; G73-N77 VanDerWaalsContact O-CA 3.26Å; G73-N77 WeakPolarHBondContact O-CA 3.37Å; G73-N77 PolarHBondContact O-N 2.91Å; G73-N77 VanDerWaalsContact O-N 3.14Å; G73-Q78 PolarHBondContact N-O 2.86Å
74	A	93.8	Very high	92.6	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.033	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.1	-176.2	0	0	0	0	0	113.2	Q152 F163 Y164	A74-Q152 VanDerWaalsContact O-CG 3.29Å; A74-Q152 WeakPolarHBondContact O-CG 3.26Å; A74-Q152 PolarHBondContact O-NE2 3.42Å; A74-F163 HydrophobicContact CB-CB 4.42Å; A74-F163 HydrophobicContact CB-CD1 3.57Å; A74-F163 HydrophobicContact CB-CD2 4.13Å; A74-F163 HydrophobicContact CB-CE1 3.74Å; A74-F163 HydrophobicContact CB-CE2 4.3Å; A74-F163 HydrophobicContact CB-CG 3.77Å; A74-F163 HydrophobicContact CB-CZ 4.1Å; A74-F163 WeakPolarHBondContact CB-O 3.35Å; A74-Y164 VanDerWaalsContact CB-O 3.28Å; A74-Y164 WeakPolarHBondContact CB-O 3.43Å; A74-Y164 PolarHBondContact N-O 3.12Å
75	Q	89.5	Confident	93.6	Very high	58 Å²	58	53.4 Å²	53.4	27%	0.271	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-60.2	179.5	-68.4	-51.6	-29.3	0	0	113.7	G73 N77 Q152 N155 N438	G73-Q75 VanDerWaalsContact C-N 3.27Å; G73-Q75 PolarHBondContact O-N 3.11Å; Q75-N77 PolarHBondContact O-N 3.05Å; Q75-N77 PolarHBondContact O-ND2 3.2Å; Q75-N77 VanDerWaalsContact O-ND2 3.08Å; Q75-Q152 PolarHBondContact NE2-O 3.24Å; Q75-N155 PolarHBondContact NE2-ND2 2.94Å; Q75-N438 VanDerWaalsContact CD-CG 3.41Å; Q75-N438 PolarHBondContact NE2-ND2 2.91Å; Q75-N438 VanDerWaalsContact OE1-CB 3.28Å; Q75-N438 PolarHBondContact OE1-ND2 3.46Å; Q75-N438 PolarHBondContact OE1-OD1 2.96Å
76	D	91	Very high	94	Very high	76 Å²	76	46.9 Å²	46.9	41%	0.406	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.5	-171.5	60.5	16	0	0	0	113.7	G73 Q78	G73-D76 WeakPolarHBondContact CA-OD1 3.19Å; D76-Q78 HydrophobicContact CB-CG 3.81Å; D76-Q78 PolarHBondContact O-N 3.08Å; D76-Q78 PolarHBondContact O-NE2 3.02Å; D76-Q78 VanDerWaalsContact O-NE2 3.1Å; D76-Q78 PolarHBondContact OD1-N 3.29Å
77	N	92.6	Very high	94	Very high	39 Å²	39	44.4 Å²	44.4	21%	0.209	23%	0.226	C	C	.	.			trans	53.7	15.9	-172.5	-63.1	-89.2	0	0	0	114	G73 Q75 Q152 Y166	G73-N77 VanDerWaalsContact O-CA 3.26Å; G73-N77 WeakPolarHBondContact O-CA 3.37Å; G73-N77 PolarHBondContact O-N 2.91Å; G73-N77 VanDerWaalsContact O-N 3.14Å; Q75-N77 PolarHBondContact O-N 3.05Å; Q75-N77 PolarHBondContact O-ND2 3.2Å; Q75-N77 VanDerWaalsContact O-ND2 3.08Å; N77-Q152 PolarHBondContact ND2-NE2 3.32Å; N77-Q152 PolarHBondContact OD1-NE2 3.14Å; N77-Y166 PolarHBondContact OD1-OH 3.12Å
78	Q	93.8	Very high	93.9	Very high	125 Å²	125	44 Å²	44	58%	0.584	23%	0.231	S	C	*	.			trans	-71.7	136.5	-175.9	-65.5	-54.5	-55.8	0	0	110.7	R72 G73 D76 I80	R72-Q78 CarbonylContact C-O 3.58Å; R72-Q78 VanDerWaalsContact CA-O 3.27Å; R72-Q78 WeakPolarHBondContact CA-O 3.43Å; G73-Q78 PolarHBondContact N-O 2.86Å; D76-Q78 HydrophobicContact CB-CG 3.81Å; D76-Q78 PolarHBondContact O-N 3.08Å; D76-Q78 PolarHBondContact O-NE2 3.02Å; D76-Q78 VanDerWaalsContact O-NE2 3.1Å; D76-Q78 PolarHBondContact OD1-N 3.29Å; Q78-I80 PolarHBondContact O-N 2.69Å
79	H	94.6	Very high	93.8	Very high	105 Å²	105	41.7 Å²	41.7	49%	0.486	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	121.3	-179.9	-84.8	-87.2	0	0	0	110.7	Q70 A71 R72	Q70-H79 HydrophobicContact CG-CB 4.39Å; A71-H79 CarbonylContact O-C 3.49Å; A71-H79 WeakPolarHBondContact O-CA 3.26Å; R72-H79 PolarHBondContact NE-CE1 3.48Å; R72-H79 VanDerWaalsContact NE-CE1 3.3Å; R72-H79 PolarHBondContact NE-NE2 2.93Å; R72-H79 PolarHBondContact NH2-NE2 3.27Å
80	I	93.8	Very high	93.7	Very high	40 Å²	40	45.1 Å²	45.1	21%	0.205	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.7	-174.3	-173.7	172	0	0	0	110.5	A71 Q78 I82 V105 Y165	A71-I80 HydrophobicContact CB-CG2 4.49Å; A71-I80 PolarHBondContact N-O 3.37Å; A71-I80 PolarHBondContact O-N 3.13Å; Q78-I80 PolarHBondContact O-N 2.69Å; I80-I82 HydrophobicContact CG2-CG2 4.29Å; I80-I82 PolarHBondContact O-N 2.79Å; I80-V105 HydrophobicContact CD1-CG1 3.86Å; I80-V105 HydrophobicContact CG1-CG1 4.33Å; I80-Y165 HydrophobicContact CD1-CE1 3.97Å; I80-Y165 HydrophobicContact CG2-CD1 3.62Å; I80-Y165 HydrophobicContact CG2-CE1 3.67Å
81	P	95.9	Very high	93.1	Very high	42 Å²	42	42.4 Å²	42.4	27%	0.273	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.5	172.3	29.3	-32.6	0	0	0	109.4	P106	P81-P106 HydrophobicContact CG-CG 4.45Å; P81-P106 WeakPolarHBondContact O-CD 3.44Å
82	I	95.6	Very high	92.4	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	145.6	173.4	65.2	173.1	0	0	0	110.6	M68 V69 A71 I80 L84 L103 V105 Y165 V199	M68-I82 WeakPolarHBondContact CA-O 3.27Å; V69-I82 HydrophobicContact CG2-CD1 4.06Å; V69-I82 HydrophobicContact CG2-CG1 3.57Å; V69-I82 PolarHBondContact N-O 2.88Å; V69-I82 PolarHBondContact O-N 2.86Å; A71-I82 HydrophobicContact CB-CD1 3.6Å; A71-I82 HydrophobicContact CB-CG1 3.8Å; A71-I82 HydrophobicContact CB-CG2 4.4Å; I80-I82 HydrophobicContact CG2-CG2 4.29Å; I80-I82 PolarHBondContact O-N 2.79Å; I82-L84 HydrophobicContact CD1-CD1 4.11Å; I82-L84 HydrophobicContact CD1-CG 4.29Å; I82-L103 HydrophobicContact CB-CD1 3.79Å; I82-L103 HydrophobicContact CD1-CD1 4.21Å; I82-L103 HydrophobicContact CG1-CD1 4.46Å; I82-L103 HydrophobicContact CG2-CD1 4.21Å; I82-V105 HydrophobicContact CG2-CG2 4.37Å; I82-Y165 HydrophobicContact CD1-CD2 4.49Å; I82-Y165 HydrophobicContact CD1-CG 4.4Å; I82-Y165 HydrophobicContact CG2-CD1 4.42Å; I82-Y165 HydrophobicContact CG2-CD2 4.27Å; I82-Y165 HydrophobicContact CG2-CE2 4.44Å; I82-Y165 HydrophobicContact CG2-CG 4.28Å; I82-V199 HydrophobicContact CD1-CG2 4.14Å
83	H	95.3	Very high	91.3	Very high	46 Å²	46	48.7 Å²	48.7	21%	0.213	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	129.5	172.8	-178.6	-108.8	0	0	0	110	M67 L103 T104	M67-H83 WeakPolarHBondContact O-CA 3.36Å; M67-H83 PolarHBondContact O-CD2 3.49Å; M67-H83 VanDerWaalsContact O-CD2 3.3Å; H83-L103 WeakPolarHBondContact O-CA 3.26Å; H83-T104 PolarHBondContact N-O 3.04Å; H83-T104 PolarHBondContact O-N 3.04Å
84	L	95.4	Very high	90.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.1	-178.9	-68.1	169.9	0	0	0	109.6	Q66 M67 V69 I82 F86 A101 T102 L103 V132 V134 Y167 V199	Q66-L84 WeakPolarHBondContact CA-O 3.29Å; M67-L84 HydrophobicContact CG-CB 4.11Å; M67-L84 PolarHBondContact N-O 2.95Å; M67-L84 PolarHBondContact O-N 3.18Å; V69-L84 HydrophobicContact CG2-CD1 4.35Å; I82-L84 HydrophobicContact CD1-CD1 4.11Å; I82-L84 HydrophobicContact CD1-CG 4.29Å; L84-F86 HydrophobicContact CB-CD2 4.05Å; L84-F86 HydrophobicContact CB-CE2 3.52Å; L84-F86 HydrophobicContact CB-CZ 4.33Å; L84-F86 HydrophobicContact CD1-CE2 4.09Å; L84-F86 HydrophobicContact CD1-CZ 4.17Å; L84-F86 HydrophobicContact CG-CE2 4.42Å; L84-A101 HydrophobicContact CB-CB 4.46Å; L84-A101 HydrophobicContact CD2-CB 4.28Å; L84-T102 WeakPolarHBondContact CA-O 3.22Å; L84-L103 HydrophobicContact CD2-CB 4.08Å; L84-L103 HydrophobicContact CD2-CD1 3.87Å; L84-V132 HydrophobicContact CD2-CG2 3.93Å; L84-V134 HydrophobicContact CD1-CG2 4.34Å; L84-V134 HydrophobicContact CD2-CG2 4.37Å; L84-Y167 HydrophobicContact CD1-CE1 3.69Å; L84-V199 HydrophobicContact CD1-CG2 4.46Å; L84-V199 HydrophobicContact CD2-CG1 4.47Å
85	S	95.3	Very high	89.4	Confident	18 Å²	18	60.5 Å²	60.5	13%	0.126	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	97	174.4	-173.1	0	0	0	0	109.4	Q66 A101 T102	Q66-S85 WeakPolarHBondContact CG-OG 3.15Å; Q66-S85 PolarHBondContact NE2-OG 2.73Å; S85-A101 CarbonylContact O-C 3.53Å; S85-A101 VanDerWaalsContact O-CA 3.31Å; S85-A101 WeakPolarHBondContact O-CA 3.38Å; S85-T102 PolarHBondContact N-O 3.45Å; S85-T102 PolarHBondContact O-N 3.04Å
86	F	94.3	Very high	88.9	Confident	8 Å²	8	59 Å²	59	4%	0.035	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	128.9	-174	-72.3	-108.3	0	0	0	111.7	P64 R65 M67 L84 E99 A101 V134	P64-F86 WeakPolarHBondContact CA-O 3.28Å; P64-F86 WeakPolarHBondContact CB-O 3.07Å; R65-F86 HydrophobicContact CB-CB 4.2Å; R65-F86 PolarHBondContact N-O 3.17Å; R65-F86 WeakPolarHBondContact O-CB 3.27Å; R65-F86 WeakPolarHBondContact O-CD2 3.36Å; R65-F86 PolarHBondContact O-N 3.31Å; M67-F86 HydrophobicContact CE-CD2 4.37Å; M67-F86 HydrophobicContact CE-CE2 3.75Å; M67-F86 HydrophobicContact CE-CZ 4.25Å; M67-F86 HydrophobicContact CG-CD2 4.47Å; M67-F86 HydrophobicContact CG-CE2 3.85Å; M67-F86 HydrophobicContact SD-CE2 3.74Å; M67-F86 HydrophobicContact SD-CZ 4.25Å; L84-F86 HydrophobicContact CB-CD2 4.05Å; L84-F86 HydrophobicContact CB-CE2 3.52Å; L84-F86 HydrophobicContact CB-CZ 4.33Å; L84-F86 HydrophobicContact CD1-CE2 4.09Å; L84-F86 HydrophobicContact CD1-CZ 4.17Å; L84-F86 HydrophobicContact CG-CE2 4.42Å; F86-E99 HydrophobicContact CD1-CB 3.64Å; F86-E99 HydrophobicContact CD1-CG 4.31Å; F86-E99 HydrophobicContact CE1-CB 3.93Å; F86-A101 HydrophobicContact CD1-CB 4.21Å; F86-A101 HydrophobicContact CD2-CB 4.23Å; F86-A101 HydrophobicContact CG-CB 4.06Å; F86-V134 HydrophobicContact CE1-CB 3.92Å; F86-V134 HydrophobicContact CE1-CG1 4.17Å; F86-V134 HydrophobicContact CE1-CG2 4.02Å; F86-V134 HydrophobicContact CZ-CB 4.21Å; F86-V134 HydrophobicContact CZ-CG1 4.13Å; F86-V134 HydrophobicContact CZ-CG2 4.02Å
87	V	90.2	Very high	88.8	Confident	73 Å²	73	58.8 Å²	58.8	44%	0.442	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-28.7	-177.2	-175.5	0	0	0	0	111.5	R100	V87-R100 PolarHBondContact N-O 3.23Å
88	G	90	Very high	88.8	Confident	28 Å²	28	59.4 Å²	59.4	29%	0.289	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	152.1	170.6	174.7	0	0	0	0	0	113.8	E99 R100	G88-E99 CarbonylContact O-C 3.6Å; G88-E99 WeakPolarHBondContact O-CA 3.44Å; G88-R100 PolarHBondContact N-O 3.46Å; G88-R100 PolarHBondContact O-N 2.84Å
89	T	90.8	Very high	88.9	Confident	78 Å²	78	55.1 Å²	55.1	48%	0.479	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	132.7	173.1	-69.6	0	0	0	0	111.2	Q92	T89-Q92 HydrophobicContact CG2-CG 4.12Å; T89-Q92 VanDerWaalsContact CG2-NE2 3.27Å
90	I	91.3	Very high	88.9	Confident	86 Å²	86	54.9 Å²	54.9	44%	0.441	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-15.9	171.6	59	169.4	0	0	0	112.9	I98 R100 A133	I90-I98 HydrophobicContact CD1-CG2 4.01Å; I90-I98 HydrophobicContact CG1-CB 4.33Å; I90-I98 HydrophobicContact CG1-CG2 3.83Å; I90-I98 PolarHBondContact N-O 2.89Å; I90-R100 HydrophobicContact CD1-CB 4.24Å; I90-R100 HydrophobicContact CG2-CB 3.7Å; I90-A133 HydrophobicContact CD1-CB 4.04Å
91	G	83.8	Confident	89	Confident	21 Å²	21	53 Å²	53	22%	0.216	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	154.1	177.4	0	0	0	0	0	113	I98	G91-I98 PolarHBondContact N-O 3.39Å; G91-I98 PolarHBondContact O-N 3.26Å
92	Q	81.1	Confident	89	Confident	118 Å²	118	52.8 Å²	52.8	55%	0.551	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.4	132	172.4	-63.9	-68.8	-76.4	0	0	107.8	T89	T89-Q92 HydrophobicContact CG2-CG 4.12Å; T89-Q92 VanDerWaalsContact CG2-NE2 3.27Å
93	G	73.2	Confident	89	Confident	50 Å²	50	53.1 Å²	53.1	52%	0.515	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	171.2	179.2	0	0	0	0	0	111.8	F95 G96	G93-F95 PolarHBondContact O-N 3.12Å; G93-F95 VanDerWaalsContact O-N 3.11Å; G93-G96 PolarHBondContact N-O 2.99Å; G93-G96 PolarHBondContact O-N 2.89Å; G93-G96 VanDerWaalsContact O-N 3.15Å; G93-G96 VanDerWaalsContact O-O 3.08Å
94	T	74.5	Confident	89	Confident	133 Å²	133	53.9 Å²	53.9	82%	0.816	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.2	179.6	46.9	0	0	0	0	113.9
95	F	75.8	Confident	88.7	Confident	126 Å²	126	55.7 Å²	55.7	55%	0.553	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-6.5	-177.3	-56.2	-67	0	0	0	114.5	G93 V137	G93-F95 PolarHBondContact O-N 3.12Å; G93-F95 VanDerWaalsContact O-N 3.11Å; F95-V137 HydrophobicContact CB-CG1 4.29Å; F95-V137 WeakPolarHBondContact O-CA 3.47Å
96	G	78.1	Confident	88.1	Confident	27 Å²	27	57.5 Å²	57.5	28%	0.278	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	149.6	-151.2	179.4	0	0	0	0	0	115.2	G93 R136	G93-G96 PolarHBondContact N-O 2.99Å; G93-G96 PolarHBondContact O-N 2.89Å; G93-G96 VanDerWaalsContact O-N 3.15Å; G93-G96 VanDerWaalsContact O-O 3.08Å; G96-R136 WeakPolarHBondContact CA-O 3.4Å
97	Q	89	Confident	87	Confident	72 Å²	72	61.9 Å²	61.9	34%	0.336	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.6	-164.4	-54	-165.5	-69.9	0	0	111	R136	Q97-R136 PolarHBondContact N-O 3.26Å; Q97-R136 VanDerWaalsContact N-O 3.14Å; Q97-R136 PolarHBondContact O-N 3.24Å
98	I	93.6	Very high	85.5	Confident	52 Å²	52	64.1 Å²	64.1	27%	0.267	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.1	173.8	-48.6	179.7	0	0	0	108.6	I90 G91 A133 V134 K135	I90-I98 HydrophobicContact CD1-CG2 4.01Å; I90-I98 HydrophobicContact CG1-CB 4.33Å; I90-I98 HydrophobicContact CG1-CG2 3.83Å; I90-I98 PolarHBondContact N-O 2.89Å; G91-I98 PolarHBondContact N-O 3.39Å; G91-I98 PolarHBondContact O-N 3.26Å; I98-A133 HydrophobicContact CG2-CB 4.11Å; I98-V134 WeakPolarHBondContact CA-O 3.34Å; I98-K135 HydrophobicContact CG1-CB 4.22Å; I98-K135 HydrophobicContact CG1-CG 4.15Å
99	E	94.7	Very high	83.1	Confident	35 Å²	35	68.7 Å²	68.7	16%	0.164	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.1	179.1	-56.4	-172.4	75.8	0	0	110.7	F86 G88 V134	F86-E99 HydrophobicContact CD1-CB 3.64Å; F86-E99 HydrophobicContact CD1-CG 4.31Å; F86-E99 HydrophobicContact CE1-CB 3.93Å; G88-E99 CarbonylContact O-C 3.6Å; G88-E99 WeakPolarHBondContact O-CA 3.44Å; E99-V134 PolarHBondContact N-O 3.21Å; E99-V134 PolarHBondContact O-N 2.85Å
100	R	95.4	Very high	80.4	Confident	100 Å²	100	70.3 Å²	70.3	38%	0.377	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.1	169.9	-178.4	174.4	63	-146.9	-4	109.4	V87 G88 I90 V132	V87-R100 PolarHBondContact N-O 3.23Å; G88-R100 PolarHBondContact N-O 3.46Å; G88-R100 PolarHBondContact O-N 2.84Å; I90-R100 HydrophobicContact CD1-CB 4.24Å; I90-R100 HydrophobicContact CG2-CB 3.7Å; R100-V132 WeakPolarHBondContact CA-O 3.25Å
101	A	95.7	Very high	77.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	156.3	173.6	0	0	0	0	0	111.5	L84 S85 F86 V132 V134	L84-A101 HydrophobicContact CB-CB 4.46Å; L84-A101 HydrophobicContact CD2-CB 4.28Å; S85-A101 CarbonylContact O-C 3.53Å; S85-A101 VanDerWaalsContact O-CA 3.31Å; S85-A101 WeakPolarHBondContact O-CA 3.38Å; F86-A101 HydrophobicContact CD1-CB 4.21Å; F86-A101 HydrophobicContact CD2-CB 4.23Å; F86-A101 HydrophobicContact CG-CB 4.06Å; A101-V132 HydrophobicContact CB-CG2 4.14Å; A101-V132 PolarHBondContact N-O 2.88Å; A101-V132 WeakPolarHBondContact O-CG2 3.25Å; A101-V132 PolarHBondContact O-N 3.28Å; A101-V134 HydrophobicContact CB-CG2 4.18Å
102	T	96.3	Very high	75.1	Confident	38 Å²	38	75.2 Å²	75.2	23%	0.233	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	123.5	163.1	-54.3	0	0	0	0	108.6	L84 S85 Q131	L84-T102 WeakPolarHBondContact CA-O 3.22Å; S85-T102 PolarHBondContact N-O 3.45Å; S85-T102 PolarHBondContact O-N 3.04Å; T102-Q131 PolarHBondContact OG1-NE2 2.9Å
103	L	95.7	Very high	72.7	Confident	6 Å²	6	76.2 Å²	76.2	3%	0.031	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.5	177.5	169.7	64.9	0	0	0	111.1	I82 H83 L84 G129 L130 V132 Y165 V199	I82-L103 HydrophobicContact CB-CD1 3.79Å; I82-L103 HydrophobicContact CD1-CD1 4.21Å; I82-L103 HydrophobicContact CG1-CD1 4.46Å; I82-L103 HydrophobicContact CG2-CD1 4.21Å; H83-L103 WeakPolarHBondContact O-CA 3.26Å; L84-L103 HydrophobicContact CD2-CB 4.08Å; L84-L103 HydrophobicContact CD2-CD1 3.87Å; L103-G129 CarbonylContact O-C 3.53Å; L103-G129 WeakPolarHBondContact O-CA 3.35Å; L103-L130 HydrophobicContact CB-CB 4.43Å; L103-L130 HydrophobicContact CD2-CD2 4.47Å; L103-L130 PolarHBondContact N-O 2.95Å; L103-L130 PolarHBondContact O-N 3.32Å; L103-V132 HydrophobicContact CB-CB 4.5Å; L103-V132 HydrophobicContact CB-CG1 3.86Å; L103-V132 HydrophobicContact CB-CG2 3.78Å; L103-V132 HydrophobicContact CD2-CG1 3.82Å; L103-Y165 HydrophobicContact CD2-CD2 4.02Å; L103-Y165 HydrophobicContact CD2-CE2 3.9Å; L103-V199 HydrophobicContact CD2-CG1 4.36Å
104	T	94.6	Very high	70.6	Confident	62 Å²	62	76.7 Å²	76.7	38%	0.38	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	137.7	168.8	-48.1	0	0	0	0	109.4	H83	H83-T104 PolarHBondContact N-O 3.04Å; H83-T104 PolarHBondContact O-N 3.04Å
105	V	89.2	Confident	68.6	Low	38 Å²	38	79.8 Å²	79.8	23%	0.23	50%	0.496	C	S	.	.			trans	-106.3	127.4	174.1	-176.6	0	0	0	0	108.2	I80 I82	I80-V105 HydrophobicContact CD1-CG1 3.86Å; I80-V105 HydrophobicContact CG1-CG1 4.33Å; I82-V105 HydrophobicContact CG2-CG2 4.37Å
106	P	82.1	Confident	66.3	Low	56 Å²	56	83.8 Å²	83.8	36%	0.364	51%	0.513	S	S	.	.			trans	-62.3	138.2	175.2	-21	33.6	0	0	0	111.6	P81 T108	P81-P106 HydrophobicContact CG-CG 4.45Å; P81-P106 WeakPolarHBondContact O-CD 3.44Å; P106-T108 PolarHBondContact O-N 3.08Å
107	A	72.8	Confident	64.3	Low	100 Å²	100	87.8 Å²	87.8	83%	0.826	53%	0.528	S	S	*	.			trans	-67.3	118.2	174.3	0	0	0	0	0	110.3	S109	A107-S109 PolarHBondContact O-N 2.93Å; A107-S109 VanDerWaalsContact O-N 3.15Å
108	T	58.2	Low	61.8	Low	121 Å²	121	89 Å²	89	74%	0.742	54%	0.544	S	S	*	.			trans	-74.9	103.9	-177.1	49	0	0	0	0	111.2	P106 S110	P106-T108 PolarHBondContact O-N 3.08Å; T108-S110 PolarHBondContact O-N 2.82Å
109	S	38.8	Very low	59.4	Low	124 Å²	124	91.7 Å²	91.7	87%	0.867	56%	0.56	S	S	*	*	S	Bend	trans	-76.8	38.5	-176.4	51	0	0	0	0	115	A107	A107-S109 PolarHBondContact O-N 2.93Å; A107-S109 VanDerWaalsContact O-N 3.15Å
110	S	35.6	Very low	57.1	Low	111 Å²	111	94 Å²	94	78%	0.776	58%	0.576	S	S	*	*			trans	-173.7	140	161.4	38.9	0	0	0	0	110.9	T108	T108-S110 PolarHBondContact O-N 2.82Å
111	G	32.9	Very low	54.1	Low	75 Å²	75	91.7 Å²	91.7	77%	0.773	58%	0.583	S	S	*	*			trans	155	125.8	177.3	0	0	0	0	0	112.9
112	T	30.1	Very low	51.1	Low	135 Å²	135	98 Å²	98	83%	0.828	62%	0.622	S	S	*	*			trans	-60.6	144.6	-178.6	8.2	0	0	0	0	112.6	G114	T112-G114 PolarHBondContact O-N 2.93Å
113	P	30	Very low	48.7	Very low	139 Å²	139	102.1 Å²	102.1	90%	0.903	64%	0.637	S	S	*	*	S	Bend	trans	-72.4	76.9	176.2	30.8	-35.7	0	0	0	111.1
114	G	29.2	Very low	45.7	Very low	61 Å²	61	107.7 Å²	107.7	63%	0.629	68%	0.676	S	S	*	*			trans	-132.2	-0.3	-162.4	0	0	0	0	0	117.5	T112	T112-G114 PolarHBondContact O-N 2.93Å
115	K	32.5	Very low	42.9	Very low	198 Å²	198	109.5 Å²	109.5	86%	0.861	68%	0.684	S	S	*	*			trans	-171.9	121.8	165.5	-108.8	158.6	-177.1	179.1	0	110.2	N117	K115-N117 PolarHBondContact O-N 2.86Å
116	K	29.1	Very low	40.3	Very low	209 Å²	209	111 Å²	111	91%	0.909	71%	0.708	S	S	*	*			trans	-83.9	105	165.4	-71.8	-177	177	-178.1	0	108.1	S118	K116-S118 PolarHBondContact O-N 2.91Å
117	N	35.5	Very low	38.9	Very low	111 Å²	111	112 Å²	112	59%	0.594	73%	0.728	S	S	*	*			trans	-68.4	109.9	159.4	-83.5	4.2	0	0	0	106.9	K115 D119	K115-N117 PolarHBondContact O-N 2.86Å; N117-D119 PolarHBondContact O-N 3.24Å
118	S	36.5	Very low	38.5	Very low	97 Å²	97	113.1 Å²	113.1	68%	0.678	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-26.1	-173.5	38.2	0	0	0	0	114.5	K116	K116-S118 PolarHBondContact O-N 2.91Å
119	D	42.6	Very low	39.8	Very low	110 Å²	110	108.6 Å²	108.6	59%	0.588	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-14.4	-160.7	-72.2	48.1	0	0	0	114.1	N117 G121	N117-D119 PolarHBondContact O-N 3.24Å; D119-G121 VanDerWaalsContact C-N 3.27Å; D119-G121 PolarHBondContact O-N 2.97Å
120	V	45.7	Very low	42.4	Very low	83 Å²	83	105.7 Å²	105.7	50%	0.503	67%	0.667	S	S	.	*	S	Bend	trans	-88.5	80.1	156.2	-175.9	0	0	0	0	105.9	T122 F123	V120-T122 PolarHBondContact O-N 2.95Å; V120-T122 VanDerWaalsContact O-N 3.17Å; V120-F123 HydrophobicContact CG1-CE2 4.22Å
121	G	34.2	Very low	45.2	Very low	52 Å²	52	104 Å²	104	54%	0.536	65%	0.648	S	S	.	*			trans	-51.4	123.3	178.3	0	0	0	0	0	109.9	D119 F123	D119-G121 VanDerWaalsContact C-N 3.27Å; D119-G121 PolarHBondContact O-N 2.97Å; G121-F123 PolarHBondContact O-N 2.88Å; G121-F123 VanDerWaalsContact O-N 3.12Å
122	T	32.6	Very low	48.3	Very low	133 Å²	133	100.5 Å²	100.5	82%	0.816	61%	0.611	S	S	*	*			trans	-44.6	120.6	-179.1	-14.1	0	0	0	0	109.5	V120 S124	V120-T122 PolarHBondContact O-N 2.95Å; V120-T122 VanDerWaalsContact O-N 3.17Å; T122-S124 VanDerWaalsContact C-N 3.32Å; T122-S124 PolarHBondContact O-N 3.3Å
123	F	45.6	Very low	51.5	Low	123 Å²	123	94.6 Å²	94.6	54%	0.539	58%	0.576	S	S	.	*			trans	-59.4	91.2	-174	-70.7	-85.8	0	0	0	110.9	V120 G121 D125	V120-F123 HydrophobicContact CG1-CE2 4.22Å; G121-F123 PolarHBondContact O-N 2.88Å; G121-F123 VanDerWaalsContact O-N 3.12Å; F123-D125 PolarHBondContact O-N 3.32Å
124	S	31.4	Very low	54.7	Low	123 Å²	123	88.1 Å²	88.1	86%	0.86	53%	0.534	S	S	*	.			trans	-92.1	37.5	-171.7	65.5	0	0	0	0	112.4	T122	T122-S124 VanDerWaalsContact C-N 3.32Å; T122-S124 PolarHBondContact O-N 3.3Å
125	D	36.8	Very low	57.8	Low	100 Å²	100	85.9 Å²	85.9	54%	0.535	51%	0.506	S	S	.	.	S	Bend	trans	-147.3	144.9	159.8	-159.8	-27.1	0	0	0	107.6	F123 G127 Q128	F123-D125 PolarHBondContact O-N 3.32Å; D125-G127 PolarHBondContact O-N 2.92Å; D125-Q128 PolarHBondContact OD1-NE2 2.85Å; D125-Q128 PolarHBondContact OD2-NE2 3.1Å
126	G	34.3	Very low	60.8	Low	71 Å²	71	79.4 Å²	79.4	73%	0.732	48%	0.477	S	S	*	.	S	Bend	trans	-68.3	89.9	-160.6	0	0	0	0	0	114.2	Q128	G126-Q128 PolarHBondContact O-N 2.93Å
127	G	51.9	Low	63.9	Low	76 Å²	76	69.8 Å²	69.8	78%	0.784	44%	0.435	S	S	*	.	S	Bend	trans	69.7	9.7	173	0	0	0	0	0	115.2	D125 G129	D125-G127 PolarHBondContact O-N 2.92Å; G127-G129 PolarHBondContact O-N 2.82Å
128	Q	65.9	Low	66.6	Low	124 Å²	124	69.1 Å²	69.1	58%	0.579	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-71.2	125.7	179.9	-62.8	-164.6	48.2	0	0	111	D125 G126	D125-Q128 PolarHBondContact OD1-NE2 2.85Å; D125-Q128 PolarHBondContact OD2-NE2 3.1Å; G126-Q128 PolarHBondContact O-N 2.93Å
129	G	84.5	Confident	69.3	Low	26 Å²	26	65.5 Å²	65.5	27%	0.268	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-76.5	138	-178.4	0	0	0	0	0	113.2	L103 G127	L103-G129 CarbonylContact O-C 3.53Å; L103-G129 WeakPolarHBondContact O-CA 3.35Å; G127-G129 PolarHBondContact O-N 2.82Å
130	L	93.3	Very high	71.6	Confident	62 Å²	62	62.3 Å²	62.3	33%	0.325	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134	-176.8	-178.8	62.7	0	0	0	111.3	L103 V132 Y164	L103-L130 HydrophobicContact CB-CB 4.43Å; L103-L130 HydrophobicContact CD2-CD2 4.47Å; L103-L130 PolarHBondContact N-O 2.95Å; L103-L130 PolarHBondContact O-N 3.32Å; L130-V132 HydrophobicContact CD2-CG1 4.2Å; L130-V132 HydrophobicContact CG-CG1 4.11Å; L130-V132 PolarHBondContact O-N 3.1Å; L130-Y164 HydrophobicContact CD2-CD2 4.37Å; L130-Y164 HydrophobicContact CD2-CE1 4.16Å; L130-Y164 HydrophobicContact CD2-CE2 3.79Å
131	Q	95.5	Very high	73.6	Confident	77 Å²	77	62.5 Å²	62.5	36%	0.36	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	122.6	171.5	-67.5	-57.3	-71.5	0	0	110.6	T102 C202	T102-Q131 PolarHBondContact OG1-NE2 2.9Å; Q131-C202 HydrophobicContact CB-CB 4.07Å; Q131-C202 WeakPolarHBondContact O-CB 3.39Å; Q131-C202 PolarHBondContact O-N 2.9Å
132	V	97.2	Very high	76.3	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.7	-178.5	-64.7	0	0	0	0	112	L84 R100 A101 L103 L130 V134 Y164 V199 L200	L84-V132 HydrophobicContact CD2-CG2 3.93Å; R100-V132 WeakPolarHBondContact CA-O 3.25Å; A101-V132 HydrophobicContact CB-CG2 4.14Å; A101-V132 PolarHBondContact N-O 2.88Å; A101-V132 WeakPolarHBondContact O-CG2 3.25Å; A101-V132 PolarHBondContact O-N 3.28Å; L103-V132 HydrophobicContact CB-CB 4.5Å; L103-V132 HydrophobicContact CB-CG1 3.86Å; L103-V132 HydrophobicContact CB-CG2 3.78Å; L103-V132 HydrophobicContact CD2-CG1 3.82Å; L130-V132 HydrophobicContact CD2-CG1 4.2Å; L130-V132 HydrophobicContact CG-CG1 4.11Å; L130-V132 PolarHBondContact O-N 3.1Å; V132-V134 HydrophobicContact CG2-CG2 4.32Å; V132-Y164 HydrophobicContact CG1-CD2 4.06Å; V132-Y164 HydrophobicContact CG1-CE2 4.12Å; V132-V199 HydrophobicContact CB-CG1 3.81Å; V132-V199 HydrophobicContact CG1-CG1 3.96Å; V132-V199 HydrophobicContact CG2-CG1 3.83Å; V132-L200 CarbonylContact C-O 3.53Å; V132-L200 WeakPolarHBondContact CA-O 3.41Å; V132-L200 VanDerWaalsContact CB-O 3.25Å; V132-L200 WeakPolarHBondContact CB-O 3.41Å
133	A	97	Very high	79	Confident	11 Å²	11	69.6 Å²	69.6	9%	0.091	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.4	169.3	0	0	0	0	0	108.8	I90 I98 L200	I90-A133 HydrophobicContact CD1-CB 4.04Å; I98-A133 HydrophobicContact CG2-CB 4.11Å; A133-L200 HydrophobicContact CB-CB 4.49Å; A133-L200 PolarHBondContact N-O 3.27Å; A133-L200 WeakPolarHBondContact O-CB 3.43Å; A133-L200 PolarHBondContact O-N 2.94Å
134	V	96.6	Very high	81.1	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.018	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	105.6	178.3	-173.9	0	0	0	0	108.6	L84 F86 I98 E99 A101 V132 Y167 H197 L198	L84-V134 HydrophobicContact CD1-CG2 4.34Å; L84-V134 HydrophobicContact CD2-CG2 4.37Å; F86-V134 HydrophobicContact CE1-CB 3.92Å; F86-V134 HydrophobicContact CE1-CG1 4.17Å; F86-V134 HydrophobicContact CE1-CG2 4.02Å; F86-V134 HydrophobicContact CZ-CB 4.21Å; F86-V134 HydrophobicContact CZ-CG1 4.13Å; F86-V134 HydrophobicContact CZ-CG2 4.02Å; I98-V134 WeakPolarHBondContact CA-O 3.34Å; E99-V134 PolarHBondContact N-O 3.21Å; E99-V134 PolarHBondContact O-N 2.85Å; A101-V134 HydrophobicContact CB-CG2 4.18Å; V132-V134 HydrophobicContact CG2-CG2 4.32Å; V134-Y167 HydrophobicContact CG1-CE1 4.49Å; V134-H197 HydrophobicContact CG1-CB 4.11Å; V134-L198 WeakPolarHBondContact CA-O 3.25Å
135	K	96.1	Very high	84.1	Confident	14 Å²	14	67 Å²	67	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	111.1	175.8	177.2	176	171.4	-172.2	0	109.4	I98 V137 E147 H197 L198 L200 D268	I98-K135 HydrophobicContact CG1-CB 4.22Å; I98-K135 HydrophobicContact CG1-CG 4.15Å; K135-V137 HydrophobicContact CG-CG1 4.17Å; K135-E147 WeakPolarHBondContact CE-OE2 3.34Å; K135-E147 IonicContact NZ-OE1 2.81Å; K135-E147 PolarHBondContact NZ-OE1 2.81Å; K135-E147 IonicContact NZ-OE2 3.43Å; K135-E147 PolarHBondContact NZ-OE2 3.44Å; K135-H197 WeakPolarHBondContact O-CA 3.43Å; K135-L198 HydrophobicContact CB-CB 4.46Å; K135-L198 PolarHBondContact N-O 3.13Å; K135-L198 PolarHBondContact O-N 2.84Å; K135-L200 HydrophobicContact CB-CD1 4.43Å; K135-D268 IonicContact NZ-OD1 3.43Å; K135-D268 PolarHBondContact NZ-OD1 3.46Å
136	R	94.9	Very high	86.8	Confident	62 Å²	62	68.2 Å²	68.2	23%	0.234	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.5	176.6	178.7	-174.1	176	-163.4	-2	110.1	G96 Q97 F195 L196	G96-R136 WeakPolarHBondContact CA-O 3.4Å; Q97-R136 PolarHBondContact N-O 3.26Å; Q97-R136 VanDerWaalsContact N-O 3.14Å; Q97-R136 PolarHBondContact O-N 3.24Å; R136-F195 HydrophobicContact CG-CB 4.15Å; R136-F195 HydrophobicContact CG-CD1 3.92Å; R136-F195 HydrophobicContact CG-CG 4.33Å; R136-F195 VanDerWaalsContact NE-CD1 3.26Å; R136-F195 VanDerWaalsContact NH2-CZ 3.25Å; R136-L196 WeakPolarHBondContact CA-O 3.46Å
137	V	93.7	Very high	89.8	Confident	7 Å²	7	65.5 Å²	65.5	4%	0.042	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.3	175.5	-60.6	0	0	0	0	111.6	F95 K135 F195 L196	F95-V137 HydrophobicContact CB-CG1 4.29Å; F95-V137 WeakPolarHBondContact O-CA 3.47Å; K135-V137 HydrophobicContact CG-CG1 4.17Å; V137-F195 CarbonylContact O-C 3.6Å; V137-F195 VanDerWaalsContact O-CA 3.25Å; V137-F195 WeakPolarHBondContact O-CA 3.5Å; V137-L196 HydrophobicContact CG2-CB 3.94Å; V137-L196 HydrophobicContact CG2-CD2 4.33Å; V137-L196 HydrophobicContact CG2-CG 4.35Å; V137-L196 PolarHBondContact N-O 2.74Å; V137-L196 PolarHBondContact O-N 3.14Å
138	L	93	Very high	91.8	Very high	98 Å²	98	62.4 Å²	62.4	51%	0.513	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	133.6	171	-174.3	72.2	0	0	0	109.5	D193 F195	L138-D193 HydrophobicContact CD1-CB 3.94Å; L138-F195 HydrophobicContact CB-CD1 4.46Å; L138-F195 HydrophobicContact CB-CE1 4.27Å; L138-F195 HydrophobicContact CD1-CD1 4.33Å; L138-F195 HydrophobicContact CD1-CE1 3.85Å; L138-F195 HydrophobicContact CD1-CE2 4.25Å; L138-F195 HydrophobicContact CD1-CZ 3.8Å
139	Q	93.2	Very high	93.2	Very high	20 Å²	20	59 Å²	59	9%	0.093	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.9	-179.1	-178	59.5	44.4	0	0	110.7	P141 Y143 N145 Y168 V194 L196	Q139-P141 WeakPolarHBondContact O-CD 3.33Å; Q139-Y143 PolarHBondContact NE2-O 2.92Å; Q139-N145 PolarHBondContact OE1-ND2 3.2Å; Q139-Y168 HydrophobicContact CG-CE1 4.13Å; Q139-V194 HydrophobicContact CB-CG1 4.3Å; Q139-V194 PolarHBondContact N-O 3.19Å; Q139-L196 HydrophobicContact CB-CB 4.2Å
140	D	90.2	Very high	93.8	Very high	44 Å²	44	58.4 Å²	58.4	24%	0.235	27%	0.272	C	S	.	.			trans	-80.4	118.8	164.3	-169.7	-34.5	0	0	0	109	R142 Y143	D140-R142 PolarHBondContact O-N 2.82Å; D140-R142 VanDerWaalsContact O-N 3.1Å; D140-R142 VanDerWaalsContact OD1-CB 3.25Å; D140-R142 WeakPolarHBondContact OD1-CB 3.24Å; D140-R142 WeakPolarHBondContact OD1-CG 3.22Å; D140-R142 IonicContact OD1-CZ 2.71Å; D140-R142 PolarHBondContact OD1-N 3.42Å; D140-R142 IonicContact OD1-NE 2.66Å; D140-R142 PolarHBondContact OD1-NE 2.85Å; D140-R142 IonicContact OD1-NH2 2.74Å; D140-R142 IonicContact OD2-CZ 3.98Å; D140-R142 IonicContact OD2-NE 3.8Å; D140-R142 PolarHBondContact OD2-NE 2.86Å; D140-R142 IonicContact OD2-NH2 3.37Å; D140-R142 PolarHBondContact OD2-NH2 2.86Å; D140-Y143 HydrophobicContact CB-CD2 4.1Å; D140-Y143 PolarHBondContact O-N 3.21Å
141	P	88.1	Confident	93.9	Very high	87 Å²	87	55.6 Å²	55.6	57%	0.565	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.6	-179.1	-24.2	36.1	0	0	0	114.3	Q139 V194	Q139-P141 WeakPolarHBondContact O-CD 3.33Å; P141-V194 HydrophobicContact CG-CB 4.27Å; P141-V194 HydrophobicContact CG-CG2 3.88Å
142	R	89.9	Confident	93.9	Very high	185 Å²	185	52.3 Å²	52.3	70%	0.698	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-16.7	-176.8	-56.8	171.8	-67.3	177.1	2.3	113.5	D140	D140-R142 PolarHBondContact O-N 2.82Å; D140-R142 VanDerWaalsContact O-N 3.1Å; D140-R142 VanDerWaalsContact OD1-CB 3.25Å; D140-R142 WeakPolarHBondContact OD1-CB 3.24Å; D140-R142 WeakPolarHBondContact OD1-CG 3.22Å; D140-R142 IonicContact OD1-CZ 2.71Å; D140-R142 PolarHBondContact OD1-N 3.42Å; D140-R142 IonicContact OD1-NE 2.66Å; D140-R142 PolarHBondContact OD1-NE 2.85Å; D140-R142 IonicContact OD1-NH2 2.74Å; D140-R142 IonicContact OD2-CZ 3.98Å; D140-R142 IonicContact OD2-NE 3.8Å; D140-R142 PolarHBondContact OD2-NE 2.86Å; D140-R142 IonicContact OD2-NH2 3.37Å; D140-R142 PolarHBondContact OD2-NH2 2.86Å
143	Y	89.4	Confident	93.8	Very high	149 Å²	149	55.4 Å²	55.4	58%	0.584	25%	0.254	S	S	*	.	S	Bend	trans	-127.9	140.2	-172.6	-60.7	-72.9	0	0	0	111.8	Q139 D140	Q139-Y143 PolarHBondContact NE2-O 2.92Å; D140-Y143 HydrophobicContact CB-CD2 4.1Å; D140-Y143 PolarHBondContact O-N 3.21Å
144	K	90.9	Very high	93.7	Very high	163 Å²	163	54.9 Å²	54.9	71%	0.709	25%	0.249	S	C	*	.			trans	-64.9	136.9	170.6	-69.6	-170.5	176.4	-172.8	0	110.1	R146	K144-R146 PolarHBondContact O-N 3.43Å
145	N	93.6	Very high	93.6	Very high	27 Å²	27	55 Å²	55	14%	0.144	25%	0.25	C	C	.	.			trans	-73	121.7	174.9	-167.2	-63.9	0	0	0	110.4	Q139 E147 L148 S149 L196	Q139-N145 PolarHBondContact OE1-ND2 3.2Å; N145-E147 WeakPolarHBondContact OD1-CB 3.49Å; N145-E147 PolarHBondContact OD1-N 2.84Å; N145-L148 HydrophobicContact CB-CB 3.84Å; N145-L148 HydrophobicContact CB-CD2 4.47Å; N145-L148 PolarHBondContact OD1-N 3.32Å; N145-L148 VanDerWaalsContact OD1-N 3.12Å; N145-S149 PolarHBondContact O-N 3.41Å; N145-S149 PolarHBondContact O-OG 3.39Å; N145-L196 HydrophobicContact CB-CD2 3.85Å; N145-L196 WeakPolarHBondContact ND2-CD2 3.46Å
146	R	94.6	Very high	93.4	Very high	127 Å²	127	56.7 Å²	56.7	48%	0.479	26%	0.259	S	S	.	.	H	α-helix	trans	-70.9	-41	-177.1	-168	-164.7	-63.6	153.4	5.1	112.6	K144 L148 S149 I150 A272	K144-R146 PolarHBondContact O-N 3.43Å; R146-L148 VanDerWaalsContact C-N 3.34Å; R146-S149 PolarHBondContact O-N 3.05Å; R146-I150 HydrophobicContact CG-CD1 3.86Å; R146-I150 HydrophobicContact CG-CG1 4.41Å; R146-I150 WeakPolarHBondContact O-CB 3.35Å; R146-I150 WeakPolarHBondContact O-CG1 3.33Å; R146-I150 PolarHBondContact O-N 3.44Å; R146-A272 WeakPolarHBondContact CD-O 3.12Å; R146-A272 PolarHBondContact NH1-O 2.81Å
147	E	95.8	Very high	93.4	Very high	13 Å²	13	53.9 Å²	53.9	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-47.3	178.6	176.8	168.2	-159.7	0	0	110	K135 N145 S149 I150 M151 L198 F269 G270	K135-E147 WeakPolarHBondContact CE-OE2 3.34Å; K135-E147 IonicContact NZ-OE1 2.81Å; K135-E147 PolarHBondContact NZ-OE1 2.81Å; K135-E147 IonicContact NZ-OE2 3.43Å; K135-E147 PolarHBondContact NZ-OE2 3.44Å; N145-E147 WeakPolarHBondContact OD1-CB 3.49Å; N145-E147 PolarHBondContact OD1-N 2.84Å; E147-S149 PolarHBondContact O-N 3.26Å; E147-I150 PolarHBondContact O-N 2.88Å; E147-M151 HydrophobicContact CG-CG 4.22Å; E147-M151 HydrophobicContact CG-SD 3.85Å; E147-M151 WeakPolarHBondContact O-CB 3.46Å; E147-M151 VanDerWaalsContact O-CG 3.31Å; E147-M151 WeakPolarHBondContact O-CG 3.43Å; E147-M151 PolarHBondContact O-N 2.78Å; E147-L198 HydrophobicContact CG-CD1 4.03Å; E147-F269 HydrophobicContact CG-CB 3.98Å; E147-F269 PolarHBondContact OE1-N 2.92Å; E147-G270 VanDerWaalsContact CD-N 3.27Å; E147-G270 PolarHBondContact OE1-N 2.97Å; E147-G270 WeakPolarHBondContact OE2-CA 3.19Å
148	L	95.5	Very high	93.5	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-50.8	-56.5	173.5	179	61.7	0	0	0	111.7	N145 R146 I150 M151 Q152 F163 Y166 L196 L198	N145-L148 HydrophobicContact CB-CB 3.84Å; N145-L148 HydrophobicContact CB-CD2 4.47Å; N145-L148 PolarHBondContact OD1-N 3.32Å; N145-L148 VanDerWaalsContact OD1-N 3.12Å; R146-L148 VanDerWaalsContact C-N 3.34Å; L148-I150 VanDerWaalsContact C-N 3.32Å; L148-I150 PolarHBondContact O-N 3.43Å; L148-M151 PolarHBondContact O-N 2.94Å; L148-Q152 HydrophobicContact CD1-CG 4.44Å; L148-Q152 WeakPolarHBondContact O-CG 3.49Å; L148-Q152 PolarHBondContact O-N 2.79Å; L148-F163 HydrophobicContact CD1-CE1 3.75Å; L148-F163 HydrophobicContact CD1-CZ 3.47Å; L148-F163 VanDerWaalsContact CD1-CZ 3.47Å; L148-Y166 HydrophobicContact CD1-CD1 3.95Å; L148-Y166 HydrophobicContact CD1-CD2 4.26Å; L148-Y166 HydrophobicContact CD1-CE1 4.3Å; L148-Y166 HydrophobicContact CD1-CG 3.93Å; L148-Y166 HydrophobicContact CD2-CD2 4.39Å; L148-Y166 HydrophobicContact CD2-CE2 4.26Å; L148-L196 HydrophobicContact CB-CD2 4.2Å; L148-L196 HydrophobicContact CD2-CD2 4.27Å; L148-L198 HydrophobicContact CD1-CD2 3.94Å
149	S	95.2	Very high	93.8	Very high	54 Å²	54	50.9 Å²	50.9	38%	0.378	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-35.3	-177.4	-60	0	0	0	0	113.6	N145 R146 E147 R153	N145-S149 PolarHBondContact O-N 3.41Å; N145-S149 PolarHBondContact O-OG 3.39Å; R146-S149 PolarHBondContact O-N 3.05Å; E147-S149 PolarHBondContact O-N 3.26Å; S149-R153 PolarHBondContact O-N 3.45Å
150	I	96.2	Very high	94	Very high	12 Å²	12	50.1 Å²	50.1	6%	0.062	23%	0.232	C	C	.	.	H	α-helix	trans	-69.3	-45.1	175.4	-72.9	175.3	0	0	0	110.8	R146 E147 L148 Q152 R153 L154 I245 F269 A272	R146-I150 HydrophobicContact CG-CD1 3.86Å; R146-I150 HydrophobicContact CG-CG1 4.41Å; R146-I150 WeakPolarHBondContact O-CB 3.35Å; R146-I150 WeakPolarHBondContact O-CG1 3.33Å; R146-I150 PolarHBondContact O-N 3.44Å; E147-I150 PolarHBondContact O-N 2.88Å; L148-I150 VanDerWaalsContact C-N 3.32Å; L148-I150 PolarHBondContact O-N 3.43Å; I150-Q152 VanDerWaalsContact C-N 3.35Å; I150-Q152 PolarHBondContact O-N 3.35Å; I150-R153 PolarHBondContact O-N 2.88Å; I150-L154 HydrophobicContact CG2-CD1 3.64Å; I150-L154 HydrophobicContact CG2-CG 4.38Å; I150-L154 WeakPolarHBondContact O-CG 3.44Å; I150-L154 PolarHBondContact O-N 2.7Å; I150-I245 HydrophobicContact CD1-CG2 4.45Å; I150-I245 HydrophobicContact CG2-CD1 4.4Å; I150-I245 HydrophobicContact CG2-CG2 4.09Å; I150-F269 HydrophobicContact CG2-CB 4.38Å; I150-F269 HydrophobicContact CG2-CD1 3.67Å; I150-F269 HydrophobicContact CG2-CE1 4.37Å; I150-F269 HydrophobicContact CG2-CG 4.33Å; I150-A272 HydrophobicContact CD1-CB 3.71Å; I150-A272 HydrophobicContact CG2-CB 4.31Å
151	M	96.1	Very high	94.3	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.02	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-30.3	-179.4	-67.2	-169.6	81.8	0	0	112.9	E147 L148 N155 V161 F163 L198 L200 F269	E147-M151 HydrophobicContact CG-CG 4.22Å; E147-M151 HydrophobicContact CG-SD 3.85Å; E147-M151 WeakPolarHBondContact O-CB 3.46Å; E147-M151 VanDerWaalsContact O-CG 3.31Å; E147-M151 WeakPolarHBondContact O-CG 3.43Å; E147-M151 PolarHBondContact O-N 2.78Å; L148-M151 PolarHBondContact O-N 2.94Å; M151-N155 WeakPolarHBondContact O-CB 3.42Å; M151-N155 PolarHBondContact O-N 3.24Å; M151-V161 HydrophobicContact CE-CG1 3.62Å; M151-F163 HydrophobicContact CB-CD1 3.76Å; M151-F163 HydrophobicContact CB-CE1 4.27Å; M151-F163 HydrophobicContact CB-CG 4.35Å; M151-F163 HydrophobicContact CE-CB 4.38Å; M151-L198 HydrophobicContact SD-CD1 4.2Å; M151-L200 HydrophobicContact CE-CD1 4.19Å; M151-L200 HydrophobicContact CE-CD2 3.52Å; M151-L200 HydrophobicContact SD-CD2 4.32Å; M151-F269 HydrophobicContact CE-CD2 4.07Å; M151-F269 HydrophobicContact CG-CB 3.87Å; M151-F269 HydrophobicContact CG-CD2 4Å; M151-F269 HydrophobicContact CG-CG 4.03Å; M151-F269 HydrophobicContact SD-CB 4.26Å; M151-F269 HydrophobicContact SD-CD2 4.23Å
152	Q	95.6	Very high	94.7	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.037	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-51.6	169.7	-66.9	-172.6	-66.1	0	0	111	A74 Q75 N77 L148 I150 L154 F163 N438 T441	A74-Q152 VanDerWaalsContact O-CG 3.29Å; A74-Q152 WeakPolarHBondContact O-CG 3.26Å; A74-Q152 PolarHBondContact O-NE2 3.42Å; Q75-Q152 PolarHBondContact NE2-O 3.24Å; N77-Q152 PolarHBondContact ND2-NE2 3.32Å; N77-Q152 PolarHBondContact OD1-NE2 3.14Å; L148-Q152 HydrophobicContact CD1-CG 4.44Å; L148-Q152 WeakPolarHBondContact O-CG 3.49Å; L148-Q152 PolarHBondContact O-N 2.79Å; I150-Q152 VanDerWaalsContact C-N 3.35Å; I150-Q152 PolarHBondContact O-N 3.35Å; Q152-L154 PolarHBondContact O-N 2.98Å; Q152-F163 HydrophobicContact CG-CD1 4.46Å; Q152-F163 HydrophobicContact CG-CE1 3.82Å; Q152-N438 PolarHBondContact O-ND2 3.01Å; Q152-T441 HydrophobicContact CB-CG2 4.46Å; Q152-T441 PolarHBondContact OE1-OG1 3.32Å
153	R	94.1	Very high	95.1	Very high	64 Å²	64	37.5 Å²	37.5	24%	0.242	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-42.8	-179	-171.7	172.6	174.4	-173.6	-4.2	112.8	S149 I150 E274 P437 N438	S149-R153 PolarHBondContact O-N 3.45Å; I150-R153 PolarHBondContact O-N 2.88Å; R153-E274 IonicContact CZ-OE1 3.78Å; R153-E274 IonicContact NH1-OE1 3.18Å; R153-E274 PolarHBondContact NH1-OE1 2.79Å; R153-E274 IonicContact NH1-OE2 3.7Å; R153-E274 IonicContact NH2-OE1 2.9Å; R153-P437 HydrophobicContact CG-CB 3.99Å; R153-N438 PolarHBondContact O-N 3.14Å; R153-N438 PolarHBondContact O-ND2 2.94Å
154	L	95.1	Very high	95.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-90.1	-7.8	-170.8	-63	177.6	0	0	0	116.1	I150 Q152 N156 H157 V160 Y239 L240 I245 F269	I150-L154 HydrophobicContact CG2-CD1 3.64Å; I150-L154 HydrophobicContact CG2-CG 4.38Å; I150-L154 WeakPolarHBondContact O-CG 3.44Å; I150-L154 PolarHBondContact O-N 2.7Å; Q152-L154 PolarHBondContact O-N 2.98Å; L154-N156 PolarHBondContact O-N 3.26Å; L154-H157 PolarHBondContact O-N 2.99Å; L154-V160 HydrophobicContact CB-CG1 4.38Å; L154-Y239 HydrophobicContact CB-CE1 4.01Å; L154-Y239 HydrophobicContact CD2-CD1 4.06Å; L154-Y239 HydrophobicContact CD2-CE1 3.42Å; L154-Y239 VanDerWaalsContact CD2-CE1 3.42Å; L154-Y239 HydrophobicContact CG-CE1 4.29Å; L154-L240 HydrophobicContact CD1-CD1 3.9Å; L154-L240 HydrophobicContact CD1-CG 4.07Å; L154-I245 HydrophobicContact CD1-CD1 4.12Å; L154-I245 HydrophobicContact CD1-CG2 4.21Å; L154-I245 HydrophobicContact CD2-CD1 4Å; L154-I245 HydrophobicContact CG-CD1 4.13Å; L154-F269 HydrophobicContact CD1-CD1 4.16Å; L154-F269 HydrophobicContact CD1-CE1 3.56Å; L154-F269 HydrophobicContact CD1-CZ 4.28Å
155	N	94.3	Very high	95.8	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.027	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-2.2	-168.5	-153	-2.1	0	0	0	117.8	Q75 M151 K162 F163	Q75-N155 PolarHBondContact NE2-ND2 2.94Å; M151-N155 WeakPolarHBondContact O-CB 3.42Å; M151-N155 PolarHBondContact O-N 3.24Å; N155-K162 WeakPolarHBondContact O-CD 3.45Å; N155-K162 WeakPolarHBondContact O-CE 3.42Å; N155-K162 PolarHBondContact O-NZ 3.42Å; N155-K162 WeakPolarHBondContact OD1-CD 3.47Å; N155-F163 PolarHBondContact ND2-O 2.86Å; N155-F163 PolarHBondContact OD1-N 3.32Å; N155-F163 PolarHBondContact OD1-O 3.35Å
156	N	92.1	Very high	95.9	Very high	50 Å²	50	25.5 Å²	25.5	27%	0.267	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-21.4	-175.8	-63.6	-4.5	0	0	0	112.4	L154 P435 E436 N438	L154-N156 PolarHBondContact O-N 3.26Å; N156-P435 HydrophobicContact CB-CB 4.12Å; N156-P435 HydrophobicContact CB-CG 3.83Å; N156-E436 PolarHBondContact ND2-O 3.17Å; N156-N438 VanDerWaalsContact ND2-CG 3.3Å; N156-N438 PolarHBondContact ND2-ND2 3.2Å; N156-N438 PolarHBondContact ND2-OD1 2.88Å; N156-N438 PolarHBondContact OD1-ND2 3.33Å; N156-N438 PolarHBondContact OD1-OD1 3.05Å
157	H	95.6	Very high	96.1	Very high	3 Å²	3	19.8 Å²	19.8	1%	0.014	10%	0.098	C	C	.	.			trans	-74.9	131.9	-172.3	-171.8	-86.1	0	0	0	112.3	L154 N159 V160 Y239 D434 P435	L154-H157 PolarHBondContact O-N 2.99Å; H157-N159 PolarHBondContact ND1-N 3.28Å; H157-N159 PolarHBondContact O-N 3.42Å; H157-N159 VanDerWaalsContact O-N 3.14Å; H157-V160 HydrophobicContact CB-CB 4.21Å; H157-V160 HydrophobicContact CB-CG2 3.93Å; H157-V160 PolarHBondContact O-N 3.32Å; H157-Y239 HydrophobicContact CB-CD1 3.43Å; H157-Y239 VanDerWaalsContact CB-CD1 3.43Å; H157-Y239 HydrophobicContact CB-CE1 3.38Å; H157-Y239 HydrophobicContact CB-CG 4.07Å; H157-Y239 VanDerWaalsContact CD2-CB 3.45Å; H157-Y239 WeakPolarHBondContact CD2-CB 3.37Å; H157-Y239 AromaticContact CD2-CD1 3.6Å; H157-Y239 AromaticContact CD2-CD2 3.86Å; H157-Y239 AromaticContact CD2-CG 3.34Å; H157-Y239 AromaticContact CG-CD1 3.51Å; H157-Y239 AromaticContact CG-CG 3.78Å; H157-D434 IonicContact CD2-OD1 3.6Å; H157-D434 IonicContact NE2-OD1 3.75Å; H157-D434 PolarHBondContact NE2-OD1 3.18Å; H157-P435 HydrophobicContact CB-CG 4.46Å
158	P	95.9	Very high	96	Very high	38 Å²	38	23.4 Å²	23.4	25%	0.247	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.5	-174.1	23.8	-34.4	0	0	0	113.6	K265 H429	P158-K265 WeakPolarHBondContact O-CD 3.31Å; P158-K265 WeakPolarHBondContact O-CE 3.44Å; P158-H429 HydrophobicContact CB-CB 4.09Å; P158-H429 HydrophobicContact CG-CB 4.31Å
159	N	97.6	Very high	95.9	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.021	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	20.8	178	-50.4	110.3	0	0	0	114.3	H157 Q232 S236 L264 K265 V266	H157-N159 PolarHBondContact ND1-N 3.28Å; H157-N159 PolarHBondContact O-N 3.42Å; H157-N159 VanDerWaalsContact O-N 3.14Å; N159-Q232 WeakPolarHBondContact ND2-CB 3.27Å; N159-Q232 WeakPolarHBondContact ND2-CG 3.28Å; N159-Q232 PolarHBondContact ND2-OE1 2.91Å; N159-S236 WeakPolarHBondContact O-CB 3.35Å; N159-L264 WeakPolarHBondContact CB-O 3.49Å; N159-L264 PolarHBondContact ND2-O 3.28Å; N159-K265 CarbonylContact O-C 3.58Å; N159-K265 WeakPolarHBondContact O-CA 3.38Å; N159-V266 PolarHBondContact O-N 2.83Å
160	V	97.5	Very high	95.8	Very high	4 Å²	4	26 Å²	26	2%	0.024	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-113.7	136.3	166.9	172.4	0	0	0	0	108.3	L154 H157 K162 Y239 L240 F269	L154-V160 HydrophobicContact CB-CG1 4.38Å; H157-V160 HydrophobicContact CB-CB 4.21Å; H157-V160 HydrophobicContact CB-CG2 3.93Å; H157-V160 PolarHBondContact O-N 3.32Å; V160-K162 PolarHBondContact O-N 2.96Å; V160-Y239 HydrophobicContact CG2-CD1 4.38Å; V160-L240 HydrophobicContact CG2-CD1 4Å; V160-F269 HydrophobicContact CG1-CE2 3.89Å; V160-F269 HydrophobicContact CG1-CZ 3.78Å; V160-F269 HydrophobicContact CG2-CZ 4.34Å
161	V	97.1	Very high	95.1	Very high	3 Å²	3	27 Å²	27	2%	0.018	14%	0.137	C	C	.	.			trans	-56	126.9	-179.5	67.9	0	0	0	0	110.9	M151 F163 L200 E201 L256 V266 C267	M151-V161 HydrophobicContact CE-CG1 3.62Å; V161-F163 PolarHBondContact O-N 3.37Å; V161-L200 HydrophobicContact CG2-CB 4.42Å; V161-E201 HydrophobicContact CG2-CB 3.86Å; V161-L256 HydrophobicContact CB-CD1 4.29Å; V161-L256 HydrophobicContact CG2-CD1 3.81Å; V161-V266 WeakPolarHBondContact CB-O 3.44Å; V161-V266 WeakPolarHBondContact CG1-O 3.4Å; V161-V266 PolarHBondContact N-O 3.39Å; V161-C267 HydrophobicContact CB-CB 4.09Å; V161-C267 HydrophobicContact CG1-CB 3.83Å
162	K	97.1	Very high	93.7	Very high	47 Å²	47	30.8 Å²	30.8	20%	0.204	16%	0.164	C	C	.	.			trans	-68	133.8	-177.6	-163	77.2	-174.1	-178.4	0	109.8	N155 V160 Y164 L200 E201	N155-K162 WeakPolarHBondContact O-CD 3.45Å; N155-K162 WeakPolarHBondContact O-CE 3.42Å; N155-K162 PolarHBondContact O-NZ 3.42Å; N155-K162 WeakPolarHBondContact OD1-CD 3.47Å; V160-K162 PolarHBondContact O-N 2.96Å; K162-Y164 HydrophobicContact CB-CE1 4.15Å; K162-Y164 HydrophobicContact CG-CD1 4.07Å; K162-Y164 HydrophobicContact CG-CE1 3.62Å; K162-L200 CarbonylContact O-C 3.32Å; K162-L200 WeakPolarHBondContact O-CA 3.37Å; K162-E201 HydrophobicContact CB-CB 4.06Å; K162-E201 WeakPolarHBondContact CB-OE2 3.44Å; K162-E201 PolarHBondContact N-OE2 2.97Å; K162-E201 PolarHBondContact O-N 3.26Å
163	F	97.3	Very high	91.9	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.009	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.6	176.7	172	-146.4	0	0	0	108.2	A74 L148 M151 Q152 N155 V161 Y165 Y166 L198 L200	A74-F163 HydrophobicContact CB-CB 4.42Å; A74-F163 HydrophobicContact CB-CD1 3.57Å; A74-F163 HydrophobicContact CB-CD2 4.13Å; A74-F163 HydrophobicContact CB-CE1 3.74Å; A74-F163 HydrophobicContact CB-CE2 4.3Å; A74-F163 HydrophobicContact CB-CG 3.77Å; A74-F163 HydrophobicContact CB-CZ 4.1Å; A74-F163 WeakPolarHBondContact CB-O 3.35Å; L148-F163 HydrophobicContact CD1-CE1 3.75Å; L148-F163 HydrophobicContact CD1-CZ 3.47Å; L148-F163 VanDerWaalsContact CD1-CZ 3.47Å; M151-F163 HydrophobicContact CB-CD1 3.76Å; M151-F163 HydrophobicContact CB-CE1 4.27Å; M151-F163 HydrophobicContact CB-CG 4.35Å; M151-F163 HydrophobicContact CE-CB 4.38Å; Q152-F163 HydrophobicContact CG-CD1 4.46Å; Q152-F163 HydrophobicContact CG-CE1 3.82Å; N155-F163 PolarHBondContact ND2-O 2.86Å; N155-F163 PolarHBondContact OD1-N 3.32Å; N155-F163 PolarHBondContact OD1-O 3.35Å; V161-F163 PolarHBondContact O-N 3.37Å; F163-Y165 VanDerWaalsContact CE2-O 3.27Å; F163-Y165 WeakPolarHBondContact CE2-O 3.43Å; F163-Y166 AromaticContact CZ-CD1 3.88Å; F163-Y166 HydrophobicContact CZ-CD1 3.88Å; F163-Y166 HydrophobicContact CZ-CG 4.23Å; F163-L198 HydrophobicContact CE2-CB 4.22Å; F163-L198 HydrophobicContact CE2-CD2 3.82Å; F163-L198 HydrophobicContact CZ-CD2 3.82Å; F163-L200 HydrophobicContact CB-CD2 3.9Å; F163-L200 HydrophobicContact CD2-CD2 3.69Å; F163-L200 HydrophobicContact CG-CD2 4.1Å
164	Y	96.8	Very high	89.8	Confident	57 Å²	57	36.5 Å²	36.5	22%	0.224	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-53.9	-172.7	-57.9	-69	0	0	0	112.3	A74 L130 V132 K162 V199 E201	A74-Y164 VanDerWaalsContact CB-O 3.28Å; A74-Y164 WeakPolarHBondContact CB-O 3.43Å; A74-Y164 PolarHBondContact N-O 3.12Å; L130-Y164 HydrophobicContact CD2-CD2 4.37Å; L130-Y164 HydrophobicContact CD2-CE1 4.16Å; L130-Y164 HydrophobicContact CD2-CE2 3.79Å; V132-Y164 HydrophobicContact CG1-CD2 4.06Å; V132-Y164 HydrophobicContact CG1-CE2 4.12Å; K162-Y164 HydrophobicContact CB-CE1 4.15Å; K162-Y164 HydrophobicContact CG-CD1 4.07Å; K162-Y164 HydrophobicContact CG-CE1 3.62Å; Y164-V199 PolarHBondContact N-O 3.46Å; Y164-E201 HydrophobicContact CE2-CB 4.05Å
165	Y	97.6	Very high	87.6	Confident	21 Å²	21	42 Å²	42	8%	0.082	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	156.2	-170.5	-56.1	-75	0	0	0	111.2	R72 I80 I82 L103 F163 V199	R72-Y165 CarbonylContact O-C 3.58Å; R72-Y165 VanDerWaalsContact O-CA 3.26Å; R72-Y165 WeakPolarHBondContact O-CA 3.37Å; I80-Y165 HydrophobicContact CD1-CE1 3.97Å; I80-Y165 HydrophobicContact CG2-CD1 3.62Å; I80-Y165 HydrophobicContact CG2-CE1 3.67Å; I82-Y165 HydrophobicContact CD1-CD2 4.49Å; I82-Y165 HydrophobicContact CD1-CG 4.4Å; I82-Y165 HydrophobicContact CG2-CD1 4.42Å; I82-Y165 HydrophobicContact CG2-CD2 4.27Å; I82-Y165 HydrophobicContact CG2-CE2 4.44Å; I82-Y165 HydrophobicContact CG2-CG 4.28Å; L103-Y165 HydrophobicContact CD2-CD2 4.02Å; L103-Y165 HydrophobicContact CD2-CE2 3.9Å; F163-Y165 VanDerWaalsContact CE2-O 3.27Å; F163-Y165 WeakPolarHBondContact CE2-O 3.43Å; Y165-V199 WeakPolarHBondContact O-CA 3.19Å; Y165-V199 VanDerWaalsContact O-CB 3.28Å; Y165-V199 WeakPolarHBondContact O-CB 3.48Å; Y165-V199 PolarHBondContact O-N 2.93Å
166	Y	97.7	Very high	85.4	Confident	9 Å²	9	50 Å²	50	4%	0.035	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153.9	166.9	69.3	-81.7	0	0	0	112.1	A71 R72 N77 L148 F163 Y168 L196 H197	A71-Y166 CarbonylContact C-O 3.57Å; A71-Y166 WeakPolarHBondContact CA-O 3.33Å; A71-Y166 WeakPolarHBondContact CB-O 3.45Å; R72-Y166 HydrophobicContact CB-CD1 4.13Å; R72-Y166 HydrophobicContact CB-CE1 3.66Å; R72-Y166 HydrophobicContact CB-CE2 4.2Å; R72-Y166 VanDerWaalsContact CD-OH 3.26Å; R72-Y166 WeakPolarHBondContact CD-OH 3.39Å; R72-Y166 PolarHBondContact N-O 3.48Å; R72-Y166 PolarHBondContact O-N 3.46Å; N77-Y166 PolarHBondContact OD1-OH 3.12Å; L148-Y166 HydrophobicContact CD1-CD1 3.95Å; L148-Y166 HydrophobicContact CD1-CD2 4.26Å; L148-Y166 HydrophobicContact CD1-CE1 4.3Å; L148-Y166 HydrophobicContact CD1-CG 3.93Å; L148-Y166 HydrophobicContact CD2-CD2 4.39Å; L148-Y166 HydrophobicContact CD2-CE2 4.26Å; F163-Y166 AromaticContact CZ-CD1 3.88Å; F163-Y166 HydrophobicContact CZ-CD1 3.88Å; F163-Y166 HydrophobicContact CZ-CG 4.23Å; Y166-Y168 HydrophobicContact CD2-CE2 4.22Å; Y166-Y168 AromaticContact CE2-CE2 3.98Å; Y166-Y168 HydrophobicContact CE2-CE2 3.98Å; Y166-L196 HydrophobicContact CD2-CD1 3.87Å; Y166-L196 HydrophobicContact CG-CD1 4.42Å; Y166-H197 VanDerWaalsContact CA-O 3.22Å; Y166-H197 WeakPolarHBondContact CA-O 3.25Å; Y166-H197 WeakPolarHBondContact CB-O 3.29Å
167	Y	97	Very high	82.9	Confident	7 Å²	7	50.5 Å²	50.5	3%	0.027	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	164.5	174.5	62.9	-86.3	0	0	0	111.2	V69 A71 L84 V134 H197 V199	V69-Y167 HydrophobicContact CB-CD2 4.25Å; V69-Y167 HydrophobicContact CB-CG 4.36Å; V69-Y167 HydrophobicContact CG1-CD2 4.26Å; V69-Y167 HydrophobicContact CG1-CE2 4.15Å; V69-Y167 HydrophobicContact CG2-CD1 3.82Å; V69-Y167 HydrophobicContact CG2-CD2 4.14Å; V69-Y167 HydrophobicContact CG2-CE1 3.98Å; V69-Y167 HydrophobicContact CG2-CE2 4.28Å; V69-Y167 HydrophobicContact CG2-CG 3.91Å; A71-Y167 HydrophobicContact CB-CD1 4.47Å; L84-Y167 HydrophobicContact CD1-CE1 3.69Å; V134-Y167 HydrophobicContact CG1-CE1 4.49Å; Y167-H197 HydrophobicContact CD1-CB 3.87Å; Y167-H197 HydrophobicContact CD2-CB 4Å; Y167-H197 AromaticContact CD2-CD2 3.75Å; Y167-H197 AromaticContact CD2-CG 3.98Å; Y167-H197 HydrophobicContact CE1-CB 3.51Å; Y167-H197 HydrophobicContact CE2-CB 3.65Å; Y167-H197 AromaticContact CE2-CD2 3.39Å; Y167-H197 WeakPolarHBondContact CE2-CD2 3.44Å; Y167-H197 AromaticContact CE2-CE1 3.99Å; Y167-H197 AromaticContact CE2-CG 3.37Å; Y167-H197 AromaticContact CE2-ND1 3.79Å; Y167-H197 AromaticContact CE2-NE2 3.79Å; Y167-H197 HydrophobicContact CG-CB 4.1Å; Y167-H197 AromaticContact CZ-CD2 3.99Å; Y167-H197 AromaticContact CZ-CG 3.45Å; Y167-H197 VanDerWaalsContact CZ-CG 3.45Å; Y167-H197 AromaticContact CZ-ND1 3.69Å; Y167-H197 PolarHBondContact N-O 3.04Å; Y167-H197 VanDerWaalsContact N-O 3.1Å; Y167-H197 PolarHBondContact O-N 3.4Å; Y167-H197 PolarHBondContact OH-ND1 2.74Å; Y167-V199 HydrophobicContact CD1-CG2 4.21Å; Y167-V199 HydrophobicContact CE1-CG2 3.91Å
168	Y	95.4	Very high	80.1	Confident	89 Å²	89	59.3 Å²	59.3	35%	0.349	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	152.2	175	-63.7	-78.9	0	0	0	110.7	Q139 Y166 V194 F195 L196	Q139-Y168 HydrophobicContact CG-CE1 4.13Å; Y166-Y168 HydrophobicContact CD2-CE2 4.22Å; Y166-Y168 AromaticContact CE2-CE2 3.98Å; Y166-Y168 HydrophobicContact CE2-CE2 3.98Å; Y168-V194 HydrophobicContact CD1-CG1 4.29Å; Y168-F195 CarbonylContact C-O 3.56Å; Y168-F195 VanDerWaalsContact CA-O 3.25Å; Y168-F195 WeakPolarHBondContact CA-O 3.47Å; Y168-L196 HydrophobicContact CD1-CB 4.11Å; Y168-L196 HydrophobicContact CD1-CD1 4.14Å; Y168-L196 HydrophobicContact CE1-CB 3.88Å; Y168-L196 HydrophobicContact CE1-CD1 3.64Å; Y168-L196 HydrophobicContact CE1-CG 4.25Å
169	S	93.3	Very high	77.6	Confident	37 Å²	37	66.6 Å²	66.6	26%	0.259	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	140.1	169.1	72.7	0	0	0	0	110.8	F195 H197	S169-F195 PolarHBondContact N-O 3.05Å; S169-F195 PolarHBondContact O-N 2.89Å; S169-H197 PolarHBondContact OG-NE2 3.33Å
170	T	91.3	Very high	74.9	Confident	82 Å²	82	71.9 Å²	71.9	50%	0.503	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	151.7	170.4	47.2	0	0	0	0	111.5	V192 V194 Y452	T170-V192 VanDerWaalsContact CB-CG1 3.45Å; T170-V192 HydrophobicContact CG2-CG1 3.51Å; T170-V194 HydrophobicContact CG2-CG2 4.49Å; T170-Y452 HydrophobicContact CG2-CE2 4.48Å
171	A	82.2	Confident	72.2	Confident	32 Å²	32	75.1 Å²	75.1	26%	0.264	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.7	162.7	0	0	0	0	0	109.8	D193 F195	A171-D193 PolarHBondContact N-O 2.88Å; A171-D193 PolarHBondContact O-N 2.85Å; A171-F195 HydrophobicContact CB-CD2 4.33Å; A171-F195 HydrophobicContact CB-CE2 3.77Å
172	S	66.8	Low	69.2	Low	84 Å²	84	79.4 Å²	79.4	59%	0.587	47%	0.468	S	S	*	.			trans	-69.9	132.9	171.8	-176.5	0	0	0	0	109.9	N174	S172-N174 PolarHBondContact O-N 3.01Å
173	S	57.3	Low	66.4	Low	49 Å²	49	80.6 Å²	80.6	34%	0.343	49%	0.493	S	S	.	.	S	Bend	trans	-71.3	5.2	-172.8	54.3	0	0	0	0	115.2	S175 R176	S173-S175 PolarHBondContact O-N 2.88Å; S173-R176 PolarHBondContact O-N 2.87Å; S173-R176 VanDerWaalsContact O-N 3.16Å
174	N	50.3	Low	63.6	Low	144 Å²	144	92.3 Å²	92.3	77%	0.77	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	10.5	-170.5	-70.7	2	0	0	0	115.8	S172	S172-N174 PolarHBondContact O-N 3.01Å
175	S	49	Very low	60.7	Low	115 Å²	115	94.9 Å²	94.9	80%	0.804	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	0.4	175.4	-50.8	0	0	0	0	114.1	S173 G177	S173-S175 PolarHBondContact O-N 2.88Å; S175-G177 PolarHBondContact O-N 2.92Å
176	R	47.9	Very low	57.9	Low	173 Å²	173	96.8 Å²	96.8	65%	0.653	60%	0.597	S	S	*	*	S	Bend	trans	-77.5	76.1	165.6	-71.5	-176.3	178.2	128.4	7.6	109.2	S173 D193	S173-R176 PolarHBondContact O-N 2.87Å; S173-R176 VanDerWaalsContact O-N 3.16Å; R176-D193 IonicContact CZ-OD1 3.43Å; R176-D193 IonicContact CZ-OD2 2.67Å; R176-D193 IonicContact NH1-OD1 2.83Å; R176-D193 PolarHBondContact NH1-OD1 3.37Å; R176-D193 IonicContact NH1-OD2 2.68Å; R176-D193 PolarHBondContact NH1-OD2 2.78Å; R176-D193 VanDerWaalsContact NH1-OD2 3.1Å; R176-D193 IonicContact NH2-OD1 3.17Å; R176-D193 PolarHBondContact NH2-OD1 2.98Å; R176-D193 IonicContact NH2-OD2 3.92Å; R176-D193 PolarHBondContact NH2-OD2 3.32Å
177	G	41	Very low	55	Low	60 Å²	60	101.6 Å²	101.6	62%	0.619	64%	0.639	S	S	*	*			trans	-54.4	152.7	-171.7	0	0	0	0	0	114.9	S175 R179	S175-G177 PolarHBondContact O-N 2.92Å; G177-R179 PolarHBondContact O-N 2.81Å
178	H	36.7	Very low	52.4	Low	188 Å²	188	106.5 Å²	106.5	87%	0.87	67%	0.674	S	S	*	*			trans	-46.4	104.6	-174.4	-89.5	-76.2	0	0	0	113.5
179	R	43.6	Very low	50.3	Low	192 Å²	192	108.3 Å²	108.3	73%	0.725	69%	0.694	S	S	*	*			trans	-98.9	86.9	152.5	-80.2	-171.5	166.9	-176.6	-3.8	108.4	G177 G181	G177-R179 PolarHBondContact O-N 2.81Å; R179-G181 PolarHBondContact O-N 2.68Å
180	S	39.6	Very low	48.3	Very low	115 Å²	115	112 Å²	112	80%	0.804	72%	0.72	S	S	*	*			trans	-53.1	118	174.5	-57.8	0	0	0	0	110.2
181	G	41.2	Very low	47.1	Very low	72 Å²	72	110 Å²	110	74%	0.742	72%	0.716	S	S	*	*			trans	-168.1	87.8	-175.6	0	0	0	0	0	109.2	R179 G183	R179-G181 PolarHBondContact O-N 2.68Å; G181-G183 PolarHBondContact O-N 2.71Å
182	G	35	Very low	47.1	Very low	93 Å²	93	111.1 Å²	111.1	96%	0.959	72%	0.719	S	S	*	*			trans	-62	121.2	-178.7	0	0	0	0	0	111.3
183	G	38.3	Very low	48.2	Very low	71 Å²	71	108.8 Å²	108.8	73%	0.732	70%	0.7	S	S	*	*			trans	-170	92	-178.1	0	0	0	0	0	111.8	G181	G181-G183 PolarHBondContact O-N 2.71Å
184	R	38.6	Very low	49.9	Very low	248 Å²	248	107.2 Å²	107.2	94%	0.936	69%	0.689	S	S	*	*			trans	32	109.4	171.1	-81.4	-179.7	163	162.7	-6.1	116.9	G186	R184-G186 VanDerWaalsContact C-N 3.35Å; R184-G186 PolarHBondContact O-N 3.1Å
185	A	34.1	Very low	52	Low	111 Å²	111	101.8 Å²	101.8	92%	0.917	66%	0.658	S	S	*	*			trans	-66.3	87	169.5	0	0	0	0	0	112
186	G	39.7	Very low	54.2	Low	62 Å²	62	96.3 Å²	96.3	64%	0.639	62%	0.62	S	S	*	*			trans	-74.1	139.7	154.1	0	0	0	0	0	109.3	R184 S188	R184-G186 VanDerWaalsContact C-N 3.35Å; R184-G186 PolarHBondContact O-N 3.1Å; G186-S188 PolarHBondContact O-N 3.22Å
187	A	37.2	Very low	56.6	Low	110 Å²	110	88.9 Å²	88.9	91%	0.909	59%	0.593	S	S	*	*			trans	-71.2	85.4	-171.7	0	0	0	0	0	113	T189	A187-T189 PolarHBondContact O-N 2.95Å
188	S	41.7	Very low	59.2	Low	109 Å²	109	86 Å²	86	76%	0.762	56%	0.563	S	S	*	*			trans	-76.2	113.9	162.1	60.3	0	0	0	0	109.4	G186	G186-S188 PolarHBondContact O-N 3.22Å
189	T	50.7	Low	62.1	Low	127 Å²	127	77 Å²	77	78%	0.779	52%	0.522	S	S	*	.			trans	-44.9	142.6	161.1	44.2	0	0	0	0	110.5	A187 G191	A187-T189 PolarHBondContact O-N 2.95Å; T189-G191 WeakPolarHBondContact O-CA 3.3Å; T189-G191 PolarHBondContact O-N 3Å
190	S	52.5	Low	64.7	Low	114 Å²	114	68.6 Å²	68.6	80%	0.797	49%	0.491	S	S	*	.			trans	-52	99.1	-177.1	32.4	0	0	0	0	111.5	V192	S190-V192 VanDerWaalsContact C-N 3.34Å; S190-V192 PolarHBondContact O-N 3.16Å
191	G	65.9	Low	67.4	Low	42 Å²	42	64.8 Å²	64.8	43%	0.433	46%	0.46	S	S	.	.			trans	-77.9	75.2	-160.3	0	0	0	0	0	113.9	T189 D193	T189-G191 WeakPolarHBondContact O-CA 3.3Å; T189-G191 PolarHBondContact O-N 3Å; G191-D193 PolarHBondContact O-N 2.74Å
192	V	82.2	Confident	70	Confident	54 Å²	54	62.8 Å²	62.8	33%	0.327	44%	0.435	S	S	.	.			trans	-64.4	114.3	167.6	179.1	0	0	0	0	108.5	T170 S190 V194	T170-V192 VanDerWaalsContact CB-CG1 3.45Å; T170-V192 HydrophobicContact CG2-CG1 3.51Å; S190-V192 VanDerWaalsContact C-N 3.34Å; S190-V192 PolarHBondContact O-N 3.16Å; V192-V194 PolarHBondContact O-N 3.31Å
193	D	89.3	Confident	72.8	Confident	35 Å²	35	60 Å²	60	19%	0.187	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	118	175.5	-72.1	-31.9	0	0	0	108.2	L138 A171 R176 G191 F195	L138-D193 HydrophobicContact CD1-CB 3.94Å; A171-D193 PolarHBondContact N-O 2.88Å; A171-D193 PolarHBondContact O-N 2.85Å; R176-D193 IonicContact CZ-OD1 3.43Å; R176-D193 IonicContact CZ-OD2 2.67Å; R176-D193 IonicContact NH1-OD1 2.83Å; R176-D193 PolarHBondContact NH1-OD1 3.37Å; R176-D193 IonicContact NH1-OD2 2.68Å; R176-D193 PolarHBondContact NH1-OD2 2.78Å; R176-D193 VanDerWaalsContact NH1-OD2 3.1Å; R176-D193 IonicContact NH2-OD1 3.17Å; R176-D193 PolarHBondContact NH2-OD1 2.98Å; R176-D193 IonicContact NH2-OD2 3.92Å; R176-D193 PolarHBondContact NH2-OD2 3.32Å; G191-D193 PolarHBondContact O-N 2.74Å; D193-F195 HydrophobicContact CB-CE2 3.66Å; D193-F195 HydrophobicContact CB-CZ 4.11Å
194	V	92.6	Very high	75.5	Confident	16 Å²	16	60.9 Å²	60.9	10%	0.097	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137	175.8	-177.7	0	0	0	0	109.4	Q139 P141 Y168 T170 V192 Y452	Q139-V194 HydrophobicContact CB-CG1 4.3Å; Q139-V194 PolarHBondContact N-O 3.19Å; P141-V194 HydrophobicContact CG-CB 4.27Å; P141-V194 HydrophobicContact CG-CG2 3.88Å; Y168-V194 HydrophobicContact CD1-CG1 4.29Å; T170-V194 HydrophobicContact CG2-CG2 4.49Å; V192-V194 PolarHBondContact O-N 3.31Å; V194-Y452 HydrophobicContact CG2-CE2 4.07Å
195	F	94.9	Very high	78.2	Confident	31 Å²	31	50.7 Å²	50.7	14%	0.136	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.5	176.2	-64.4	-94.9	0	0	0	110.6	R136 V137 L138 Y168 S169 A171 D193	R136-F195 HydrophobicContact CG-CB 4.15Å; R136-F195 HydrophobicContact CG-CD1 3.92Å; R136-F195 HydrophobicContact CG-CG 4.33Å; R136-F195 VanDerWaalsContact NE-CD1 3.26Å; R136-F195 VanDerWaalsContact NH2-CZ 3.25Å; V137-F195 CarbonylContact O-C 3.6Å; V137-F195 VanDerWaalsContact O-CA 3.25Å; V137-F195 WeakPolarHBondContact O-CA 3.5Å; L138-F195 HydrophobicContact CB-CD1 4.46Å; L138-F195 HydrophobicContact CB-CE1 4.27Å; L138-F195 HydrophobicContact CD1-CD1 4.33Å; L138-F195 HydrophobicContact CD1-CE1 3.85Å; L138-F195 HydrophobicContact CD1-CE2 4.25Å; L138-F195 HydrophobicContact CD1-CZ 3.8Å; Y168-F195 CarbonylContact C-O 3.56Å; Y168-F195 VanDerWaalsContact CA-O 3.25Å; Y168-F195 WeakPolarHBondContact CA-O 3.47Å; S169-F195 PolarHBondContact N-O 3.05Å; S169-F195 PolarHBondContact O-N 2.89Å; A171-F195 HydrophobicContact CB-CD2 4.33Å; A171-F195 HydrophobicContact CB-CE2 3.77Å; D193-F195 HydrophobicContact CB-CE2 3.66Å; D193-F195 HydrophobicContact CB-CZ 4.11Å
196	L	96	Very high	81.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	136.3	165.8	171.3	64	0	0	0	108.4	R136 V137 Q139 N145 L148 Y166 Y168 L198	R136-L196 WeakPolarHBondContact CA-O 3.46Å; V137-L196 HydrophobicContact CG2-CB 3.94Å; V137-L196 HydrophobicContact CG2-CD2 4.33Å; V137-L196 HydrophobicContact CG2-CG 4.35Å; V137-L196 PolarHBondContact N-O 2.74Å; V137-L196 PolarHBondContact O-N 3.14Å; Q139-L196 HydrophobicContact CB-CB 4.2Å; N145-L196 HydrophobicContact CB-CD2 3.85Å; N145-L196 WeakPolarHBondContact ND2-CD2 3.46Å; L148-L196 HydrophobicContact CB-CD2 4.2Å; L148-L196 HydrophobicContact CD2-CD2 4.27Å; Y166-L196 HydrophobicContact CD2-CD1 3.87Å; Y166-L196 HydrophobicContact CG-CD1 4.42Å; Y168-L196 HydrophobicContact CD1-CB 4.11Å; Y168-L196 HydrophobicContact CD1-CD1 4.14Å; Y168-L196 HydrophobicContact CE1-CB 3.88Å; Y168-L196 HydrophobicContact CE1-CD1 3.64Å; Y168-L196 HydrophobicContact CE1-CG 4.25Å; L196-L198 HydrophobicContact CD1-CD2 4.18Å; L196-L198 HydrophobicContact CD2-CD2 3.99Å; L196-L198 HydrophobicContact CG-CD2 4.02Å; L196-L198 HydrophobicContact CG-CG 4.46Å
197	H	96.9	Very high	84	Confident	16 Å²	16	43 Å²	43	7%	0.074	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.5	172.9	-60.3	-110.7	0	0	0	109	V134 K135 Y166 Y167 S169	V134-H197 HydrophobicContact CG1-CB 4.11Å; K135-H197 WeakPolarHBondContact O-CA 3.43Å; Y166-H197 VanDerWaalsContact CA-O 3.22Å; Y166-H197 WeakPolarHBondContact CA-O 3.25Å; Y166-H197 WeakPolarHBondContact CB-O 3.29Å; Y167-H197 HydrophobicContact CD1-CB 3.87Å; Y167-H197 HydrophobicContact CD2-CB 4Å; Y167-H197 AromaticContact CD2-CD2 3.75Å; Y167-H197 AromaticContact CD2-CG 3.98Å; Y167-H197 HydrophobicContact CE1-CB 3.51Å; Y167-H197 HydrophobicContact CE2-CB 3.65Å; Y167-H197 AromaticContact CE2-CD2 3.39Å; Y167-H197 WeakPolarHBondContact CE2-CD2 3.44Å; Y167-H197 AromaticContact CE2-CE1 3.99Å; Y167-H197 AromaticContact CE2-CG 3.37Å; Y167-H197 AromaticContact CE2-ND1 3.79Å; Y167-H197 AromaticContact CE2-NE2 3.79Å; Y167-H197 HydrophobicContact CG-CB 4.1Å; Y167-H197 AromaticContact CZ-CD2 3.99Å; Y167-H197 AromaticContact CZ-CG 3.45Å; Y167-H197 VanDerWaalsContact CZ-CG 3.45Å; Y167-H197 AromaticContact CZ-ND1 3.69Å; Y167-H197 PolarHBondContact N-O 3.04Å; Y167-H197 VanDerWaalsContact N-O 3.1Å; Y167-H197 PolarHBondContact O-N 3.4Å; Y167-H197 PolarHBondContact OH-ND1 2.74Å; S169-H197 PolarHBondContact OG-NE2 3.33Å
198	L	97.1	Very high	86.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.8	174.4	-55.1	177.1	0	0	0	108.5	V134 K135 E147 L148 M151 F163 L196 L200	V134-L198 WeakPolarHBondContact CA-O 3.25Å; K135-L198 HydrophobicContact CB-CB 4.46Å; K135-L198 PolarHBondContact N-O 3.13Å; K135-L198 PolarHBondContact O-N 2.84Å; E147-L198 HydrophobicContact CG-CD1 4.03Å; L148-L198 HydrophobicContact CD1-CD2 3.94Å; M151-L198 HydrophobicContact SD-CD1 4.2Å; F163-L198 HydrophobicContact CE2-CB 4.22Å; F163-L198 HydrophobicContact CE2-CD2 3.82Å; F163-L198 HydrophobicContact CZ-CD2 3.82Å; L196-L198 HydrophobicContact CD1-CD2 4.18Å; L196-L198 HydrophobicContact CD2-CD2 3.99Å; L196-L198 HydrophobicContact CG-CD2 4.02Å; L196-L198 HydrophobicContact CG-CG 4.46Å; L198-L200 HydrophobicContact CB-CD2 4.19Å; L198-L200 HydrophobicContact CB-CG 4.26Å
199	V	97.6	Very high	89.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	106.4	177.5	-173.2	0	0	0	0	108.6	I82 L84 L103 V132 Y164 Y165 Y167	I82-V199 HydrophobicContact CD1-CG2 4.14Å; L84-V199 HydrophobicContact CD1-CG2 4.46Å; L84-V199 HydrophobicContact CD2-CG1 4.47Å; L103-V199 HydrophobicContact CD2-CG1 4.36Å; V132-V199 HydrophobicContact CB-CG1 3.81Å; V132-V199 HydrophobicContact CG1-CG1 3.96Å; V132-V199 HydrophobicContact CG2-CG1 3.83Å; Y164-V199 PolarHBondContact N-O 3.46Å; Y165-V199 WeakPolarHBondContact O-CA 3.19Å; Y165-V199 VanDerWaalsContact O-CB 3.28Å; Y165-V199 WeakPolarHBondContact O-CB 3.48Å; Y165-V199 PolarHBondContact O-N 2.93Å; Y167-V199 HydrophobicContact CD1-CG2 4.21Å; Y167-V199 HydrophobicContact CE1-CG2 3.91Å
200	L	97.4	Very high	91.8	Very high	14 Å²	14	33.6 Å²	33.6	7%	0.073	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	161.9	-170.8	-54.3	179.8	0	0	0	111.7	V132 A133 K135 M151 V161 K162 F163 L198 C202	V132-L200 CarbonylContact C-O 3.53Å; V132-L200 WeakPolarHBondContact CA-O 3.41Å; V132-L200 VanDerWaalsContact CB-O 3.25Å; V132-L200 WeakPolarHBondContact CB-O 3.41Å; A133-L200 HydrophobicContact CB-CB 4.49Å; A133-L200 PolarHBondContact N-O 3.27Å; A133-L200 WeakPolarHBondContact O-CB 3.43Å; A133-L200 PolarHBondContact O-N 2.94Å; K135-L200 HydrophobicContact CB-CD1 4.43Å; M151-L200 HydrophobicContact CE-CD1 4.19Å; M151-L200 HydrophobicContact CE-CD2 3.52Å; M151-L200 HydrophobicContact SD-CD2 4.32Å; V161-L200 HydrophobicContact CG2-CB 4.42Å; K162-L200 CarbonylContact O-C 3.32Å; K162-L200 WeakPolarHBondContact O-CA 3.37Å; F163-L200 HydrophobicContact CB-CD2 3.9Å; F163-L200 HydrophobicContact CD2-CD2 3.69Å; F163-L200 HydrophobicContact CG-CD2 4.1Å; L198-L200 HydrophobicContact CB-CD2 4.19Å; L198-L200 HydrophobicContact CB-CG 4.26Å; L200-C202 PolarHBondContact O-N 3.47Å
201	E	96.2	Very high	94	Very high	36 Å²	36	28.5 Å²	28.5	17%	0.168	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	126.8	168.1	-169	175.4	-160.1	0	0	111.9	V161 K162 Y164 F203 K265	V161-E201 HydrophobicContact CG2-CB 3.86Å; K162-E201 HydrophobicContact CB-CB 4.06Å; K162-E201 WeakPolarHBondContact CB-OE2 3.44Å; K162-E201 PolarHBondContact N-OE2 2.97Å; K162-E201 PolarHBondContact O-N 3.26Å; Y164-E201 HydrophobicContact CE2-CB 4.05Å; E201-F203 HydrophobicContact CG-CD2 4.14Å; E201-F203 HydrophobicContact CG-CE2 3.92Å; E201-K265 WeakPolarHBondContact OE1-CE 3.5Å; E201-K265 IonicContact OE1-NZ 3.6Å; E201-K265 PolarHBondContact OE1-NZ 2.96Å; E201-K265 VanDerWaalsContact OE2-CD 3.3Å; E201-K265 WeakPolarHBondContact OE2-CD 3.44Å; E201-K265 WeakPolarHBondContact OE2-CE 3.31Å; E201-K265 IonicContact OE2-NZ 3.24Å; E201-K265 PolarHBondContact OE2-NZ 3.27Å
202	C	95.6	Very high	95.5	Very high	30 Å²	30	31.2 Å²	31.2	20%	0.203	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-89.2	128.8	173.6	-165.4	0	0	0	0	110.2	Q131 L200	Q131-C202 HydrophobicContact CB-CB 4.07Å; Q131-C202 WeakPolarHBondContact O-CB 3.39Å; Q131-C202 PolarHBondContact O-N 2.9Å; L200-C202 PolarHBondContact O-N 3.47Å
203	F	94.9	Very high	96.2	Very high	34 Å²	34	31.2 Å²	31.2	15%	0.149	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-101.5	163.2	172	-96.7	-115.2	0	0	0	111.5	E201 L256 N258 V263 K265	E201-F203 HydrophobicContact CG-CD2 4.14Å; E201-F203 HydrophobicContact CG-CE2 3.92Å; F203-L256 HydrophobicContact CB-CB 3.74Å; F203-L256 HydrophobicContact CB-CD1 4.14Å; F203-L256 HydrophobicContact CB-CD2 4.28Å; F203-L256 HydrophobicContact CB-CG 4.27Å; F203-L256 HydrophobicContact CD1-CB 3.7Å; F203-L256 HydrophobicContact CD2-CB 4.11Å; F203-L256 HydrophobicContact CD2-CD1 4.08Å; F203-L256 HydrophobicContact CE1-CB 4.37Å; F203-L256 HydrophobicContact CG-CB 3.56Å; F203-L256 HydrophobicContact CG-CD1 4.18Å; F203-L256 HydrophobicContact CG-CG 4.41Å; F203-N258 HydrophobicContact CD1-CB 4.26Å; F203-N258 HydrophobicContact CE1-CB 4.08Å; F203-V263 HydrophobicContact CE1-CG1 4.26Å; F203-V263 HydrophobicContact CZ-CG1 3.99Å; F203-K265 HydrophobicContact CE1-CG 4.39Å; F203-K265 HydrophobicContact CE2-CD 3.69Å; F203-K265 HydrophobicContact CE2-CG 4.04Å; F203-K265 HydrophobicContact CZ-CB 4.31Å; F203-K265 HydrophobicContact CZ-CD 3.68Å; F203-K265 HydrophobicContact CZ-CG 3.62Å
204	P	94.2	Very high	96.6	Very high	90 Å²	90	31 Å²	31	58%	0.584	16%	0.155	S	C	*	.	S	Bend	trans	-75.1	-36	179.7	29.6	-33.7	0	0	0	113	V257 N258	P204-V257 WeakPolarHBondContact CG-O 3.4Å; P204-N258 HydrophobicContact CG-CB 3.94Å
205	E	95	Very high	96.7	Very high	33 Å²	33	32 Å²	32	15%	0.154	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	165.4	177.1	76.2	-162.5	134.9	0	0	111.7	E209 L210 R213 V257	E205-E209 HydrophobicContact CB-CB 4.11Å; E205-L210 HydrophobicContact CG-CB 4.38Å; E205-R213 VanDerWaalsContact CD-NH2 3.34Å; E205-R213 IonicContact OE1-CZ 2.89Å; E205-R213 IonicContact OE1-NE 2.68Å; E205-R213 IonicContact OE1-NH2 3.13Å; E205-R213 PolarHBondContact OE1-NH2 3.07Å; E205-R213 IonicContact OE2-CZ 3.4Å; E205-R213 IonicContact OE2-NE 2.75Å; E205-R213 PolarHBondContact OE2-NE 3.42Å; E205-R213 IonicContact OE2-NH2 2.68Å; E205-R213 PolarHBondContact OE2-NH2 3.17Å; E205-V257 HydrophobicContact CG-CG2 3.63Å; E205-V257 PolarHBondContact O-N 3.46Å; E205-V257 VanDerWaalsContact O-O 3.12Å
206	S	97.5	Very high	96.8	Very high	11 Å²	11	35.2 Å²	35.2	8%	0.077	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	159.6	164.2	64.1	0	0	0	0	111.7	C208 E209 L210 L255	S206-C208 PolarHBondContact O-N 2.89Å; S206-E209 WeakPolarHBondContact CB-OE2 3.46Å; S206-E209 PolarHBondContact N-OE2 2.84Å; S206-E209 WeakPolarHBondContact O-CB 3.42Å; S206-E209 PolarHBondContact O-N 2.91Å; S206-E209 WeakPolarHBondContact OG-CG 3.45Å; S206-E209 PolarHBondContact OG-N 2.78Å; S206-E209 PolarHBondContact OG-OE2 2.89Å; S206-L210 PolarHBondContact O-N 2.89Å; S206-L255 CarbonylContact C-O 3.55Å; S206-L255 WeakPolarHBondContact CA-O 3.28Å
207	L	98.5	Very high	96.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-31.1	176	-178.8	62	0	0	0	111.7	L210 I211 F229 S252 L255 V257 V314 M318	L207-L210 HydrophobicContact CD1-CD2 4.3Å; L207-L210 PolarHBondContact O-N 2.85Å; L207-I211 HydrophobicContact CD1-CD1 4.28Å; L207-I211 HydrophobicContact CD1-CG1 4.36Å; L207-I211 HydrophobicContact CG-CD1 3.84Å; L207-I211 HydrophobicContact CG-CG1 4.41Å; L207-I211 WeakPolarHBondContact O-CB 3.47Å; L207-I211 WeakPolarHBondContact O-CD1 3.41Å; L207-I211 WeakPolarHBondContact O-CG1 3.35Å; L207-I211 PolarHBondContact O-N 2.8Å; L207-F229 HydrophobicContact CD1-CD2 4.08Å; L207-S252 WeakPolarHBondContact CB-O 3.5Å; L207-S252 PolarHBondContact N-O 3.34Å; L207-L255 HydrophobicContact CB-CB 4.05Å; L207-L255 HydrophobicContact CD2-CB 4.32Å; L207-L255 HydrophobicContact CD2-CD1 3.91Å; L207-L255 PolarHBondContact N-O 3.15Å; L207-V257 HydrophobicContact CB-CG1 3.97Å; L207-V257 HydrophobicContact CD1-CG1 4.25Å; L207-V314 HydrophobicContact CD2-CG1 3.63Å; L207-M318 HydrophobicContact CD1-CG 4.1Å; L207-M318 HydrophobicContact CD1-SD 3.83Å; L207-M318 HydrophobicContact CD2-CE 4.43Å; L207-M318 HydrophobicContact CD2-CG 4.08Å; L207-M318 HydrophobicContact CD2-SD 3.83Å; L207-M318 HydrophobicContact CG-CG 4.38Å; L207-M318 HydrophobicContact CG-SD 4.38Å
208	C	97.7	Very high	96.7	Very high	41 Å²	41	48.8 Å²	48.8	28%	0.277	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-46.8	171.5	179.8	0	0	0	0	111.8	S206 I211 Y212 S252	S206-C208 PolarHBondContact O-N 2.89Å; C208-I211 PolarHBondContact O-N 2.88Å; C208-Y212 WeakPolarHBondContact O-CB 3.29Å; C208-Y212 PolarHBondContact O-N 3.49Å; C208-S252 PolarHBondContact N-O 2.98Å
209	E	97.4	Very high	96.6	Very high	109 Å²	109	53.1 Å²	53.1	51%	0.509	26%	0.261	S	S	.	.	H	α-helix	trans	-66.7	-37.6	176.8	-71.3	160.8	120.1	0	0	111.8	E205 S206 Y212 R213	E205-E209 HydrophobicContact CB-CB 4.11Å; S206-E209 WeakPolarHBondContact CB-OE2 3.46Å; S206-E209 PolarHBondContact N-OE2 2.84Å; S206-E209 WeakPolarHBondContact O-CB 3.42Å; S206-E209 PolarHBondContact O-N 2.91Å; S206-E209 WeakPolarHBondContact OG-CG 3.45Å; S206-E209 PolarHBondContact OG-N 2.78Å; S206-E209 PolarHBondContact OG-OE2 2.89Å; E209-Y212 PolarHBondContact O-N 3.17Å; E209-R213 WeakPolarHBondContact O-CB 3.4Å; E209-R213 PolarHBondContact O-N 3.11Å
210	L	98	Very high	96.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-47.4	173.1	-174	150.9	0	0	0	111.6	E205 S206 L207 Y212 R213 Y214 I221 F229 V257 E259	E205-L210 HydrophobicContact CG-CB 4.38Å; S206-L210 PolarHBondContact O-N 2.89Å; L207-L210 HydrophobicContact CD1-CD2 4.3Å; L207-L210 PolarHBondContact O-N 2.85Å; L210-Y212 VanDerWaalsContact C-N 3.33Å; L210-Y212 PolarHBondContact O-N 2.79Å; L210-R213 WeakPolarHBondContact O-CB 3.49Å; L210-R213 PolarHBondContact O-N 2.88Å; L210-Y214 HydrophobicContact CD2-CD2 3.72Å; L210-Y214 HydrophobicContact CD2-CE2 3.87Å; L210-Y214 HydrophobicContact CG-CD2 4.1Å; L210-Y214 HydrophobicContact CG-CE2 4.13Å; L210-Y214 WeakPolarHBondContact O-CD2 3.08Å; L210-Y214 PolarHBondContact O-N 3.48Å; L210-I221 HydrophobicContact CD2-CD1 3.79Å; L210-I221 HydrophobicContact CD2-CG1 4.08Å; L210-I221 HydrophobicContact CD2-CG2 4.42Å; L210-F229 HydrophobicContact CD1-CE2 3.79Å; L210-F229 HydrophobicContact CD1-CZ 4.31Å; L210-V257 HydrophobicContact CB-CG2 4.1Å; L210-V257 HydrophobicContact CD1-CG2 3.82Å; L210-E259 HydrophobicContact CD1-CB 4.26Å
211	I	98.2	Very high	96.4	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-46.8	177.1	-71.2	158.8	0	0	0	110.4	L207 C208 Y214 S215 I221 E317 M318 Q321	L207-I211 HydrophobicContact CD1-CD1 4.28Å; L207-I211 HydrophobicContact CD1-CG1 4.36Å; L207-I211 HydrophobicContact CG-CD1 3.84Å; L207-I211 HydrophobicContact CG-CG1 4.41Å; L207-I211 WeakPolarHBondContact O-CB 3.47Å; L207-I211 WeakPolarHBondContact O-CD1 3.41Å; L207-I211 WeakPolarHBondContact O-CG1 3.35Å; L207-I211 PolarHBondContact O-N 2.8Å; C208-I211 PolarHBondContact O-N 2.88Å; I211-Y214 PolarHBondContact O-N 3.49Å; I211-S215 WeakPolarHBondContact O-CB 3.5Å; I211-S215 PolarHBondContact O-N 3.38Å; I211-I221 HydrophobicContact CB-CD1 4.49Å; I211-I221 HydrophobicContact CG1-CD1 3.72Å; I211-E317 HydrophobicContact CD1-CG 4.01Å; I211-M318 HydrophobicContact CD1-CG 4.05Å; I211-M318 HydrophobicContact CG1-CG 4.38Å; I211-Q321 HydrophobicContact CG2-CB 4.22Å
212	Y	97.5	Very high	96.3	Very high	100 Å²	100	59.4 Å²	59.4	39%	0.392	29%	0.293	S	S	.	.	H	α-helix	trans	-61.5	-45.2	175.2	-178.1	-104.8	0	0	0	112	C208 E209 L210 Y214 S215 Q216	C208-Y212 WeakPolarHBondContact O-CB 3.29Å; C208-Y212 PolarHBondContact O-N 3.49Å; E209-Y212 PolarHBondContact O-N 3.17Å; L210-Y212 VanDerWaalsContact C-N 3.33Å; L210-Y212 PolarHBondContact O-N 2.79Å; Y212-Y214 VanDerWaalsContact C-N 3.34Å; Y212-Y214 PolarHBondContact O-N 3.39Å; Y212-S215 PolarHBondContact O-N 2.66Å; Y212-S215 VanDerWaalsContact O-N 3.14Å; Y212-Q216 HydrophobicContact CD1-CG 3.99Å; Y212-Q216 HydrophobicContact CD2-CG 4.11Å; Y212-Q216 HydrophobicContact CE1-CG 3.63Å; Y212-Q216 HydrophobicContact CE2-CG 3.75Å; Y212-Q216 VanDerWaalsContact CE2-NE2 3.3Å; Y212-Q216 HydrophobicContact CG-CG 4.23Å; Y212-Q216 VanDerWaalsContact CZ-CG 3.49Å; Y212-Q216 WeakPolarHBondContact O-CB 3.18Å; Y212-Q216 VanDerWaalsContact O-CG 3.31Å; Y212-Q216 WeakPolarHBondContact O-CG 3.35Å; Y212-Q216 PolarHBondContact O-N 3.25Å
213	R	97.4	Very high	96.2	Very high	54 Å²	54	60.1 Å²	60.1	20%	0.204	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-39.9	177.9	173	170.4	63.2	85.4	-21.2	112.7	E205 E209 L210 R217 E259	E205-R213 VanDerWaalsContact CD-NH2 3.34Å; E205-R213 IonicContact OE1-CZ 2.89Å; E205-R213 IonicContact OE1-NE 2.68Å; E205-R213 IonicContact OE1-NH2 3.13Å; E205-R213 PolarHBondContact OE1-NH2 3.07Å; E205-R213 IonicContact OE2-CZ 3.4Å; E205-R213 IonicContact OE2-NE 2.75Å; E205-R213 PolarHBondContact OE2-NE 3.42Å; E205-R213 IonicContact OE2-NH2 2.68Å; E205-R213 PolarHBondContact OE2-NH2 3.17Å; E209-R213 WeakPolarHBondContact O-CB 3.4Å; E209-R213 PolarHBondContact O-N 3.11Å; L210-R213 WeakPolarHBondContact O-CB 3.49Å; L210-R213 PolarHBondContact O-N 2.88Å; R213-R217 WeakPolarHBondContact O-CD 3.37Å; R213-R217 VanDerWaalsContact O-CG 3.31Å; R213-R217 WeakPolarHBondContact O-CG 3.5Å; R213-R217 PolarHBondContact O-N 3.27Å; R213-E259 IonicContact CZ-OE2 2.71Å; R213-E259 IonicContact NH1-OE2 2.74Å; R213-E259 PolarHBondContact NH1-OE2 3.18Å; R213-E259 IonicContact NH2-OE2 2.65Å; R213-E259 PolarHBondContact NH2-OE2 3.23Å
214	Y	97.2	Very high	96.2	Very high	30 Å²	30	58.8 Å²	58.8	12%	0.118	30%	0.296	C	S	.	.	H	α-helix	trans	-70.7	-43.9	172.6	-89.2	-89.7	0	0	0	111.9	L210 I211 Y212 Q216 R217 N218 L219 K220 I221 P222 E259	L210-Y214 HydrophobicContact CD2-CD2 3.72Å; L210-Y214 HydrophobicContact CD2-CE2 3.87Å; L210-Y214 HydrophobicContact CG-CD2 4.1Å; L210-Y214 HydrophobicContact CG-CE2 4.13Å; L210-Y214 WeakPolarHBondContact O-CD2 3.08Å; L210-Y214 PolarHBondContact O-N 3.48Å; I211-Y214 PolarHBondContact O-N 3.49Å; Y212-Y214 VanDerWaalsContact C-N 3.34Å; Y212-Y214 PolarHBondContact O-N 3.39Å; Y214-Q216 PolarHBondContact O-N 3.24Å; Y214-R217 PolarHBondContact O-N 3.01Å; Y214-N218 PolarHBondContact O-N 3.28Å; Y214-L219 CarbonylContact C-O 3.59Å; Y214-L219 HydrophobicContact CD1-CB 3.83Å; Y214-L219 HydrophobicContact CE1-CB 4.43Å; Y214-L219 PolarHBondContact O-N 2.71Å; Y214-L219 VanDerWaalsContact O-N 3.07Å; Y214-L219 VanDerWaalsContact O-O 3.12Å; Y214-K220 WeakPolarHBondContact CD1-O 3.04Å; Y214-K220 WeakPolarHBondContact CE1-O 3.45Å; Y214-I221 HydrophobicContact CD1-CG1 4.25Å; Y214-I221 HydrophobicContact CD2-CG1 3.87Å; Y214-I221 HydrophobicContact CE2-CG1 4.42Å; Y214-I221 HydrophobicContact CG-CG1 3.76Å; Y214-P222 WeakPolarHBondContact OH-CD 3.4Å; Y214-E259 VanDerWaalsContact CE2-OE1 3.26Å; Y214-E259 WeakPolarHBondContact CE2-OE1 3.47Å; Y214-E259 PolarHBondContact OH-OE1 3.13Å
215	S	95.7	Very high	96.3	Very high	36 Å²	36	54.5 Å²	54.5	25%	0.252	27%	0.268	S	S	.	.	H	α-helix	trans	-60.9	-43.7	179	-170.9	0	0	0	0	112.5	I211 Y212 R217 N218	I211-S215 WeakPolarHBondContact O-CB 3.5Å; I211-S215 PolarHBondContact O-N 3.38Å; Y212-S215 PolarHBondContact O-N 2.66Å; Y212-S215 VanDerWaalsContact O-N 3.14Å; S215-R217 PolarHBondContact O-N 2.85Å; S215-N218 PolarHBondContact O-N 3.03Å
216	Q	96.3	Very high	96.4	Very high	99 Å²	99	53 Å²	53	46%	0.463	26%	0.262	S	S	.	.	H	α-helix	trans	-66.8	-23.6	178.3	-70.2	-63.8	-50.5	0	0	113.1	Y212 Y214 N218 G514	Y212-Q216 HydrophobicContact CD1-CG 3.99Å; Y212-Q216 HydrophobicContact CD2-CG 4.11Å; Y212-Q216 HydrophobicContact CE1-CG 3.63Å; Y212-Q216 HydrophobicContact CE2-CG 3.75Å; Y212-Q216 VanDerWaalsContact CE2-NE2 3.3Å; Y212-Q216 HydrophobicContact CG-CG 4.23Å; Y212-Q216 VanDerWaalsContact CZ-CG 3.49Å; Y212-Q216 WeakPolarHBondContact O-CB 3.18Å; Y212-Q216 VanDerWaalsContact O-CG 3.31Å; Y212-Q216 WeakPolarHBondContact O-CG 3.35Å; Y212-Q216 PolarHBondContact O-N 3.25Å; Y214-Q216 PolarHBondContact O-N 3.24Å; Q216-N218 VanDerWaalsContact C-N 3.33Å; Q216-G514 PolarHBondContact NE2-O 3.04Å
217	R	96.6	Very high	96.4	Very high	161 Å²	161	53.2 Å²	53.2	61%	0.608	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-1.4	173.7	-68.1	174.9	-179	-177	1.2	113.1	R213 Y214 S215 L219	R213-R217 WeakPolarHBondContact O-CD 3.37Å; R213-R217 VanDerWaalsContact O-CG 3.31Å; R213-R217 WeakPolarHBondContact O-CG 3.5Å; R213-R217 PolarHBondContact O-N 3.27Å; Y214-R217 PolarHBondContact O-N 3.01Å; S215-R217 PolarHBondContact O-N 2.85Å; R217-L219 HydrophobicContact CB-CB 4.37Å; R217-L219 HydrophobicContact CB-CD1 3.97Å; R217-L219 HydrophobicContact CB-CG 3.95Å; R217-L219 PolarHBondContact O-N 3.37Å
218	N	94.7	Very high	96.3	Very high	140 Å²	140	53.2 Å²	53.2	75%	0.749	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	32.9	-168.7	-163.9	30.9	0	0	0	113.4	Y214 S215 Q216	Y214-N218 PolarHBondContact O-N 3.28Å; S215-N218 PolarHBondContact O-N 3.03Å; Q216-N218 VanDerWaalsContact C-N 3.33Å
219	L	95	Very high	96.3	Very high	91 Å²	91	51.2 Å²	51.2	48%	0.476	25%	0.248	S	C	.	.			trans	-106.6	150.1	176.8	-64.9	177.2	0	0	0	109.7	Y214 R217 Q321	Y214-L219 CarbonylContact C-O 3.59Å; Y214-L219 HydrophobicContact CD1-CB 3.83Å; Y214-L219 HydrophobicContact CE1-CB 4.43Å; Y214-L219 PolarHBondContact O-N 2.71Å; Y214-L219 VanDerWaalsContact O-N 3.07Å; Y214-L219 VanDerWaalsContact O-O 3.12Å; R217-L219 HydrophobicContact CB-CB 4.37Å; R217-L219 HydrophobicContact CB-CD1 3.97Å; R217-L219 HydrophobicContact CB-CG 3.95Å; R217-L219 PolarHBondContact O-N 3.37Å; L219-Q321 PolarHBondContact O-NE2 2.8Å
220	K	94.2	Very high	96.4	Very high	118 Å²	118	46 Å²	46	51%	0.513	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-88.8	145	169.2	-58.7	-51.5	179	-174.6	0	110.4	Y214	Y214-K220 WeakPolarHBondContact CD1-O 3.04Å; Y214-K220 WeakPolarHBondContact CE1-O 3.45Å
221	I	95.7	Very high	96.4	Very high	14 Å²	14	47.1 Å²	47.1	7%	0.072	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-63.5	130	170.3	-57.5	172.7	0	0	0	107.3	L210 I211 Y214 A223 T225 V226 M318	L210-I221 HydrophobicContact CD2-CD1 3.79Å; L210-I221 HydrophobicContact CD2-CG1 4.08Å; L210-I221 HydrophobicContact CD2-CG2 4.42Å; I211-I221 HydrophobicContact CB-CD1 4.49Å; I211-I221 HydrophobicContact CG1-CD1 3.72Å; Y214-I221 HydrophobicContact CD1-CG1 4.25Å; Y214-I221 HydrophobicContact CD2-CG1 3.87Å; Y214-I221 HydrophobicContact CE2-CG1 4.42Å; Y214-I221 HydrophobicContact CG-CG1 3.76Å; I221-A223 PolarHBondContact O-N 3.25Å; I221-T225 HydrophobicContact CG2-CG2 3.95Å; I221-V226 HydrophobicContact CB-CG2 4.09Å; I221-V226 HydrophobicContact CG2-CG2 3.69Å; I221-M318 HydrophobicContact CD1-CB 4.44Å
222	P	94.6	Very high	96.4	Very high	51 Å²	51	47 Å²	47	33%	0.331	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-58.5	137.8	179.2	-24.4	33.7	0	0	0	111.6	Y214 C224 T225 V226	Y214-P222 WeakPolarHBondContact OH-CD 3.4Å; P222-C224 PolarHBondContact O-N 3.19Å; P222-C224 VanDerWaalsContact O-N 3.15Å; P222-T225 WeakPolarHBondContact O-CA 3.49Å; P222-T225 WeakPolarHBondContact O-CB 3.38Å; P222-T225 PolarHBondContact O-N 3.03Å; P222-V226 PolarHBondContact O-N 3.44Å
223	A	94.1	Very high	96.5	Very high	45 Å²	45	42.2 Å²	42.2	37%	0.372	21%	0.208	S	C	.	.	H	α-helix	trans	-55.1	-36.9	-178.5	0	0	0	0	0	112.7	I221 V226 K227 P378	I221-A223 PolarHBondContact O-N 3.25Å; A223-V226 PolarHBondContact O-N 2.96Å; A223-K227 WeakPolarHBondContact O-CG 3.49Å; A223-K227 PolarHBondContact O-N 3.28Å; A223-P378 HydrophobicContact CB-CG 3.8Å
224	C	94	Very high	96.5	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.034	20%	0.199	C	C	.	.	H	α-helix	trans	-61.1	-42.8	173.2	-177.4	0	0	0	0	112.7	P222 K227 V228 L420	P222-C224 PolarHBondContact O-N 3.19Å; P222-C224 VanDerWaalsContact O-N 3.15Å; C224-K227 PolarHBondContact O-N 3.25Å; C224-V228 WeakPolarHBondContact O-CG2 3.44Å; C224-V228 PolarHBondContact O-N 3.37Å; C224-L420 WeakPolarHBondContact SG-CD2 3.43Å
225	T	96	Very high	96.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-43.3	175	-51.8	0	0	0	0	111	I221 P222 K227 V228 F229 M262	I221-T225 HydrophobicContact CG2-CG2 3.95Å; P222-T225 WeakPolarHBondContact O-CA 3.49Å; P222-T225 WeakPolarHBondContact O-CB 3.38Å; P222-T225 PolarHBondContact O-N 3.03Å; T225-K227 PolarHBondContact O-N 3.14Å; T225-V228 PolarHBondContact O-N 3.35Å; T225-F229 HydrophobicContact CG2-CD2 3.73Å; T225-F229 HydrophobicContact CG2-CE2 3.36Å; T225-F229 HydrophobicContact CG2-CZ 4.03Å; T225-F229 PolarHBondContact O-N 2.69Å; T225-M262 HydrophobicContact CG2-CE 4.27Å; T225-M262 HydrophobicContact CG2-SD 4.16Å
226	V	97.4	Very high	96.7	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-45.7	174.5	-175.4	0	0	0	0	111	I221 P222 A223 T230 L315 M318 L319 L381	I221-V226 HydrophobicContact CB-CG2 4.09Å; I221-V226 HydrophobicContact CG2-CG2 3.69Å; P222-V226 PolarHBondContact O-N 3.44Å; A223-V226 PolarHBondContact O-N 2.96Å; V226-T230 VanDerWaalsContact O-CB 3.24Å; V226-T230 WeakPolarHBondContact O-CB 3.23Å; V226-T230 PolarHBondContact O-N 3.49Å; V226-T230 PolarHBondContact O-OG1 2.96Å; V226-L315 HydrophobicContact CG1-CD1 3.86Å; V226-M318 HydrophobicContact CG1-CB 3.99Å; V226-M318 HydrophobicContact CG1-CE 4.03Å; V226-M318 HydrophobicContact CG1-SD 4.2Å; V226-M318 HydrophobicContact CG2-CB 4.22Å; V226-L319 HydrophobicContact CG1-CD2 3.91Å; V226-L319 HydrophobicContact CG1-CG 4.41Å; V226-L381 HydrophobicContact CB-CD1 4.35Å; V226-L381 HydrophobicContact CG1-CD1 4.05Å
227	K	97.2	Very high	96.8	Very high	14 Å²	14	32.1 Å²	32.1	6%	0.061	16%	0.16	C	C	.	.	H	α-helix	trans	-57.7	-50.9	175.9	-74	175.5	174.2	-153	0	111.8	A223 C224 T225 F229 T230 Y231 D380 L381 C407 F408 E410 L411	A223-K227 WeakPolarHBondContact O-CG 3.49Å; A223-K227 PolarHBondContact O-N 3.28Å; C224-K227 PolarHBondContact O-N 3.25Å; T225-K227 PolarHBondContact O-N 3.14Å; K227-F229 PolarHBondContact O-N 3.17Å; K227-T230 PolarHBondContact O-N 2.86Å; K227-Y231 WeakPolarHBondContact O-CB 3.49Å; K227-Y231 PolarHBondContact O-N 3.27Å; K227-D380 VanDerWaalsContact CE-OD2 3.24Å; K227-D380 WeakPolarHBondContact CE-OD2 3.12Å; K227-D380 IonicContact NZ-OD2 3.22Å; K227-D380 PolarHBondContact NZ-OD2 3.01Å; K227-L381 HydrophobicContact CG-CD1 4.13Å; K227-L381 HydrophobicContact CG-CD2 4.05Å; K227-L381 HydrophobicContact CG-CG 4.4Å; K227-C407 WeakPolarHBondContact CD-O 3.1Å; K227-C407 WeakPolarHBondContact CE-O 2.94Å; K227-C407 PolarHBondContact NZ-O 3.29Å; K227-F408 HydrophobicContact CB-CD1 4.45Å; K227-F408 WeakPolarHBondContact O-CE1 3.31Å; K227-E410 VanDerWaalsContact CD-OE2 3.31Å; K227-E410 WeakPolarHBondContact CD-OE2 3.42Å; K227-E410 WeakPolarHBondContact CE-OE2 3.44Å; K227-E410 IonicContact NZ-OE2 2.76Å; K227-E410 PolarHBondContact NZ-OE2 2.71Å; K227-L411 HydrophobicContact CB-CD1 4.15Å; K227-L411 HydrophobicContact CB-CD2 4.37Å; K227-L411 HydrophobicContact CB-CG 4.42Å
228	V	97.1	Very high	96.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.3	-38.9	-176.3	172	0	0	0	0	112.6	C224 T225 Q232 M262 L411 L420 M426 P427 I430	C224-V228 WeakPolarHBondContact O-CG2 3.44Å; C224-V228 PolarHBondContact O-N 3.37Å; T225-V228 PolarHBondContact O-N 3.35Å; V228-Q232 VanDerWaalsContact CG1-NE2 3.31Å; V228-Q232 WeakPolarHBondContact O-CG 3.45Å; V228-Q232 PolarHBondContact O-N 2.94Å; V228-Q232 PolarHBondContact O-NE2 3.36Å; V228-M262 HydrophobicContact CB-CE 4.42Å; V228-M262 HydrophobicContact CG1-CB 4.04Å; V228-M262 WeakPolarHBondContact CG1-O 3.44Å; V228-M262 HydrophobicContact CG2-CE 4.46Å; V228-L411 HydrophobicContact CG2-CD1 3.98Å; V228-L411 HydrophobicContact CG2-CD2 3.59Å; V228-L411 HydrophobicContact CG2-CG 4.45Å; V228-L420 HydrophobicContact CG2-CD1 3.93Å; V228-L420 HydrophobicContact CG2-CD2 4.47Å; V228-M426 HydrophobicContact CG2-SD 4.23Å; V228-P427 HydrophobicContact CG1-CG 4.16Å; V228-I430 HydrophobicContact CG1-CD1 4.46Å
229	F	98.2	Very high	97.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-74.4	-39.7	175.1	-68.3	-25.6	0	0	0	112.7	L207 L210 T225 K227 Y231 Q232 M233 V257 L264 M318	L207-F229 HydrophobicContact CD1-CD2 4.08Å; L210-F229 HydrophobicContact CD1-CE2 3.79Å; L210-F229 HydrophobicContact CD1-CZ 4.31Å; T225-F229 HydrophobicContact CG2-CD2 3.73Å; T225-F229 HydrophobicContact CG2-CE2 3.36Å; T225-F229 HydrophobicContact CG2-CZ 4.03Å; T225-F229 PolarHBondContact O-N 2.69Å; K227-F229 PolarHBondContact O-N 3.17Å; F229-Y231 VanDerWaalsContact C-N 3.34Å; F229-Y231 PolarHBondContact O-N 3.18Å; F229-Q232 PolarHBondContact O-N 3.4Å; F229-M233 WeakPolarHBondContact O-CB 3.48Å; F229-M233 PolarHBondContact O-N 2.91Å; F229-V257 HydrophobicContact CD1-CG1 4.31Å; F229-V257 HydrophobicContact CD2-CG1 4.32Å; F229-V257 HydrophobicContact CE1-CB 4.21Å; F229-V257 HydrophobicContact CE1-CG1 4.14Å; F229-V257 HydrophobicContact CE2-CB 4.27Å; F229-V257 HydrophobicContact CE2-CG1 4.16Å; F229-V257 HydrophobicContact CG-CG1 4.4Å; F229-V257 HydrophobicContact CZ-CB 3.9Å; F229-V257 HydrophobicContact CZ-CG1 4.08Å; F229-L264 HydrophobicContact CB-CD1 3.76Å; F229-L264 HydrophobicContact CD1-CB 3.74Å; F229-L264 HydrophobicContact CD1-CD1 4.29Å; F229-L264 HydrophobicContact CE1-CB 4.33Å; F229-L264 HydrophobicContact CG-CB 4.44Å; F229-L264 HydrophobicContact CG-CD1 4.15Å; F229-M318 HydrophobicContact CB-SD 4.24Å
230	T	98.7	Very high	97.2	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.9	-41.4	175.7	-53.1	0	0	0	0	111.3	V226 K227 M233 L234 L315 M318 L384 F408	V226-T230 VanDerWaalsContact O-CB 3.24Å; V226-T230 WeakPolarHBondContact O-CB 3.23Å; V226-T230 PolarHBondContact O-N 3.49Å; V226-T230 PolarHBondContact O-OG1 2.96Å; K227-T230 PolarHBondContact O-N 2.86Å; T230-M233 HydrophobicContact CG2-CE 4.23Å; T230-M233 PolarHBondContact O-N 3.23Å; T230-L234 HydrophobicContact CG2-CD1 4.06Å; T230-L234 HydrophobicContact CG2-CG 4.44Å; T230-L234 WeakPolarHBondContact O-CB 3.21Å; T230-L234 VanDerWaalsContact O-CG 3.3Å; T230-L234 WeakPolarHBondContact O-CG 3.45Å; T230-L234 PolarHBondContact O-N 3.03Å; T230-L315 HydrophobicContact CG2-CB 4.49Å; T230-L315 HydrophobicContact CG2-CD1 4.16Å; T230-L315 HydrophobicContact CG2-CD2 4.15Å; T230-M318 VanDerWaalsContact OG1-CE 3.22Å; T230-M318 WeakPolarHBondContact OG1-CE 3.06Å; T230-L384 HydrophobicContact CG2-CD2 3.98Å; T230-F408 HydrophobicContact CG2-CZ 3.97Å
231	Y	98.5	Very high	97.4	Very high	22 Å²	22	9.6 Å²	9.6	9%	0.086	6%	0.059	C	C	.	.	H	α-helix	trans	-60.3	-49.9	176.3	-171.7	-87.4	0	0	0	111.9	K227 F229 M233 L234 K235 L403 F408 L411 I430 F431	K227-Y231 WeakPolarHBondContact O-CB 3.49Å; K227-Y231 PolarHBondContact O-N 3.27Å; F229-Y231 VanDerWaalsContact C-N 3.34Å; F229-Y231 PolarHBondContact O-N 3.18Å; Y231-M233 VanDerWaalsContact C-N 3.35Å; Y231-M233 PolarHBondContact O-N 2.92Å; Y231-L234 PolarHBondContact O-N 2.81Å; Y231-K235 WeakPolarHBondContact O-CB 3.29Å; Y231-K235 PolarHBondContact O-N 3.47Å; Y231-L403 HydrophobicContact CD1-CD2 4.14Å; Y231-L403 HydrophobicContact CD2-CD2 3.69Å; Y231-L403 HydrophobicContact CE1-CD2 3.99Å; Y231-L403 HydrophobicContact CE2-CB 3.92Å; Y231-L403 HydrophobicContact CE2-CD2 3.55Å; Y231-L403 HydrophobicContact CE2-CG 4.3Å; Y231-L403 HydrophobicContact CG-CD2 3.99Å; Y231-L403 WeakPolarHBondContact O-CD2 3.43Å; Y231-F408 HydrophobicContact CD2-CB 3.96Å; Y231-F408 AromaticContact CD2-CD1 3.86Å; Y231-F408 HydrophobicContact CD2-CD1 3.86Å; Y231-F408 AromaticContact CD2-CD2 3.85Å; Y231-F408 HydrophobicContact CD2-CD2 3.85Å; Y231-F408 HydrophobicContact CD2-CE1 4.31Å; Y231-F408 HydrophobicContact CD2-CE2 4.29Å; Y231-F408 AromaticContact CD2-CG 3.61Å; Y231-F408 HydrophobicContact CD2-CG 3.61Å; Y231-F408 HydrophobicContact CE2-CB 4.33Å; Y231-F408 HydrophobicContact CE2-CD2 4.47Å; Y231-F408 HydrophobicContact CE2-CG 4.36Å; Y231-F408 HydrophobicContact CG-CD1 4.41Å; Y231-L411 HydrophobicContact CG-CD1 4.43Å; Y231-I430 HydrophobicContact CD1-CD1 3.83Å; Y231-I430 HydrophobicContact CD1-CG1 3.53Å; Y231-I430 HydrophobicContact CE1-CD1 4.38Å; Y231-I430 HydrophobicContact CE1-CG1 3.71Å; Y231-I430 WeakPolarHBondContact CE1-O 3.35Å; Y231-I430 HydrophobicContact CG-CD1 4.5Å; Y231-F431 HydrophobicContact CE1-CD1 4.1Å; Y231-F431 HydrophobicContact CE1-CE1 4.01Å; Y231-F431 HydrophobicContact CE2-CE1 4.19Å; Y231-F431 AromaticContact CZ-CD1 3.85Å; Y231-F431 AromaticContact CZ-CE1 3.71Å; Y231-F431 WeakPolarHBondContact OH-CD1 3.34Å
232	Q	98.4	Very high	97.4	Very high	3 Å²	3	12.8 Å²	12.8	1%	0.014	8%	0.082	C	C	.	.	H	α-helix	trans	-65.6	-35.7	179.2	-75.3	174	95.4	0	0	113	N159 V228 F229 K235 S236 M262 L264 I430	N159-Q232 WeakPolarHBondContact ND2-CB 3.27Å; N159-Q232 WeakPolarHBondContact ND2-CG 3.28Å; N159-Q232 PolarHBondContact ND2-OE1 2.91Å; V228-Q232 VanDerWaalsContact CG1-NE2 3.31Å; V228-Q232 WeakPolarHBondContact O-CG 3.45Å; V228-Q232 PolarHBondContact O-N 2.94Å; V228-Q232 PolarHBondContact O-NE2 3.36Å; F229-Q232 PolarHBondContact O-N 3.4Å; Q232-K235 PolarHBondContact O-N 3.48Å; Q232-S236 PolarHBondContact O-N 3.14Å; Q232-S236 PolarHBondContact O-OG 3Å; Q232-M262 PolarHBondContact NE2-O 3.27Å; Q232-L264 HydrophobicContact CB-CB 4.07Å; Q232-L264 HydrophobicContact CB-CD2 4.1Å; Q232-L264 VanDerWaalsContact OE1-N 3.1Å; Q232-I430 HydrophobicContact CG-CD1 4.48Å; Q232-I430 HydrophobicContact CG-CG1 4.31Å
233	M	98.7	Very high	97.4	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-62	-52.2	171.7	178.7	-178.1	66.8	0	0	110.2	F229 T230 Y231 K235 S236 L237 L255 L264 G311 V314	F229-M233 WeakPolarHBondContact O-CB 3.48Å; F229-M233 PolarHBondContact O-N 2.91Å; T230-M233 HydrophobicContact CG2-CE 4.23Å; T230-M233 PolarHBondContact O-N 3.23Å; Y231-M233 VanDerWaalsContact C-N 3.35Å; Y231-M233 PolarHBondContact O-N 2.92Å; M233-K235 VanDerWaalsContact C-N 3.28Å; M233-K235 PolarHBondContact O-N 3Å; M233-S236 PolarHBondContact O-N 2.83Å; M233-S236 PolarHBondContact O-OG 2.86Å; M233-L237 HydrophobicContact CG-CD1 4.46Å; M233-L237 WeakPolarHBondContact O-CG 3.19Å; M233-L237 PolarHBondContact O-N 3.31Å; M233-L255 HydrophobicContact CG-CD1 4.36Å; M233-L255 HydrophobicContact CG-CD2 4.29Å; M233-L255 HydrophobicContact SD-CD1 3.7Å; M233-L264 HydrophobicContact CB-CD2 4.16Å; M233-G311 WeakPolarHBondContact CE-O 3.37Å; M233-V314 HydrophobicContact CE-CB 4.46Å; M233-V314 HydrophobicContact CE-CG1 4.44Å; M233-V314 HydrophobicContact SD-CB 4.02Å; M233-V314 HydrophobicContact SD-CG1 3.85Å
234	L	98.8	Very high	97.5	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-59.1	-37	177.1	-72.8	170.6	0	0	0	112.7	T230 Y231 L237 A238 L384 M388 P399 A402 L403 F408	T230-L234 HydrophobicContact CG2-CD1 4.06Å; T230-L234 HydrophobicContact CG2-CG 4.44Å; T230-L234 WeakPolarHBondContact O-CB 3.21Å; T230-L234 VanDerWaalsContact O-CG 3.3Å; T230-L234 WeakPolarHBondContact O-CG 3.45Å; T230-L234 PolarHBondContact O-N 3.03Å; Y231-L234 PolarHBondContact O-N 2.81Å; L234-L237 PolarHBondContact O-N 3.32Å; L234-A238 WeakPolarHBondContact O-CB 3.35Å; L234-A238 PolarHBondContact O-N 2.91Å; L234-L384 HydrophobicContact CD1-CD1 4.38Å; L234-L384 HydrophobicContact CD1-CD2 4.12Å; L234-M388 HydrophobicContact CD2-CE 3.67Å; L234-M388 HydrophobicContact CD2-SD 4.36Å; L234-P399 HydrophobicContact CD2-CB 4.14Å; L234-P399 WeakPolarHBondContact O-CB 3.33Å; L234-A402 HydrophobicContact CD1-CB 3.74Å; L234-A402 HydrophobicContact CD2-CB 3.91Å; L234-A402 HydrophobicContact CG-CB 4.39Å; L234-L403 HydrophobicContact CB-CD2 3.75Å; L234-L403 HydrophobicContact CB-CG 4.38Å; L234-F408 HydrophobicContact CD1-CE2 3.74Å; L234-F408 HydrophobicContact CD1-CZ 3.79Å
235	K	98.2	Very high	97.7	Very high	5 Å²	5	14 Å²	14	2%	0.022	8%	0.075	C	C	.	.	H	α-helix	trans	-64.9	-48.5	176.6	-170.1	-179.2	178.9	172.9	0	111.3	Y231 Q232 M233 L237 A238 Y239 L403 H429 I430 D432 D434	Y231-K235 WeakPolarHBondContact O-CB 3.29Å; Y231-K235 PolarHBondContact O-N 3.47Å; Q232-K235 PolarHBondContact O-N 3.48Å; M233-K235 VanDerWaalsContact C-N 3.28Å; M233-K235 PolarHBondContact O-N 3Å; K235-L237 VanDerWaalsContact C-N 3.28Å; K235-L237 PolarHBondContact O-N 2.98Å; K235-A238 WeakPolarHBondContact O-CB 3.4Å; K235-A238 PolarHBondContact O-N 3.09Å; K235-A238 VanDerWaalsContact O-N 3.14Å; K235-Y239 PolarHBondContact O-N 3.25Å; K235-L403 HydrophobicContact CB-CD1 4.35Å; K235-L403 HydrophobicContact CB-CD2 4.08Å; K235-L403 HydrophobicContact CG-CD1 4.49Å; K235-H429 PolarHBondContact NZ-O 3.47Å; K235-I430 PolarHBondContact NZ-O 3.01Å; K235-D432 WeakPolarHBondContact CE-O 3.36Å; K235-D432 PolarHBondContact NZ-O 3.05Å; K235-D434 WeakPolarHBondContact CE-OD1 3.16Å
236	S	98.5	Very high	97.8	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-58.4	-38.7	173.8	70.4	0	0	0	0	112.7	N159 Q232 M233 Y239 L240 V266	N159-S236 WeakPolarHBondContact O-CB 3.35Å; Q232-S236 PolarHBondContact O-N 3.14Å; Q232-S236 PolarHBondContact O-OG 3Å; M233-S236 PolarHBondContact O-N 2.83Å; M233-S236 PolarHBondContact O-OG 2.86Å; S236-Y239 PolarHBondContact O-N 3.29Å; S236-L240 WeakPolarHBondContact O-CB 3.41Å; S236-L240 WeakPolarHBondContact O-CD1 3.24Å; S236-L240 PolarHBondContact O-N 2.88Å; S236-V266 WeakPolarHBondContact OG-CG2 3.41Å
237	L	98.7	Very high	97.9	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-69.6	-38.2	175.6	-66.5	-177.5	0	0	0	112.3	M233 L234 K235 Y239 L240 H241 I250 D307 P399	M233-L237 HydrophobicContact CG-CD1 4.46Å; M233-L237 WeakPolarHBondContact O-CG 3.19Å; M233-L237 PolarHBondContact O-N 3.31Å; L234-L237 PolarHBondContact O-N 3.32Å; K235-L237 VanDerWaalsContact C-N 3.28Å; K235-L237 PolarHBondContact O-N 2.98Å; L237-Y239 VanDerWaalsContact C-N 3.33Å; L237-Y239 PolarHBondContact O-N 2.71Å; L237-L240 PolarHBondContact O-N 3.12Å; L237-H241 VanDerWaalsContact O-CB 3.23Å; L237-H241 WeakPolarHBondContact O-CB 3.16Å; L237-H241 PolarHBondContact O-CD2 2.99Å; L237-H241 PolarHBondContact O-N 3.25Å; L237-I250 HydrophobicContact CD2-CD1 3.82Å; L237-I250 HydrophobicContact CD2-CG1 3.97Å; L237-D307 HydrophobicContact CD2-CB 4Å; L237-P399 HydrophobicContact CB-CB 3.84Å; L237-P399 HydrophobicContact CB-CG 3.8Å
238	A	98.3	Very high	97.9	Very high	10 Å²	10	14 Å²	14	8%	0.083	7%	0.074	C	C	.	.	H	α-helix	trans	-58.7	-46.8	174.1	0	0	0	0	0	111	L234 K235 H241 S242 P399 L403	L234-A238 WeakPolarHBondContact O-CB 3.35Å; L234-A238 PolarHBondContact O-N 2.91Å; K235-A238 WeakPolarHBondContact O-CB 3.4Å; K235-A238 PolarHBondContact O-N 3.09Å; K235-A238 VanDerWaalsContact O-N 3.14Å; A238-H241 PolarHBondContact O-N 2.96Å; A238-S242 PolarHBondContact O-N 1.9Å; A238-S242 PolarHBondContact O-OG 3.25Å; A238-P399 HydrophobicContact CB-CB 4.17Å; A238-L403 HydrophobicContact CB-CD1 4.48Å
239	Y	98	Very high	98	Very high	1 Å²	1	14.6 Å²	14.6	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-64.4	-43.3	175.4	177.2	-112.7	0	0	0	113.5	L154 H157 V160 K235 S236 L237 S242 H243 D434 P435	L154-Y239 HydrophobicContact CB-CE1 4.01Å; L154-Y239 HydrophobicContact CD2-CD1 4.06Å; L154-Y239 HydrophobicContact CD2-CE1 3.42Å; L154-Y239 VanDerWaalsContact CD2-CE1 3.42Å; L154-Y239 HydrophobicContact CG-CE1 4.29Å; H157-Y239 HydrophobicContact CB-CD1 3.43Å; H157-Y239 VanDerWaalsContact CB-CD1 3.43Å; H157-Y239 HydrophobicContact CB-CE1 3.38Å; H157-Y239 HydrophobicContact CB-CG 4.07Å; H157-Y239 VanDerWaalsContact CD2-CB 3.45Å; H157-Y239 WeakPolarHBondContact CD2-CB 3.37Å; H157-Y239 AromaticContact CD2-CD1 3.6Å; H157-Y239 AromaticContact CD2-CD2 3.86Å; H157-Y239 AromaticContact CD2-CG 3.34Å; H157-Y239 AromaticContact CG-CD1 3.51Å; H157-Y239 AromaticContact CG-CG 3.78Å; V160-Y239 HydrophobicContact CG2-CD1 4.38Å; K235-Y239 PolarHBondContact O-N 3.25Å; S236-Y239 PolarHBondContact O-N 3.29Å; L237-Y239 VanDerWaalsContact C-N 3.33Å; L237-Y239 PolarHBondContact O-N 2.71Å; Y239-S242 PolarHBondContact O-OG 3.3Å; Y239-H243 AromaticContact CD2-CE1 3.64Å; Y239-H243 AromaticContact CD2-ND1 3.77Å; Y239-H243 AromaticContact CE2-CE1 3.29Å; Y239-H243 WeakPolarHBondContact CE2-CE1 3.33Å; Y239-H243 AromaticContact CE2-ND1 3.62Å; Y239-H243 PolarHBondContact O-ND1 3.07Å; Y239-D434 HydrophobicContact CD2-CB 4.02Å; Y239-P435 WeakPolarHBondContact CE2-O 3.16Å
240	L	98	Very high	98	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61	-45.8	174.8	-98.9	65.9	0	0	0	111.1	L154 V160 S236 L237 H243 Q244 I245 H247 F269	L154-L240 HydrophobicContact CD1-CD1 3.9Å; L154-L240 HydrophobicContact CD1-CG 4.07Å; V160-L240 HydrophobicContact CG2-CD1 4Å; S236-L240 WeakPolarHBondContact O-CB 3.41Å; S236-L240 WeakPolarHBondContact O-CD1 3.24Å; S236-L240 PolarHBondContact O-N 2.88Å; L237-L240 PolarHBondContact O-N 3.12Å; L240-H243 PolarHBondContact O-N 2.83Å; L240-Q244 PolarHBondContact O-N 3.35Å; L240-I245 CarbonylContact C-O 3.52Å; L240-I245 WeakPolarHBondContact CB-O 3.28Å; L240-I245 HydrophobicContact CG-CG2 4.4Å; L240-I245 PolarHBondContact O-N 2.88Å; L240-I245 VanDerWaalsContact O-O 3.11Å; L240-H247 HydrophobicContact CD2-CB 3.94Å; L240-F269 HydrophobicContact CD1-CE1 4.17Å; L240-F269 HydrophobicContact CD1-CZ 4.35Å; L240-F269 HydrophobicContact CD2-CE1 3.93Å; L240-F269 HydrophobicContact CG-CE1 4.28Å
241	H	97.6	Very high	98	Very high	27 Å²	27	16.1 Å²	16.1	13%	0.125	8%	0.084	C	C	.	.	H	α-helix	trans	-72.3	-34.6	-174.6	-67.1	-165	0	0	0	112.6	L237 A238 H243 Q244 C304 D307	L237-H241 VanDerWaalsContact O-CB 3.23Å; L237-H241 WeakPolarHBondContact O-CB 3.16Å; L237-H241 PolarHBondContact O-CD2 2.99Å; L237-H241 PolarHBondContact O-N 3.25Å; A238-H241 PolarHBondContact O-N 2.96Å; H241-H243 PolarHBondContact O-N 2.78Å; H241-Q244 WeakPolarHBondContact O-CA 3.33Å; H241-Q244 PolarHBondContact O-N 3.11Å; H241-C304 HydrophobicContact CB-CB 4.36Å; H241-C304 PolarHBondContact CE1-O 2.8Å; H241-C304 PolarHBondContact NE2-O 3.18Å; H241-D307 IonicContact NE2-OD2 3.55Å
242	S	96.2	Very high	98	Very high	80 Å²	80	15.2 Å²	15.2	56%	0.559	8%	0.081	S	C	*	.	H	α-helix	trans	-62.3	-26.8	174	63	0	0	0	0	112.4	A238 Y239 Q244	A238-S242 PolarHBondContact O-N 1.9Å; A238-S242 PolarHBondContact O-OG 3.25Å; Y239-S242 PolarHBondContact O-OG 3.3Å; S242-Q244 VanDerWaalsContact C-N 3.33Å
243	H	95.3	Very high	97.9	Very high	28 Å²	28	17.5 Å²	17.5	13%	0.13	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	9.9	173	-64.2	93.2	0	0	0	114.1	Y239 L240 H241 I245 P437	Y239-H243 AromaticContact CD2-CE1 3.64Å; Y239-H243 AromaticContact CD2-ND1 3.77Å; Y239-H243 AromaticContact CE2-CE1 3.29Å; Y239-H243 WeakPolarHBondContact CE2-CE1 3.33Å; Y239-H243 AromaticContact CE2-ND1 3.62Å; Y239-H243 PolarHBondContact O-ND1 3.07Å; L240-H243 PolarHBondContact O-N 2.83Å; H241-H243 PolarHBondContact O-N 2.78Å; H243-I245 HydrophobicContact CB-CD1 4.15Å; H243-I245 HydrophobicContact CB-CG1 4.49Å; H243-I245 PolarHBondContact O-N 2.68Å; H243-I245 VanDerWaalsContact O-N 3.13Å; H243-P437 WeakPolarHBondContact NE2-CB 3.36Å; H243-P437 VanDerWaalsContact NE2-CD 3.33Å; H243-P437 WeakPolarHBondContact NE2-CD 3.46Å; H243-P437 WeakPolarHBondContact NE2-CG 3.42Å
244	Q	96.5	Very high	97.9	Very high	98 Å²	98	17.9 Å²	17.9	46%	0.458	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	21.7	-173.4	-61	-75.6	52.6	0	0	114	L240 H241 S242 E274 M275	L240-Q244 PolarHBondContact O-N 3.35Å; H241-Q244 WeakPolarHBondContact O-CA 3.33Å; H241-Q244 PolarHBondContact O-N 3.11Å; S242-Q244 VanDerWaalsContact C-N 3.33Å; Q244-E274 CarbonylContact O-C 3.24Å; Q244-E274 WeakPolarHBondContact O-CA 3.39Å; Q244-M275 PolarHBondContact O-N 3.26Å
245	I	97.7	Very high	97.9	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.8	177	-69.7	161.4	0	0	0	108.5	I150 L154 L240 H243 A272 E274	I150-I245 HydrophobicContact CD1-CG2 4.45Å; I150-I245 HydrophobicContact CG2-CD1 4.4Å; I150-I245 HydrophobicContact CG2-CG2 4.09Å; L154-I245 HydrophobicContact CD1-CD1 4.12Å; L154-I245 HydrophobicContact CD1-CG2 4.21Å; L154-I245 HydrophobicContact CD2-CD1 4Å; L154-I245 HydrophobicContact CG-CD1 4.13Å; L240-I245 CarbonylContact C-O 3.52Å; L240-I245 WeakPolarHBondContact CB-O 3.28Å; L240-I245 HydrophobicContact CG-CG2 4.4Å; L240-I245 PolarHBondContact O-N 2.88Å; L240-I245 VanDerWaalsContact O-O 3.11Å; H243-I245 HydrophobicContact CB-CD1 4.15Å; H243-I245 HydrophobicContact CB-CG1 4.49Å; H243-I245 PolarHBondContact O-N 2.68Å; H243-I245 VanDerWaalsContact O-N 3.13Å; I245-A272 HydrophobicContact CG2-CB 4.43Å; I245-E274 HydrophobicContact CG1-CB 4.44Å
246	C	98.5	Very high	97.9	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.4	170.2	-170.7	0	0	0	0	108.2	R248 A272 K273 M275 C304 I306 D307	C246-R248 HydrophobicContact CB-CG 3.88Å; C246-R248 WeakPolarHBondContact SG-CG 3.47Å; C246-A272 CarbonylContact O-C 3.45Å; C246-A272 VanDerWaalsContact O-CA 3.24Å; C246-A272 WeakPolarHBondContact O-CA 3.46Å; C246-K273 PolarHBondContact N-O 3.49Å; C246-K273 PolarHBondContact O-N 2.76Å; C246-M275 HydrophobicContact CB-CG 3.38Å; C246-M275 HydrophobicContact CB-SD 3.83Å; C246-C304 HydrophobicContact CB-CB 4.26Å; C246-I306 VanDerWaalsContact SG-CG1 3.56Å; C246-D307 WeakPolarHBondContact CA-OD2 3.4Å; C246-D307 PolarHBondContact SG-OD2 2.85Å
247	H	98.6	Very high	97.9	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.105	C	C	.	.			trans	-73.9	-41.7	178.6	-169.9	-70.6	0	0	0	111.1	L240 D249 I250 N254 V266 C267 D268 S271 A272 D307	L240-H247 HydrophobicContact CD2-CB 3.94Å; H247-D249 PolarHBondContact CE1-O 3.34Å; H247-D249 PolarHBondContact ND1-N 2.89Å; H247-D249 PolarHBondContact O-N 3.04Å; H247-I250 HydrophobicContact CB-CD1 3.76Å; H247-I250 HydrophobicContact CB-CG1 3.92Å; H247-N254 PolarHBondContact CE1-ND2 3.32Å; H247-V266 WeakPolarHBondContact CD2-CG1 3.42Å; H247-V266 WeakPolarHBondContact NE2-CG1 3.32Å; H247-C267 PolarHBondContact CE1-O 3.3Å; H247-C267 VanDerWaalsContact CE1-O 3.3Å; H247-C267 PolarHBondContact NE2-O 3.11Å; H247-D268 PolarHBondContact CE1-O 3.05Å; H247-D268 VanDerWaalsContact NE2-C 3.35Å; H247-D268 PolarHBondContact NE2-O 3.07Å; H247-D268 VanDerWaalsContact NE2-O 3.12Å; H247-S271 CarbonylContact O-C 3.55Å; H247-S271 VanDerWaalsContact O-C 3.24Å; H247-S271 WeakPolarHBondContact O-CB 3.45Å; H247-A272 WeakPolarHBondContact O-CA 3.36Å; H247-A272 PolarHBondContact O-N 2.85Å; H247-D307 PolarHBondContact N-OD2 2.67Å
248	R	98.6	Very high	97.8	Very high	18 Å²	18	20.7 Å²	20.7	7%	0.068	11%	0.114	C	C	.	.	S	Bend	trans	65.8	12.2	175	-44.9	-168.9	-58.4	139.3	10.6	114.9	C246 S271 I285 S286 Y302 I306 D307	C246-R248 HydrophobicContact CB-CG 3.88Å; C246-R248 WeakPolarHBondContact SG-CG 3.47Å; R248-S271 VanDerWaalsContact CZ-O 3.22Å; R248-S271 PolarHBondContact NE-O 3.47Å; R248-S271 PolarHBondContact NH2-O 3.12Å; R248-I285 HydrophobicContact CB-CD1 4.09Å; R248-I285 HydrophobicContact CB-CG1 4.24Å; R248-S286 WeakPolarHBondContact O-CA 3.45Å; R248-S286 WeakPolarHBondContact O-CB 3.43Å; R248-S286 PolarHBondContact O-N 3.07Å; R248-Y302 PolarHBondContact NH1-OH 3.34Å; R248-I306 HydrophobicContact CB-CD1 4.26Å; R248-I306 HydrophobicContact CG-CD1 4.11Å; R248-D307 PolarHBondContact N-OD1 2.91Å
249	D	98.3	Very high	97.5	Very high	12 Å²	12	21.8 Å²	21.8	6%	0.064	12%	0.118	C	C	.	.			trans	-158	45.1	173.6	-163.4	33.7	0	0	0	112.7	H247 K251 N254 S287	H247-D249 PolarHBondContact CE1-O 3.34Å; H247-D249 PolarHBondContact ND1-N 2.89Å; H247-D249 PolarHBondContact O-N 3.04Å; D249-K251 PolarHBondContact O-N 3.41Å; D249-K251 IonicContact OD1-NZ 3.3Å; D249-K251 PolarHBondContact OD1-NZ 3.11Å; D249-K251 IonicContact OD2-NZ 3.52Å; D249-K251 PolarHBondContact OD2-NZ 2.87Å; D249-N254 PolarHBondContact O-ND2 2.85Å; D249-N254 PolarHBondContact OD2-ND2 2.98Å; D249-S287 WeakPolarHBondContact OD1-CB 3.21Å; D249-S287 PolarHBondContact OD1-N 2.91Å; D249-S287 PolarHBondContact OD1-OG 3.15Å
250	I	98.7	Very high	97.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.			trans	-69.5	124.1	172	-63.2	-65.5	0	0	0	109.8	L237 H247 V266 Y290 D307 V314	L237-I250 HydrophobicContact CD2-CD1 3.82Å; L237-I250 HydrophobicContact CD2-CG1 3.97Å; H247-I250 HydrophobicContact CB-CD1 3.76Å; H247-I250 HydrophobicContact CB-CG1 3.92Å; I250-V266 HydrophobicContact CD1-CG1 4.18Å; I250-Y290 WeakPolarHBondContact O-CB 3.4Å; I250-D307 HydrophobicContact CG1-CB 4.04Å; I250-V314 HydrophobicContact CG2-CG2 4.38Å
251	K	98.4	Very high	97.2	Very high	32 Å²	32	31.6 Å²	31.6	14%	0.139	17%	0.173	C	C	.	.			trans	-163.7	162.5	-179.2	66.1	-157.5	-170.2	-156.9	0	109.7	D249 S253 N254 S287 Y290	D249-K251 PolarHBondContact O-N 3.41Å; D249-K251 IonicContact OD1-NZ 3.3Å; D249-K251 PolarHBondContact OD1-NZ 3.11Å; D249-K251 IonicContact OD2-NZ 3.52Å; D249-K251 PolarHBondContact OD2-NZ 2.87Å; K251-S253 WeakPolarHBondContact CE-OG 3.08Å; K251-S253 WeakPolarHBondContact CG-OG 3.35Å; K251-S253 PolarHBondContact O-N 3.41Å; K251-S253 VanDerWaalsContact O-N 3.15Å; K251-N254 WeakPolarHBondContact CE-ND2 3.43Å; K251-N254 VanDerWaalsContact CE-OD1 3.23Å; K251-N254 WeakPolarHBondContact CE-OD1 3.36Å; K251-N254 HydrophobicContact CG-CB 4.06Å; K251-N254 PolarHBondContact O-N 3.3Å; K251-S287 WeakPolarHBondContact CD-OG 3.49Å; K251-S287 WeakPolarHBondContact CE-OG 3.25Å; K251-S287 PolarHBondContact NZ-OG 3.01Å; K251-Y290 HydrophobicContact CB-CD1 3.97Å; K251-Y290 HydrophobicContact CB-CD2 3.6Å; K251-Y290 HydrophobicContact CB-CE1 3.89Å; K251-Y290 HydrophobicContact CB-CE2 3.54Å; K251-Y290 HydrophobicContact CB-CG 3.82Å
252	S	98.3	Very high	97.1	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.014	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-63	-21.8	-175.3	53.7	0	0	0	0	115	L207 C208 Y290 E317	L207-S252 WeakPolarHBondContact CB-O 3.5Å; L207-S252 PolarHBondContact N-O 3.34Å; C208-S252 PolarHBondContact N-O 2.98Å; S252-Y290 PolarHBondContact OG-OH 2.86Å; S252-Y290 VanDerWaalsContact OG-OH 3.05Å; S252-E317 WeakPolarHBondContact CB-OE2 3.42Å; S252-E317 PolarHBondContact OG-OE2 2.95Å
253	S	96.9	Very high	97.1	Very high	51 Å²	51	28 Å²	28	36%	0.357	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-75.2	-22.6	171.5	72.6	0	0	0	0	113.9	K251 L255	K251-S253 WeakPolarHBondContact CE-OG 3.08Å; K251-S253 WeakPolarHBondContact CG-OG 3.35Å; K251-S253 PolarHBondContact O-N 3.41Å; K251-S253 VanDerWaalsContact O-N 3.15Å; S253-L255 VanDerWaalsContact C-N 3.33Å
254	N	98	Very high	97.3	Very high	10 Å²	10	26.6 Å²	26.6	5%	0.053	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-98.1	12.4	-177.3	-67.6	7.5	0	0	0	112.1	H247 D249 K251 C267	H247-N254 PolarHBondContact CE1-ND2 3.32Å; D249-N254 PolarHBondContact O-ND2 2.85Å; D249-N254 PolarHBondContact OD2-ND2 2.98Å; K251-N254 WeakPolarHBondContact CE-ND2 3.43Å; K251-N254 VanDerWaalsContact CE-OD1 3.23Å; K251-N254 WeakPolarHBondContact CE-OD1 3.36Å; K251-N254 HydrophobicContact CG-CB 4.06Å; K251-N254 PolarHBondContact O-N 3.3Å; N254-C267 PolarHBondContact O-N 2.85Å; N254-C267 PolarHBondContact O-SG 3.06Å
255	L	98.6	Very high	97.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	102.8	176.1	-62.5	172	0	0	0	107	S206 L207 M233 S253 L264 V266 V314	S206-L255 CarbonylContact C-O 3.55Å; S206-L255 WeakPolarHBondContact CA-O 3.28Å; L207-L255 HydrophobicContact CB-CB 4.05Å; L207-L255 HydrophobicContact CD2-CB 4.32Å; L207-L255 HydrophobicContact CD2-CD1 3.91Å; L207-L255 PolarHBondContact N-O 3.15Å; M233-L255 HydrophobicContact CG-CD1 4.36Å; M233-L255 HydrophobicContact CG-CD2 4.29Å; M233-L255 HydrophobicContact SD-CD1 3.7Å; S253-L255 VanDerWaalsContact C-N 3.33Å; L255-L264 HydrophobicContact CB-CD1 4.25Å; L255-L264 HydrophobicContact CD2-CD2 4.3Å; L255-V266 HydrophobicContact CD2-CG2 3.68Å; L255-V314 HydrophobicContact CD1-CB 4.42Å; L255-V314 HydrophobicContact CD1-CG1 3.63Å; L255-V314 HydrophobicContact CD1-CG2 4.12Å
256	L	98.3	Very high	97.4	Very high	28 Å²	28	23.1 Å²	23.1	15%	0.147	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	136.8	178	-58.8	178.2	0	0	0	109.2	V161 F203 L264 K265 C267	V161-L256 HydrophobicContact CB-CD1 4.29Å; V161-L256 HydrophobicContact CG2-CD1 3.81Å; F203-L256 HydrophobicContact CB-CB 3.74Å; F203-L256 HydrophobicContact CB-CD1 4.14Å; F203-L256 HydrophobicContact CB-CD2 4.28Å; F203-L256 HydrophobicContact CB-CG 4.27Å; F203-L256 HydrophobicContact CD1-CB 3.7Å; F203-L256 HydrophobicContact CD2-CB 4.11Å; F203-L256 HydrophobicContact CD2-CD1 4.08Å; F203-L256 HydrophobicContact CE1-CB 4.37Å; F203-L256 HydrophobicContact CG-CB 3.56Å; F203-L256 HydrophobicContact CG-CD1 4.18Å; F203-L256 HydrophobicContact CG-CG 4.41Å; L256-L264 CarbonylContact O-C 3.4Å; L256-L264 VanDerWaalsContact O-CA 3.28Å; L256-L264 WeakPolarHBondContact O-CA 3.37Å; L256-K265 PolarHBondContact N-O 2.96Å; L256-K265 PolarHBondContact O-N 2.82Å; L256-C267 HydrophobicContact CD1-CB 3.72Å; L256-C267 HydrophobicContact CG-CB 3.93Å
257	V	98	Very high	97.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150	-177.4	-62.8	0	0	0	0	112.4	P204 E205 L207 L210 F229 V263 L264	P204-V257 WeakPolarHBondContact CG-O 3.4Å; E205-V257 HydrophobicContact CG-CG2 3.63Å; E205-V257 PolarHBondContact O-N 3.46Å; E205-V257 VanDerWaalsContact O-O 3.12Å; L207-V257 HydrophobicContact CB-CG1 3.97Å; L207-V257 HydrophobicContact CD1-CG1 4.25Å; L210-V257 HydrophobicContact CB-CG2 4.1Å; L210-V257 HydrophobicContact CD1-CG2 3.82Å; F229-V257 HydrophobicContact CD1-CG1 4.31Å; F229-V257 HydrophobicContact CD2-CG1 4.32Å; F229-V257 HydrophobicContact CE1-CB 4.21Å; F229-V257 HydrophobicContact CE1-CG1 4.14Å; F229-V257 HydrophobicContact CE2-CB 4.27Å; F229-V257 HydrophobicContact CE2-CG1 4.16Å; F229-V257 HydrophobicContact CG-CG1 4.4Å; F229-V257 HydrophobicContact CZ-CB 3.9Å; F229-V257 HydrophobicContact CZ-CG1 4.08Å; V257-V263 WeakPolarHBondContact CA-O 3.45Å; V257-L264 HydrophobicContact CG1-CB 4.13Å; V257-L264 HydrophobicContact CG1-CD1 3.89Å; V257-L264 HydrophobicContact CG1-CG 4.09Å
258	N	96.3	Very high	97.2	Very high	36 Å²	36	26 Å²	26	19%	0.193	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	109.9	169.6	179	-34.9	0	0	0	107.1	F203 P204 D260 T261 M262 V263	F203-N258 HydrophobicContact CD1-CB 4.26Å; F203-N258 HydrophobicContact CE1-CB 4.08Å; P204-N258 HydrophobicContact CG-CB 3.94Å; N258-D260 WeakPolarHBondContact OD1-CB 3.39Å; N258-D260 PolarHBondContact OD1-N 2.89Å; N258-T261 WeakPolarHBondContact CB-OG1 3.23Å; N258-T261 PolarHBondContact OD1-N 3.31Å; N258-T261 PolarHBondContact OD1-OG1 2.86Å; N258-M262 CarbonylContact O-C 3.57Å; N258-M262 WeakPolarHBondContact O-CA 3.39Å; N258-M262 PolarHBondContact O-N 3.39Å; N258-V263 PolarHBondContact N-O 3.27Å; N258-V263 PolarHBondContact O-N 3.45Å
259	E	93.9	Very high	97.1	Very high	34 Å²	34	25.1 Å²	25.1	16%	0.159	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-27.8	-176.5	-172.1	163.7	-134.6	0	0	112.7	L210 R213 Y214	L210-E259 HydrophobicContact CD1-CB 4.26Å; R213-E259 IonicContact CZ-OE2 2.71Å; R213-E259 IonicContact NH1-OE2 2.74Å; R213-E259 PolarHBondContact NH1-OE2 3.18Å; R213-E259 IonicContact NH2-OE2 2.65Å; R213-E259 PolarHBondContact NH2-OE2 3.23Å; Y214-E259 VanDerWaalsContact CE2-OE1 3.26Å; Y214-E259 WeakPolarHBondContact CE2-OE1 3.47Å; Y214-E259 PolarHBondContact OH-OE1 3.13Å
260	D	93.3	Very high	97	Very high	141 Å²	141	25.9 Å²	25.9	75%	0.754	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-29.7	178.6	-57.6	-46.9	0	0	0	112.6	N258 V424	N258-D260 WeakPolarHBondContact OD1-CB 3.39Å; N258-D260 PolarHBondContact OD1-N 2.89Å; D260-V424 VanDerWaalsContact O-CG1 3.28Å; D260-V424 WeakPolarHBondContact O-CG1 3.45Å
261	T	94.5	Very high	96.9	Very high	66 Å²	66	27 Å²	27	41%	0.405	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-5.5	176.2	65.2	0	0	0	0	113.7	N258 V263	N258-T261 WeakPolarHBondContact CB-OG1 3.23Å; N258-T261 PolarHBondContact OD1-N 3.31Å; N258-T261 PolarHBondContact OD1-OG1 2.86Å; T261-V263 PolarHBondContact O-N 3.44Å; T261-V263 VanDerWaalsContact O-N 3.15Å
262	M	96.1	Very high	96.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	23.3	-173.6	-62.6	-78.6	-94.5	0	0	114.4	T225 V228 Q232 N258 L420 V424 P427	T225-M262 HydrophobicContact CG2-CE 4.27Å; T225-M262 HydrophobicContact CG2-SD 4.16Å; V228-M262 HydrophobicContact CB-CE 4.42Å; V228-M262 HydrophobicContact CG1-CB 4.04Å; V228-M262 WeakPolarHBondContact CG1-O 3.44Å; V228-M262 HydrophobicContact CG2-CE 4.46Å; Q232-M262 PolarHBondContact NE2-O 3.27Å; N258-M262 CarbonylContact O-C 3.57Å; N258-M262 WeakPolarHBondContact O-CA 3.39Å; N258-M262 PolarHBondContact O-N 3.39Å; M262-L420 HydrophobicContact CE-CD1 3.47Å; M262-L420 VanDerWaalsContact CE-CD1 3.47Å; M262-L420 HydrophobicContact CG-CD1 4.26Å; M262-V424 HydrophobicContact CB-CG1 4.48Å; M262-V424 HydrophobicContact CG-CB 4.04Å; M262-V424 HydrophobicContact CG-CG1 3.6Å; M262-P427 HydrophobicContact CB-CG 4.02Å; M262-P427 WeakPolarHBondContact O-CG 3.31Å
263	V	97	Very high	96.8	Very high	30 Å²	30	27.3 Å²	27.3	18%	0.182	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	136.4	177.7	175.8	0	0	0	0	110.8	F203 V257 N258 T261 K265 P427	F203-V263 HydrophobicContact CE1-CG1 4.26Å; F203-V263 HydrophobicContact CZ-CG1 3.99Å; V257-V263 WeakPolarHBondContact CA-O 3.45Å; N258-V263 PolarHBondContact N-O 3.27Å; N258-V263 PolarHBondContact O-N 3.45Å; T261-V263 PolarHBondContact O-N 3.44Å; T261-V263 VanDerWaalsContact O-N 3.15Å; V263-K265 HydrophobicContact CG1-CG 4.08Å; V263-P427 HydrophobicContact CG2-CB 4.3Å
264	L	98.2	Very high	96.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.1	167.6	173.2	152.5	0	0	0	110.9	N159 F229 Q232 M233 L255 L256 V257	N159-L264 WeakPolarHBondContact CB-O 3.49Å; N159-L264 PolarHBondContact ND2-O 3.28Å; F229-L264 HydrophobicContact CB-CD1 3.76Å; F229-L264 HydrophobicContact CD1-CB 3.74Å; F229-L264 HydrophobicContact CD1-CD1 4.29Å; F229-L264 HydrophobicContact CE1-CB 4.33Å; F229-L264 HydrophobicContact CG-CB 4.44Å; F229-L264 HydrophobicContact CG-CD1 4.15Å; Q232-L264 HydrophobicContact CB-CB 4.07Å; Q232-L264 HydrophobicContact CB-CD2 4.1Å; Q232-L264 VanDerWaalsContact OE1-N 3.1Å; M233-L264 HydrophobicContact CB-CD2 4.16Å; L255-L264 HydrophobicContact CB-CD1 4.25Å; L255-L264 HydrophobicContact CD2-CD2 4.3Å; L256-L264 CarbonylContact O-C 3.4Å; L256-L264 VanDerWaalsContact O-CA 3.28Å; L256-L264 WeakPolarHBondContact O-CA 3.37Å; V257-L264 HydrophobicContact CG1-CB 4.13Å; V257-L264 HydrophobicContact CG1-CD1 3.89Å; V257-L264 HydrophobicContact CG1-CG 4.09Å
265	K	98.4	Very high	96.7	Very high	25 Å²	25	29.1 Å²	29.1	11%	0.109	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.1	173	-54.9	-163.7	-177.9	-168	0	113.2	P158 N159 E201 F203 L256 V263	P158-K265 WeakPolarHBondContact O-CD 3.31Å; P158-K265 WeakPolarHBondContact O-CE 3.44Å; N159-K265 CarbonylContact O-C 3.58Å; N159-K265 WeakPolarHBondContact O-CA 3.38Å; E201-K265 WeakPolarHBondContact OE1-CE 3.5Å; E201-K265 IonicContact OE1-NZ 3.6Å; E201-K265 PolarHBondContact OE1-NZ 2.96Å; E201-K265 VanDerWaalsContact OE2-CD 3.3Å; E201-K265 WeakPolarHBondContact OE2-CD 3.44Å; E201-K265 WeakPolarHBondContact OE2-CE 3.31Å; E201-K265 IonicContact OE2-NZ 3.24Å; E201-K265 PolarHBondContact OE2-NZ 3.27Å; F203-K265 HydrophobicContact CE1-CG 4.39Å; F203-K265 HydrophobicContact CE2-CD 3.69Å; F203-K265 HydrophobicContact CE2-CG 4.04Å; F203-K265 HydrophobicContact CZ-CB 4.31Å; F203-K265 HydrophobicContact CZ-CD 3.68Å; F203-K265 HydrophobicContact CZ-CG 3.62Å; L256-K265 PolarHBondContact N-O 2.96Å; L256-K265 PolarHBondContact O-N 2.82Å; V263-K265 HydrophobicContact CG1-CG 4.08Å
266	V	98.6	Very high	96.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	138	171.5	175.8	0	0	0	0	110.8	N159 V161 S236 H247 I250 L255 F269	N159-V266 PolarHBondContact O-N 2.83Å; V161-V266 WeakPolarHBondContact CB-O 3.44Å; V161-V266 WeakPolarHBondContact CG1-O 3.4Å; V161-V266 PolarHBondContact N-O 3.39Å; S236-V266 WeakPolarHBondContact OG-CG2 3.41Å; H247-V266 WeakPolarHBondContact CD2-CG1 3.42Å; H247-V266 WeakPolarHBondContact NE2-CG1 3.32Å; I250-V266 HydrophobicContact CD1-CG1 4.18Å; L255-V266 HydrophobicContact CD2-CG2 3.68Å; V266-F269 HydrophobicContact CB-CZ 4.49Å; V266-F269 HydrophobicContact CG1-CE2 4.17Å; V266-F269 HydrophobicContact CG1-CZ 3.93Å
267	C	97.4	Very high	96.3	Very high	16 Å²	16	36.8 Å²	36.8	11%	0.108	21%	0.211	C	C	.	.			trans	-133.9	-177.6	175.3	75.7	0	0	0	0	112.7	V161 H247 N254 L256	V161-C267 HydrophobicContact CB-CB 4.09Å; V161-C267 HydrophobicContact CG1-CB 3.83Å; H247-C267 PolarHBondContact CE1-O 3.3Å; H247-C267 VanDerWaalsContact CE1-O 3.3Å; H247-C267 PolarHBondContact NE2-O 3.11Å; N254-C267 PolarHBondContact O-N 2.85Å; N254-C267 PolarHBondContact O-SG 3.06Å; L256-C267 HydrophobicContact CD1-CB 3.72Å; L256-C267 HydrophobicContact CG-CB 3.93Å
268	D	95.8	Very high	96	Very high	44 Å²	44	40.2 Å²	40.2	24%	0.235	25%	0.246	C	C	.	.			trans	54.6	70.6	-178.1	-165.5	21.6	0	0	0	115.4	K135 H247 G270	K135-D268 IonicContact NZ-OD1 3.43Å; K135-D268 PolarHBondContact NZ-OD1 3.46Å; H247-D268 PolarHBondContact CE1-O 3.05Å; H247-D268 VanDerWaalsContact NE2-C 3.35Å; H247-D268 PolarHBondContact NE2-O 3.07Å; H247-D268 VanDerWaalsContact NE2-O 3.12Å; D268-G270 PolarHBondContact O-N 2.67Å
269	F	96.8	Very high	96	Very high	1 Å²	1	41.3 Å²	41.3	0%	0.004	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-79.7	13	177.7	-71.8	-98.3	0	0	0	113.1	E147 I150 M151 L154 V160 L240 V266 S271 A272	E147-F269 HydrophobicContact CG-CB 3.98Å; E147-F269 PolarHBondContact OE1-N 2.92Å; I150-F269 HydrophobicContact CG2-CB 4.38Å; I150-F269 HydrophobicContact CG2-CD1 3.67Å; I150-F269 HydrophobicContact CG2-CE1 4.37Å; I150-F269 HydrophobicContact CG2-CG 4.33Å; M151-F269 HydrophobicContact CE-CD2 4.07Å; M151-F269 HydrophobicContact CG-CB 3.87Å; M151-F269 HydrophobicContact CG-CD2 4Å; M151-F269 HydrophobicContact CG-CG 4.03Å; M151-F269 HydrophobicContact SD-CB 4.26Å; M151-F269 HydrophobicContact SD-CD2 4.23Å; L154-F269 HydrophobicContact CD1-CD1 4.16Å; L154-F269 HydrophobicContact CD1-CE1 3.56Å; L154-F269 HydrophobicContact CD1-CZ 4.28Å; V160-F269 HydrophobicContact CG1-CE2 3.89Å; V160-F269 HydrophobicContact CG1-CZ 3.78Å; V160-F269 HydrophobicContact CG2-CZ 4.34Å; L240-F269 HydrophobicContact CD1-CE1 4.17Å; L240-F269 HydrophobicContact CD1-CZ 4.35Å; L240-F269 HydrophobicContact CD2-CE1 3.93Å; L240-F269 HydrophobicContact CG-CE1 4.28Å; V266-F269 HydrophobicContact CB-CZ 4.49Å; V266-F269 HydrophobicContact CG1-CE2 4.17Å; V266-F269 HydrophobicContact CG1-CZ 3.93Å; F269-S271 PolarHBondContact O-N 2.86Å; F269-A272 HydrophobicContact CB-CB 4.15Å; F269-A272 HydrophobicContact CD1-CB 4Å; F269-A272 VanDerWaalsContact O-CB 3.29Å; F269-A272 WeakPolarHBondContact O-CB 3.39Å; F269-A272 PolarHBondContact O-N 2.97Å
270	G	95.2	Very high	96.1	Very high	27 Å²	27	41.9 Å²	41.9	28%	0.278	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-60.7	-31.1	178.8	0	0	0	0	0	113.6	E147 D268	E147-G270 VanDerWaalsContact CD-N 3.27Å; E147-G270 PolarHBondContact OE1-N 2.97Å; E147-G270 WeakPolarHBondContact OE2-CA 3.19Å; D268-G270 PolarHBondContact O-N 2.67Å
271	S	96.4	Very high	96.2	Very high	25 Å²	25	35.7 Å²	35.7	18%	0.175	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-84.8	-13.7	174.6	-70.9	0	0	0	0	113.9	H247 R248 F269	H247-S271 CarbonylContact O-C 3.55Å; H247-S271 VanDerWaalsContact O-C 3.24Å; H247-S271 WeakPolarHBondContact O-CB 3.45Å; R248-S271 VanDerWaalsContact CZ-O 3.22Å; R248-S271 PolarHBondContact NE-O 3.47Å; R248-S271 PolarHBondContact NH2-O 3.12Å; F269-S271 PolarHBondContact O-N 2.86Å
272	A	97.7	Very high	96.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	24%	0.24	C	C	.	.			trans	-66.4	155.7	-167.9	0	0	0	0	0	113.6	R146 I150 I245 C246 H247 F269	R146-A272 WeakPolarHBondContact CD-O 3.12Å; R146-A272 PolarHBondContact NH1-O 2.81Å; I150-A272 HydrophobicContact CD1-CB 3.71Å; I150-A272 HydrophobicContact CG2-CB 4.31Å; I245-A272 HydrophobicContact CG2-CB 4.43Å; C246-A272 CarbonylContact O-C 3.45Å; C246-A272 VanDerWaalsContact O-CA 3.24Å; C246-A272 WeakPolarHBondContact O-CA 3.46Å; H247-A272 WeakPolarHBondContact O-CA 3.36Å; H247-A272 PolarHBondContact O-N 2.85Å; F269-A272 HydrophobicContact CB-CB 4.15Å; F269-A272 HydrophobicContact CD1-CB 4Å; F269-A272 VanDerWaalsContact O-CB 3.29Å; F269-A272 WeakPolarHBondContact O-CB 3.39Å; F269-A272 PolarHBondContact O-N 2.97Å
273	K	97.1	Very high	96.3	Very high	39 Å²	39	38.6 Å²	38.6	17%	0.17	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	142.1	175	-161.9	-158.6	163.4	-174.3	0	111.1	C246 M275 N281	C246-K273 PolarHBondContact N-O 3.49Å; C246-K273 PolarHBondContact O-N 2.76Å; K273-M275 HydrophobicContact CB-SD 4.38Å; K273-M275 HydrophobicContact CD-SD 4.37Å; K273-N281 WeakPolarHBondContact CD-OD1 3.37Å; K273-N281 PolarHBondContact NZ-OD1 3.17Å
274	E	97.1	Very high	96.2	Very high	87 Å²	87	45 Å²	45	41%	0.407	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	126.2	161.7	-171.5	164.3	-141.3	0	0	110.2	R153 Q244 I245 V276	R153-E274 IonicContact CZ-OE1 3.78Å; R153-E274 IonicContact NH1-OE1 3.18Å; R153-E274 PolarHBondContact NH1-OE1 2.79Å; R153-E274 IonicContact NH1-OE2 3.7Å; R153-E274 IonicContact NH2-OE1 2.9Å; Q244-E274 CarbonylContact O-C 3.24Å; Q244-E274 WeakPolarHBondContact O-CA 3.39Å; I245-E274 HydrophobicContact CG1-CB 4.44Å; E274-V276 PolarHBondContact O-N 2.96Å
275	M	96.8	Very high	96.1	Very high	13 Å²	13	46 Å²	46	6%	0.064	28%	0.278	C	S	.	.			trans	-95.8	86.7	-169.9	-62.8	-56.6	-68.6	0	0	110.6	Q244 C246 K273 P277 Y302	Q244-M275 PolarHBondContact O-N 3.26Å; C246-M275 HydrophobicContact CB-CG 3.38Å; C246-M275 HydrophobicContact CB-SD 3.83Å; K273-M275 HydrophobicContact CB-SD 4.38Å; K273-M275 HydrophobicContact CD-SD 4.37Å; M275-P277 WeakPolarHBondContact O-CD 3.42Å; M275-Y302 HydrophobicContact CE-CD2 3.58Å; M275-Y302 HydrophobicContact CE-CE2 3.51Å; M275-Y302 WeakPolarHBondContact CE-O 3.3Å; M275-Y302 HydrophobicContact SD-CE2 4.38Å
276	V	95.8	Very high	96.1	Very high	79 Å²	79	45.3 Å²	45.3	48%	0.479	28%	0.275	S	S	.	.			trans	-76.3	121.7	176.6	-176.7	0	0	0	0	110	E274 T279	E274-V276 PolarHBondContact O-N 2.96Å; V276-T279 VanDerWaalsContact O-CB 3.29Å; V276-T279 WeakPolarHBondContact O-CB 3.42Å; V276-T279 PolarHBondContact O-N 3.02Å; V276-T279 PolarHBondContact O-OG1 3.06Å
277	P	92.2	Very high	96	Very high	110 Å²	110	46.9 Å²	46.9	71%	0.714	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	145.6	176.5	-27.4	36.3	0	0	0	112.8	M275 T279	M275-P277 WeakPolarHBondContact O-CD 3.42Å; P277-T279 PolarHBondContact O-N 3.46Å
278	G	92.3	Very high	96	Very high	71 Å²	71	49.5 Å²	49.5	73%	0.732	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	-6.8	-176.6	0	0	0	0	0	115.6
279	T	95.1	Very high	96.1	Very high	60 Å²	60	49.5 Å²	49.5	37%	0.368	29%	0.291	S	S	.	.			trans	-88.2	124.7	175.2	-58.2	0	0	0	0	110.3	V276 P277 N281	V276-T279 VanDerWaalsContact O-CB 3.29Å; V276-T279 WeakPolarHBondContact O-CB 3.42Å; V276-T279 PolarHBondContact O-N 3.02Å; V276-T279 PolarHBondContact O-OG1 3.06Å; P277-T279 PolarHBondContact O-N 3.46Å; T279-N281 PolarHBondContact O-ND2 3.01Å
280	A	96	Very high	96.2	Very high	45 Å²	45	50.1 Å²	50.1	37%	0.372	29%	0.294	S	S	.	.			trans	-64.3	148.9	175.5	0	0	0	0	0	112.7	Q300 Y301	A280-Q300 HydrophobicContact CB-CB 4.27Å; A280-Y301 HydrophobicContact CB-CE1 4.09Å
281	N	96.6	Very high	96.3	Very high	12 Å²	12	49.5 Å²	49.5	6%	0.064	28%	0.283	C	S	.	.			trans	-132.8	150.5	-178	-55.2	-80.8	0	0	0	111	K273 T279 S283 Q300 Y302	K273-N281 WeakPolarHBondContact CD-OD1 3.37Å; K273-N281 PolarHBondContact NZ-OD1 3.17Å; T279-N281 PolarHBondContact O-ND2 3.01Å; N281-S283 PolarHBondContact O-N 3.44Å; N281-Q300 WeakPolarHBondContact CB-O 3.36Å; N281-Q300 PolarHBondContact N-O 3.06Å; N281-Q300 PolarHBondContact ND2-O 2.93Å; N281-Q300 VanDerWaalsContact ND2-O 3.11Å; N281-Q300 WeakPolarHBondContact O-CA 3.35Å; N281-Y302 HydrophobicContact CB-CD1 4.38Å; N281-Y302 HydrophobicContact CB-CE1 3.58Å; N281-Y302 HydrophobicContact CB-CE2 4.22Å; N281-Y302 VanDerWaalsContact CB-CZ 3.49Å; N281-Y302 WeakPolarHBondContact CB-OH 3.24Å
282	V	96	Very high	96.4	Very high	97 Å²	97	48.3 Å²	48.3	59%	0.588	28%	0.275	S	S	*	.			trans	-65.5	125	172.3	179	0	0	0	0	109.2	I285 Y302	V282-I285 HydrophobicContact CG1-CG2 4.39Å; V282-I285 WeakPolarHBondContact O-CG1 3.27Å; V282-Y302 WeakPolarHBondContact O-CE1 3.43Å; V282-Y302 PolarHBondContact O-OH 3.15Å
283	S	95.6	Very high	96.4	Very high	29 Å²	29	48.3 Å²	48.3	20%	0.203	28%	0.275	C	S	.	.	S	Bend	trans	-80.2	-30.8	179.3	51.9	0	0	0	0	113.5	N281 I285 G298 A299	N281-S283 PolarHBondContact O-N 3.44Å; S283-I285 PolarHBondContact O-N 2.96Å; S283-G298 VanDerWaalsContact CB-C 3.5Å; S283-G298 WeakPolarHBondContact CB-O 3.48Å; S283-G298 PolarHBondContact OG-O 3.07Å; S283-A299 VanDerWaalsContact CB-O 3.3Å; S283-A299 WeakPolarHBondContact CB-O 3.37Å
284	Y	96.2	Very high	96.4	Very high	165 Å²	165	46.6 Å²	46.6	65%	0.647	27%	0.267	S	S	*	.	S	Bend	trans	-76.9	68.4	174.5	-162.8	-96.4	0	0	0	111.6
285	I	95.8	Very high	96.4	Very high	22 Å²	22	42.8 Å²	42.8	11%	0.113	25%	0.25	C	C	.	.			trans	-129.9	-179.3	171	53.3	61.7	0	0	0	109.9	R248 V282 S283 R291 L295 Y302 I306	R248-I285 HydrophobicContact CB-CD1 4.09Å; R248-I285 HydrophobicContact CB-CG1 4.24Å; V282-I285 HydrophobicContact CG1-CG2 4.39Å; V282-I285 WeakPolarHBondContact O-CG1 3.27Å; S283-I285 PolarHBondContact O-N 2.96Å; I285-R291 PolarHBondContact O-NE 3.34Å; I285-R291 PolarHBondContact O-NH2 3.2Å; I285-L295 HydrophobicContact CD1-CD1 3.55Å; I285-L295 HydrophobicContact CD1-CD2 3.73Å; I285-L295 HydrophobicContact CD1-CG 4.26Å; I285-L295 HydrophobicContact CG1-CD2 4.48Å; I285-Y302 WeakPolarHBondContact CG1-OH 3.23Å; I285-I306 HydrophobicContact CD1-CD1 3.71Å
286	S	96.8	Very high	96.4	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.063	25%	0.253	C	S	.	.	S	Bend	trans	59.7	143.9	-170.4	-173.4	0	0	0	0	114.6	R248 R291	R248-S286 WeakPolarHBondContact O-CA 3.45Å; R248-S286 WeakPolarHBondContact O-CB 3.43Å; R248-S286 PolarHBondContact O-N 3.07Å; S286-R291 PolarHBondContact O-NE 2.85Å; S286-R291 PolarHBondContact O-NH2 3.44Å
287	S	96.7	Very high	96.2	Very high	33 Å²	33	39.9 Å²	39.9	23%	0.231	23%	0.231	C	C	.	.			trans	-66.9	136.4	175	-61.9	0	0	0	0	110.5	D249 K251 Y289 Y290 R291	D249-S287 WeakPolarHBondContact OD1-CB 3.21Å; D249-S287 PolarHBondContact OD1-N 2.91Å; D249-S287 PolarHBondContact OD1-OG 3.15Å; K251-S287 WeakPolarHBondContact CD-OG 3.49Å; K251-S287 WeakPolarHBondContact CE-OG 3.25Å; K251-S287 PolarHBondContact NZ-OG 3.01Å; S287-Y289 PolarHBondContact O-N 3.37Å; S287-Y289 VanDerWaalsContact O-N 3.09Å; S287-Y290 PolarHBondContact O-N 3.4Å; S287-R291 PolarHBondContact O-N 2.93Å
288	R	97.5	Very high	96.3	Very high	71 Å²	71	36 Å²	36	27%	0.268	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-51.1	-47.5	-157.2	-169.4	-165.5	-66.5	145.6	-1.5	114.2	Y290 R291 G327 A328 Q333	R288-Y290 PolarHBondContact O-N 2.69Å; R288-R291 VanDerWaalsContact O-CB 3.3Å; R288-R291 WeakPolarHBondContact O-CB 3.43Å; R288-R291 PolarHBondContact O-N 3.46Å; R288-G327 WeakPolarHBondContact CD-O 3.3Å; R288-G327 PolarHBondContact NH1-O 2.93Å; R288-A328 VanDerWaalsContact NH1-C 3.33Å; R288-A328 PolarHBondContact NH1-O 2.68Å; R288-A328 PolarHBondContact NH2-O 2.62Å; R288-Q333 HydrophobicContact CG-CB 4.38Å; R288-Q333 HydrophobicContact CG-CG 4.25Å; R288-Q333 VanDerWaalsContact O-CD 3.24Å; R288-Q333 PolarHBondContact O-NE2 2.97Å
289	Y	98.1	Very high	96.5	Very high	44 Å²	44	32.9 Å²	32.9	17%	0.173	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-67	-18.2	-175.1	-52.7	-30.7	0	0	0	114.4	S287 C323 F325 M326 G327 Q333 E511	S287-Y289 PolarHBondContact O-N 3.37Å; S287-Y289 VanDerWaalsContact O-N 3.09Å; Y289-C323 HydrophobicContact CD2-CB 3.96Å; Y289-C323 VanDerWaalsContact CD2-SG 3.54Å; Y289-C323 HydrophobicContact CG-CB 4.21Å; Y289-F325 WeakPolarHBondContact CA-O 3.42Å; Y289-F325 WeakPolarHBondContact CB-O 3.42Å; Y289-F325 VanDerWaalsContact CD1-O 3.27Å; Y289-F325 WeakPolarHBondContact CD1-O 3.43Å; Y289-M326 HydrophobicContact CE1-CB 4.32Å; Y289-G327 WeakPolarHBondContact CE1-O 3.3Å; Y289-Q333 PolarHBondContact O-NE2 2.84Å; Y289-E511 PolarHBondContact OH-OE2 2.91Å
290	Y	98.6	Very high	96.5	Very high	15 Å²	15	34.2 Å²	34.2	6%	0.059	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-104.3	-6.9	-178.9	-52.6	-92.6	0	0	0	112	I250 K251 S252 S287 R288 A292 W309 S310 C313 V314 E317 C323	I250-Y290 WeakPolarHBondContact O-CB 3.4Å; K251-Y290 HydrophobicContact CB-CD1 3.97Å; K251-Y290 HydrophobicContact CB-CD2 3.6Å; K251-Y290 HydrophobicContact CB-CE1 3.89Å; K251-Y290 HydrophobicContact CB-CE2 3.54Å; K251-Y290 HydrophobicContact CB-CG 3.82Å; S252-Y290 PolarHBondContact OG-OH 2.86Å; S252-Y290 VanDerWaalsContact OG-OH 3.05Å; S287-Y290 PolarHBondContact O-N 3.4Å; R288-Y290 PolarHBondContact O-N 2.69Å; Y290-A292 PolarHBondContact O-N 3.43Å; Y290-W309 VanDerWaalsContact O-CD1 3.29Å; Y290-S310 PolarHBondContact O-OG 3.48Å; Y290-S310 VanDerWaalsContact O-OG 3.06Å; Y290-C313 HydrophobicContact CD1-CB 3.8Å; Y290-C313 HydrophobicContact CE1-CB 4.48Å; Y290-V314 HydrophobicContact CD1-CG2 3.87Å; Y290-V314 HydrophobicContact CE1-CG2 3.67Å; Y290-E317 PolarHBondContact OH-OE1 3.49Å; Y290-E317 PolarHBondContact OH-OE2 3.24Å; Y290-C323 PolarHBondContact OH-SG 2.92Å
291	R	98.4	Very high	96.5	Very high	14 Å²	14	38.6 Å²	38.6	5%	0.053	19%	0.188	C	C	.	.			trans	-66.8	125.2	-173.6	-173.8	175.6	-66.8	156.5	1.3	111.5	I285 S286 S287 R288 L295 L296 W309	I285-R291 PolarHBondContact O-NE 3.34Å; I285-R291 PolarHBondContact O-NH2 3.2Å; S286-R291 PolarHBondContact O-NE 2.85Å; S286-R291 PolarHBondContact O-NH2 3.44Å; S287-R291 PolarHBondContact O-N 2.93Å; R288-R291 VanDerWaalsContact O-CB 3.3Å; R288-R291 WeakPolarHBondContact O-CB 3.43Å; R288-R291 PolarHBondContact O-N 3.46Å; R291-L295 HydrophobicContact CG-CB 3.65Å; R291-L295 HydrophobicContact CG-CD1 3.84Å; R291-L295 HydrophobicContact CG-CG 4.42Å; R291-L296 HydrophobicContact CG-CD2 4.12Å; R291-L296 HydrophobicContact CG-CG 4.44Å; R291-W309 PolarHBondContact O-NE1 3.37Å
292	A	98.5	Very high	96.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.			trans	-64.1	146.8	176	0	0	0	0	0	112.4	Y290 E294 L295 L296 I306 W309	Y290-A292 PolarHBondContact O-N 3.43Å; A292-E294 VanDerWaalsContact C-N 3.34Å; A292-E294 VanDerWaalsContact CB-OE2 3.26Å; A292-E294 WeakPolarHBondContact CB-OE2 3.44Å; A292-E294 PolarHBondContact O-N 3.45Å; A292-L295 HydrophobicContact CB-CD1 4.02Å; A292-L295 HydrophobicContact CB-CG 4.46Å; A292-L295 VanDerWaalsContact O-CB 3.31Å; A292-L295 WeakPolarHBondContact O-CB 3.47Å; A292-L295 PolarHBondContact O-N 3.28Å; A292-L296 PolarHBondContact O-N 3.36Å; A292-I306 HydrophobicContact CB-CB 3.9Å; A292-I306 HydrophobicContact CB-CG2 3.82Å; A292-W309 HydrophobicContact CB-CB 3.87Å; A292-W309 HydrophobicContact CB-CD2 4.37Å; A292-W309 HydrophobicContact CB-CG 3.72Å
293	P	97.6	Very high	96.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-33.2	-169.2	26.2	-35.9	0	0	0	113.3	L295 L296 F297 W309 M352 Y391	P293-L295 PolarHBondContact O-N 3.4Å; P293-L296 WeakPolarHBondContact O-CA 3.35Å; P293-L296 VanDerWaalsContact O-CB 3.31Å; P293-L296 WeakPolarHBondContact O-CB 3.49Å; P293-L296 PolarHBondContact O-N 3.43Å; P293-F297 VanDerWaalsContact O-CD2 3.22Å; P293-F297 WeakPolarHBondContact O-CD2 3.4Å; P293-F297 PolarHBondContact O-N 3.06Å; P293-W309 HydrophobicContact CG-CE3 4.23Å; P293-W309 HydrophobicContact CG-CH2 4.05Å; P293-W309 HydrophobicContact CG-CZ2 4.42Å; P293-W309 HydrophobicContact CG-CZ3 3.94Å; P293-M352 HydrophobicContact CB-SD 3.59Å; P293-M352 VanDerWaalsContact CB-SD 3.59Å; P293-M352 HydrophobicContact CG-SD 3.58Å; P293-M352 VanDerWaalsContact CG-SD 3.58Å; P293-Y391 HydrophobicContact CB-CD1 4.18Å; P293-Y391 HydrophobicContact CB-CE1 4.44Å; P293-Y391 HydrophobicContact CG-CD1 4.02Å
294	E	97.5	Very high	96.7	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	17%	0.174	C	C	.	.	H	α-helix	trans	-57.9	-30.2	173.8	63.7	-88.8	-137.3	0	0	113.2	A292 F297 G298 A299 I306 M352 P393 R396	A292-E294 VanDerWaalsContact C-N 3.34Å; A292-E294 VanDerWaalsContact CB-OE2 3.26Å; A292-E294 WeakPolarHBondContact CB-OE2 3.44Å; A292-E294 PolarHBondContact O-N 3.45Å; E294-F297 CarbonylContact O-C 3.49Å; E294-F297 PolarHBondContact O-N 2.86Å; E294-G298 PolarHBondContact O-N 3.01Å; E294-G298 VanDerWaalsContact O-N 3.13Å; E294-A299 HydrophobicContact CB-CB 4.06Å; E294-A299 WeakPolarHBondContact O-CB 3.28Å; E294-A299 PolarHBondContact O-N 2.85Å; E294-I306 HydrophobicContact CG-CG2 4.16Å; E294-I306 VanDerWaalsContact OE1-CG2 3.3Å; E294-I306 WeakPolarHBondContact OE1-CG2 3.48Å; E294-M352 HydrophobicContact CB-CB 3.87Å; E294-M352 HydrophobicContact CB-CG 4.2Å; E294-M352 WeakPolarHBondContact CB-O 3.44Å; E294-P393 HydrophobicContact CB-CG 4.44Å; E294-P393 HydrophobicContact CG-CG 4.25Å; E294-P393 WeakPolarHBondContact OE1-CG 3.22Å; E294-R396 IonicContact OE1-CZ 2.71Å; E294-R396 IonicContact OE1-NH1 3.22Å; E294-R396 PolarHBondContact OE1-NH1 2.83Å; E294-R396 IonicContact OE1-NH2 2.65Å; E294-R396 PolarHBondContact OE1-NH2 2.69Å; E294-R396 IonicContact OE2-CZ 3.1Å; E294-R396 IonicContact OE2-NH1 3.57Å; E294-R396 PolarHBondContact OE2-NH1 2.98Å; E294-R396 IonicContact OE2-NH2 2.74Å; E294-R396 PolarHBondContact OE2-NH2 2.94Å
295	L	97.4	Very high	96.8	Very high	8 Å²	8	29 Å²	29	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-76.3	-28.9	175.8	-56.8	165	0	0	0	111.6	I285 R291 A292 P293 G298 Y302 I306	I285-L295 HydrophobicContact CD1-CD1 3.55Å; I285-L295 HydrophobicContact CD1-CD2 3.73Å; I285-L295 HydrophobicContact CD1-CG 4.26Å; I285-L295 HydrophobicContact CG1-CD2 4.48Å; R291-L295 HydrophobicContact CG-CB 3.65Å; R291-L295 HydrophobicContact CG-CD1 3.84Å; R291-L295 HydrophobicContact CG-CG 4.42Å; A292-L295 HydrophobicContact CB-CD1 4.02Å; A292-L295 HydrophobicContact CB-CG 4.46Å; A292-L295 VanDerWaalsContact O-CB 3.31Å; A292-L295 WeakPolarHBondContact O-CB 3.47Å; A292-L295 PolarHBondContact O-N 3.28Å; P293-L295 PolarHBondContact O-N 3.4Å; L295-G298 PolarHBondContact O-N 3.37Å; L295-G298 VanDerWaalsContact O-N 3.17Å; L295-Y302 HydrophobicContact CD2-CD1 3.47Å; L295-Y302 VanDerWaalsContact CD2-CD1 3.47Å; L295-Y302 HydrophobicContact CD2-CD2 4.44Å; L295-Y302 HydrophobicContact CD2-CE1 3.52Å; L295-Y302 HydrophobicContact CD2-CG 3.95Å; L295-I306 HydrophobicContact CD1-CB 4.12Å; L295-I306 HydrophobicContact CD1-CD1 4Å; L295-I306 HydrophobicContact CD1-CG2 3.95Å; L295-I306 HydrophobicContact CD2-CD1 4.47Å; L295-I306 HydrophobicContact CD2-CG2 4.39Å; L295-I306 HydrophobicContact CG-CG2 4.13Å
296	L	95.3	Very high	96.9	Very high	27 Å²	27	28 Å²	28	14%	0.141	14%	0.144	C	C	.	.	H	α-helix	trans	-70.9	-37.2	170.1	-55.3	173.9	0	0	0	110.8	R291 A292 P293 G298 Q333 L334	R291-L296 HydrophobicContact CG-CD2 4.12Å; R291-L296 HydrophobicContact CG-CG 4.44Å; A292-L296 PolarHBondContact O-N 3.36Å; P293-L296 WeakPolarHBondContact O-CA 3.35Å; P293-L296 VanDerWaalsContact O-CB 3.31Å; P293-L296 WeakPolarHBondContact O-CB 3.49Å; P293-L296 PolarHBondContact O-N 3.43Å; L296-G298 PolarHBondContact O-N 3.04Å; L296-Q333 HydrophobicContact CD1-CB 4.2Å; L296-Q333 HydrophobicContact CD1-CG 3.79Å; L296-Q333 HydrophobicContact CD2-CB 4.21Å; L296-Q333 HydrophobicContact CD2-CG 4.02Å; L296-L334 HydrophobicContact CD1-CB 4.03Å; L296-L334 HydrophobicContact CD1-CD1 4.34Å
297	F	92.9	Very high	97	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.018	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	3	167.2	-72.1	-74.3	0	0	0	113.7	P293 E294 A299 L334 I349 M352 N353 Y356 F361	P293-F297 VanDerWaalsContact O-CD2 3.22Å; P293-F297 WeakPolarHBondContact O-CD2 3.4Å; P293-F297 PolarHBondContact O-N 3.06Å; E294-F297 CarbonylContact O-C 3.49Å; E294-F297 PolarHBondContact O-N 2.86Å; F297-A299 VanDerWaalsContact C-N 3.34Å; F297-A299 PolarHBondContact O-N 3.31Å; F297-L334 HydrophobicContact CE1-CD2 4.36Å; F297-L334 HydrophobicContact CE2-CD1 4.05Å; F297-L334 HydrophobicContact CE2-CD2 4.25Å; F297-L334 HydrophobicContact CZ-CD1 4.38Å; F297-L334 HydrophobicContact CZ-CD2 3.92Å; F297-I349 HydrophobicContact CE1-CG2 4.46Å; F297-I349 HydrophobicContact CZ-CG1 4.4Å; F297-M352 HydrophobicContact CD2-CB 4.29Å; F297-M352 HydrophobicContact CD2-CE 3.91Å; F297-M352 HydrophobicContact CD2-SD 3.95Å; F297-M352 HydrophobicContact CE2-CE 3.43Å; F297-M352 VanDerWaalsContact CE2-CE 3.43Å; F297-M352 HydrophobicContact CE2-SD 3.93Å; F297-M352 HydrophobicContact CZ-CE 4.21Å; F297-N353 HydrophobicContact CB-CB 4.07Å; F297-N353 PolarHBondContact O-ND2 3.02Å; F297-Y356 HydrophobicContact CB-CD2 4.23Å; F297-Y356 AromaticContact CD1-CD1 3.69Å; F297-Y356 HydrophobicContact CD1-CD1 3.69Å; F297-Y356 AromaticContact CD1-CD2 3.91Å; F297-Y356 HydrophobicContact CD1-CD2 3.91Å; F297-Y356 AromaticContact CD1-CE1 3.67Å; F297-Y356 HydrophobicContact CD1-CE1 3.67Å; F297-Y356 AromaticContact CD1-CE2 3.89Å; F297-Y356 HydrophobicContact CD1-CE2 3.89Å; F297-Y356 AromaticContact CD1-CG 3.81Å; F297-Y356 HydrophobicContact CD1-CG 3.81Å; F297-Y356 AromaticContact CD1-CZ 3.77Å; F297-Y356 HydrophobicContact CE1-CD1 4.01Å; F297-Y356 AromaticContact CE1-CE1 3.84Å; F297-Y356 HydrophobicContact CE1-CE1 3.84Å; F297-Y356 WeakPolarHBondContact O-CD2 3.34Å; F297-F361 HydrophobicContact CE1-CE2 4.04Å; F297-F361 AromaticContact CE1-CZ 3.72Å; F297-F361 HydrophobicContact CE1-CZ 3.72Å; F297-F361 AromaticContact CZ-CE2 3.83Å; F297-F361 HydrophobicContact CZ-CE2 3.83Å; F297-F361 AromaticContact CZ-CZ 3.6Å; F297-F361 HydrophobicContact CZ-CZ 3.6Å
298	G	93.8	Very high	97.1	Very high	28 Å²	28	26.1 Å²	26.1	29%	0.289	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	14.4	172.7	0	0	0	0	0	115.8	S283 E294 L295 L296 Q300	S283-G298 VanDerWaalsContact CB-C 3.5Å; S283-G298 WeakPolarHBondContact CB-O 3.48Å; S283-G298 PolarHBondContact OG-O 3.07Å; E294-G298 PolarHBondContact O-N 3.01Å; E294-G298 VanDerWaalsContact O-N 3.13Å; L295-G298 PolarHBondContact O-N 3.37Å; L295-G298 VanDerWaalsContact O-N 3.17Å; L296-G298 PolarHBondContact O-N 3.04Å; G298-Q300 PolarHBondContact O-N 3.07Å
299	A	95.5	Very high	97.2	Very high	5 Å²	5	22.8 Å²	22.8	4%	0.041	12%	0.118	C	C	.	.			trans	-55.5	133.5	-176.2	0	0	0	0	0	112.7	S283 E294 F297 Y302 M352 N353	S283-A299 VanDerWaalsContact CB-O 3.3Å; S283-A299 WeakPolarHBondContact CB-O 3.37Å; E294-A299 HydrophobicContact CB-CB 4.06Å; E294-A299 WeakPolarHBondContact O-CB 3.28Å; E294-A299 PolarHBondContact O-N 2.85Å; F297-A299 VanDerWaalsContact C-N 3.34Å; F297-A299 PolarHBondContact O-N 3.31Å; A299-Y302 WeakPolarHBondContact O-CD1 3.3Å; A299-M352 WeakPolarHBondContact CB-O 3.33Å; A299-N353 HydrophobicContact CB-CB 4.09Å
300	Q	95.9	Very high	97.2	Very high	88 Å²	88	20.7 Å²	20.7	41%	0.411	11%	0.109	S	C	.	.	S	Bend	trans	-97.4	-18.2	177	-60.4	-176.4	10.9	0	0	113.1	A280 N281 G298	A280-Q300 HydrophobicContact CB-CB 4.27Å; N281-Q300 WeakPolarHBondContact CB-O 3.36Å; N281-Q300 PolarHBondContact N-O 3.06Å; N281-Q300 PolarHBondContact ND2-O 2.93Å; N281-Q300 VanDerWaalsContact ND2-O 3.11Å; N281-Q300 WeakPolarHBondContact O-CA 3.35Å; G298-Q300 PolarHBondContact O-N 3.07Å
301	Y	95.7	Very high	97.3	Very high	137 Å²	137	20 Å²	20	54%	0.537	11%	0.107	S	C	.	.	S	Bend	trans	-109.3	47.4	-175	-59	-76.3	0	0	0	111.7	A280 M355	A280-Y301 HydrophobicContact CB-CE1 4.09Å; Y301-M355 HydrophobicContact CE2-CE 4.15Å
302	Y	96.8	Very high	97.3	Very high	18 Å²	18	19.3 Å²	19.3	7%	0.071	10%	0.104	C	C	.	.			trans	-82.5	162.2	174	58.5	-97.7	0	0	0	112.4	R248 M275 N281 V282 I285 L295 A299 I306	R248-Y302 PolarHBondContact NH1-OH 3.34Å; M275-Y302 HydrophobicContact CE-CD2 3.58Å; M275-Y302 HydrophobicContact CE-CE2 3.51Å; M275-Y302 WeakPolarHBondContact CE-O 3.3Å; M275-Y302 HydrophobicContact SD-CE2 4.38Å; N281-Y302 HydrophobicContact CB-CD1 4.38Å; N281-Y302 HydrophobicContact CB-CE1 3.58Å; N281-Y302 HydrophobicContact CB-CE2 4.22Å; N281-Y302 VanDerWaalsContact CB-CZ 3.49Å; N281-Y302 WeakPolarHBondContact CB-OH 3.24Å; V282-Y302 WeakPolarHBondContact O-CE1 3.43Å; V282-Y302 PolarHBondContact O-OH 3.15Å; I285-Y302 WeakPolarHBondContact CG1-OH 3.23Å; L295-Y302 HydrophobicContact CD2-CD1 3.47Å; L295-Y302 VanDerWaalsContact CD2-CD1 3.47Å; L295-Y302 HydrophobicContact CD2-CD2 4.44Å; L295-Y302 HydrophobicContact CD2-CE1 3.52Å; L295-Y302 HydrophobicContact CD2-CG 3.95Å; A299-Y302 WeakPolarHBondContact O-CD1 3.3Å; Y302-I306 HydrophobicContact CD2-CD1 3.74Å; Y302-I306 HydrophobicContact CD2-CG1 4.33Å; Y302-I306 HydrophobicContact CD2-CG2 4.19Å; Y302-I306 HydrophobicContact CE2-CD1 3.63Å; Y302-I306 HydrophobicContact CG-CG2 4.32Å
303	S	97.2	Very high	97.3	Very high	62 Å²	62	19.4 Å²	19.4	43%	0.434	11%	0.105	S	C	.	.			trans	-112	-175.1	175.9	72.5	0	0	0	0	111.5	A305 I306	S303-A305 PolarHBondContact O-N 2.83Å; S303-A305 WeakPolarHBondContact OG-CB 3.33Å; S303-A305 PolarHBondContact OG-N 2.99Å; S303-I306 PolarHBondContact O-N 2.73Å
304	C	98.3	Very high	97.3	Very high	9 Å²	9	19.4 Å²	19.4	6%	0.061	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-9.7	173.4	-47.4	0	0	0	0	114	H241 C246 I306 D307	H241-C304 HydrophobicContact CB-CB 4.36Å; H241-C304 PolarHBondContact CE1-O 2.8Å; H241-C304 PolarHBondContact NE2-O 3.18Å; C246-C304 HydrophobicContact CB-CB 4.26Å; C304-I306 PolarHBondContact O-N 3.05Å; C304-D307 PolarHBondContact O-N 3.05Å
305	A	98.5	Very high	97.4	Very high	14 Å²	14	19.3 Å²	19.3	12%	0.116	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-12.8	175.8	0	0	0	0	0	114.3	S303 D307 W309 P393 R396	S303-A305 PolarHBondContact O-N 2.83Å; S303-A305 WeakPolarHBondContact OG-CB 3.33Å; S303-A305 PolarHBondContact OG-N 2.99Å; A305-D307 VanDerWaalsContact C-N 3.34Å; A305-W309 PolarHBondContact O-N 3.41Å; A305-P393 HydrophobicContact CB-CB 4.12Å; A305-P393 WeakPolarHBondContact CB-O 3.41Å; A305-R396 PolarHBondContact O-NH1 3.31Å
306	I	98.7	Very high	97.4	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.6	-31.1	170.2	66	167.7	0	0	0	112.7	C246 R248 I285 A292 E294 L295 Y302 S303 C304 W309 S310	C246-I306 VanDerWaalsContact SG-CG1 3.56Å; R248-I306 HydrophobicContact CB-CD1 4.26Å; R248-I306 HydrophobicContact CG-CD1 4.11Å; I285-I306 HydrophobicContact CD1-CD1 3.71Å; A292-I306 HydrophobicContact CB-CB 3.9Å; A292-I306 HydrophobicContact CB-CG2 3.82Å; E294-I306 HydrophobicContact CG-CG2 4.16Å; E294-I306 VanDerWaalsContact OE1-CG2 3.3Å; E294-I306 WeakPolarHBondContact OE1-CG2 3.48Å; L295-I306 HydrophobicContact CD1-CB 4.12Å; L295-I306 HydrophobicContact CD1-CD1 4Å; L295-I306 HydrophobicContact CD1-CG2 3.95Å; L295-I306 HydrophobicContact CD2-CD1 4.47Å; L295-I306 HydrophobicContact CD2-CG2 4.39Å; L295-I306 HydrophobicContact CG-CG2 4.13Å; Y302-I306 HydrophobicContact CD2-CD1 3.74Å; Y302-I306 HydrophobicContact CD2-CG1 4.33Å; Y302-I306 HydrophobicContact CD2-CG2 4.19Å; Y302-I306 HydrophobicContact CE2-CD1 3.63Å; Y302-I306 HydrophobicContact CG-CG2 4.32Å; S303-I306 PolarHBondContact O-N 2.73Å; C304-I306 PolarHBondContact O-N 3.05Å; I306-W309 PolarHBondContact O-N 2.9Å; I306-S310 WeakPolarHBondContact O-CB 3.38Å; I306-S310 PolarHBondContact O-N 2.88Å; I306-S310 PolarHBondContact O-OG 3.39Å
307	D	98.9	Very high	97.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-77.6	-32.1	177.4	-68.8	-32.1	0	0	0	110.7	L237 H241 C246 H247 R248 I250 C304 A305 S310 G311	L237-D307 HydrophobicContact CD2-CB 4Å; H241-D307 IonicContact NE2-OD2 3.55Å; C246-D307 WeakPolarHBondContact CA-OD2 3.4Å; C246-D307 PolarHBondContact SG-OD2 2.85Å; H247-D307 PolarHBondContact N-OD2 2.67Å; R248-D307 PolarHBondContact N-OD1 2.91Å; I250-D307 HydrophobicContact CG1-CB 4.04Å; C304-D307 PolarHBondContact O-N 3.05Å; A305-D307 VanDerWaalsContact C-N 3.34Å; D307-S310 PolarHBondContact O-N 3.29Å; D307-G311 PolarHBondContact O-N 2.98Å
308	T	98.9	Very high	97.8	Very high	3 Å²	3	18.1 Å²	18.1	2%	0.018	10%	0.098	C	C	.	.	H	α-helix	trans	-57.8	-48.8	167.8	-58.9	0	0	0	0	111	S310 G311 G312 M388 R396 I397	T308-S310 PolarHBondContact O-N 2.9Å; T308-G311 PolarHBondContact O-N 3.22Å; T308-G312 PolarHBondContact O-N 3.45Å; T308-M388 HydrophobicContact CG2-CB 4.14Å; T308-M388 HydrophobicContact CG2-CE 4.36Å; T308-M388 HydrophobicContact CG2-CG 4.12Å; T308-M388 WeakPolarHBondContact O-CE 3.12Å; T308-R396 HydrophobicContact CG2-CB 4.08Å; T308-I397 VanDerWaalsContact CG2-O 3.23Å; T308-I397 WeakPolarHBondContact CG2-O 3.45Å
309	W	98.9	Very high	98	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.1	-47.6	175.4	172.9	-78.3	0	0	0	111.4	Y290 R291 A292 P293 A305 I306 G311 G312 C313 F325 V337 L341 L389	Y290-W309 VanDerWaalsContact O-CD1 3.29Å; R291-W309 PolarHBondContact O-NE1 3.37Å; A292-W309 HydrophobicContact CB-CB 3.87Å; A292-W309 HydrophobicContact CB-CD2 4.37Å; A292-W309 HydrophobicContact CB-CG 3.72Å; P293-W309 HydrophobicContact CG-CE3 4.23Å; P293-W309 HydrophobicContact CG-CH2 4.05Å; P293-W309 HydrophobicContact CG-CZ2 4.42Å; P293-W309 HydrophobicContact CG-CZ3 3.94Å; A305-W309 PolarHBondContact O-N 3.41Å; I306-W309 PolarHBondContact O-N 2.9Å; W309-G311 VanDerWaalsContact C-N 3.32Å; W309-G311 PolarHBondContact O-N 2.68Å; W309-G312 WeakPolarHBondContact O-CA 3.45Å; W309-G312 PolarHBondContact O-N 3.48Å; W309-C313 PolarHBondContact O-N 3.23Å; W309-F325 HydrophobicContact CH2-CE2 4.37Å; W309-F325 HydrophobicContact CH2-CZ 4.45Å; W309-F325 HydrophobicContact CZ2-CD2 4.31Å; W309-F325 AromaticContact CZ2-CE2 3.67Å; W309-F325 HydrophobicContact CZ2-CE2 3.67Å; W309-F325 HydrophobicContact CZ2-CZ 4.15Å; W309-V337 HydrophobicContact CH2-CG1 3.67Å; W309-V337 HydrophobicContact CH2-CG2 4.36Å; W309-V337 HydrophobicContact CZ2-CG1 4.07Å; W309-V337 HydrophobicContact CZ2-CG2 3.9Å; W309-L341 HydrophobicContact CH2-CD1 3.66Å; W309-L341 HydrophobicContact CZ3-CD1 3.87Å; W309-L389 HydrophobicContact CD2-CD2 3.76Å; W309-L389 HydrophobicContact CE3-CB 4.45Å; W309-L389 HydrophobicContact CE3-CD2 3.96Å; W309-L389 HydrophobicContact CG-CD2 4.2Å; W309-L389 HydrophobicContact CH2-CD2 4.39Å; W309-L389 HydrophobicContact CZ2-CD2 4.21Å; W309-L389 HydrophobicContact CZ3-CB 4.21Å; W309-L389 HydrophobicContact CZ3-CD2 4.28Å; W309-L389 WeakPolarHBondContact O-CD2 3.28Å
310	S	98.9	Very high	97.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60	-40.7	-179.8	-56.6	0	0	0	0	111.9	Y290 I306 D307 T308 G312 C313 V314	Y290-S310 PolarHBondContact O-OG 3.48Å; Y290-S310 VanDerWaalsContact O-OG 3.06Å; I306-S310 WeakPolarHBondContact O-CB 3.38Å; I306-S310 PolarHBondContact O-N 2.88Å; I306-S310 PolarHBondContact O-OG 3.39Å; D307-S310 PolarHBondContact O-N 3.29Å; T308-S310 PolarHBondContact O-N 2.9Å; S310-G312 VanDerWaalsContact C-N 3.33Å; S310-G312 PolarHBondContact O-N 3.47Å; S310-C313 WeakPolarHBondContact O-CB 3.42Å; S310-C313 PolarHBondContact O-N 3.02Å; S310-V314 PolarHBondContact O-N 3.37Å
311	G	98.9	Very high	97.9	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.2	-32.4	171.5	0	0	0	0	0	113.3	M233 D307 T308 W309 V314 L315	M233-G311 WeakPolarHBondContact CE-O 3.37Å; D307-G311 PolarHBondContact O-N 2.98Å; T308-G311 PolarHBondContact O-N 3.22Å; W309-G311 VanDerWaalsContact C-N 3.32Å; W309-G311 PolarHBondContact O-N 2.68Å; G311-V314 PolarHBondContact O-N 2.81Å; G311-L315 PolarHBondContact O-N 3.11Å
312	G	98.7	Very high	97.9	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63.4	-40.3	171	0	0	0	0	0	112	T308 W309 S310 L315 A316	T308-G312 PolarHBondContact O-N 3.45Å; W309-G312 WeakPolarHBondContact O-CA 3.45Å; W309-G312 PolarHBondContact O-N 3.48Å; S310-G312 VanDerWaalsContact C-N 3.33Å; S310-G312 PolarHBondContact O-N 3.47Å; G312-L315 PolarHBondContact O-N 3.02Å; G312-A316 WeakPolarHBondContact O-CB 3.49Å; G312-A316 PolarHBondContact O-N 3.19Å
313	C	98.7	Very high	97.9	Very high	3 Å²	3	14.3 Å²	14.3	2%	0.02	8%	0.077	C	C	.	.	H	α-helix	trans	-64.2	-38.9	172	-65.8	0	0	0	0	112.6	Y290 W309 S310 A316 E317 F325	Y290-C313 HydrophobicContact CD1-CB 3.8Å; Y290-C313 HydrophobicContact CE1-CB 4.48Å; W309-C313 PolarHBondContact O-N 3.23Å; S310-C313 WeakPolarHBondContact O-CB 3.42Å; S310-C313 PolarHBondContact O-N 3.02Å; C313-A316 WeakPolarHBondContact O-CB 3.42Å; C313-A316 PolarHBondContact O-N 3.05Å; C313-E317 WeakPolarHBondContact O-CB 3.38Å; C313-E317 PolarHBondContact O-N 3.49Å; C313-F325 VanDerWaalsContact SG-CD2 3.6Å
314	V	98.8	Very high	97.8	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-67.2	-43.2	175.5	171.9	0	0	0	0	111.8	L207 M233 I250 L255 Y290 S310 G311 A316 E317 M318	L207-V314 HydrophobicContact CD2-CG1 3.63Å; M233-V314 HydrophobicContact CE-CB 4.46Å; M233-V314 HydrophobicContact CE-CG1 4.44Å; M233-V314 HydrophobicContact SD-CB 4.02Å; M233-V314 HydrophobicContact SD-CG1 3.85Å; I250-V314 HydrophobicContact CG2-CG2 4.38Å; L255-V314 HydrophobicContact CD1-CB 4.42Å; L255-V314 HydrophobicContact CD1-CG1 3.63Å; L255-V314 HydrophobicContact CD1-CG2 4.12Å; Y290-V314 HydrophobicContact CD1-CG2 3.87Å; Y290-V314 HydrophobicContact CE1-CG2 3.67Å; S310-V314 PolarHBondContact O-N 3.37Å; G311-V314 PolarHBondContact O-N 2.81Å; V314-A316 VanDerWaalsContact C-N 3.33Å; V314-A316 PolarHBondContact O-N 2.98Å; V314-E317 PolarHBondContact O-N 3.37Å; V314-M318 HydrophobicContact CG1-CE 4.29Å; V314-M318 PolarHBondContact O-N 2.82Å
315	L	98.7	Very high	97.7	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-59.2	-46.8	173.4	170.3	56.8	0	0	0	110.5	V226 T230 G311 G312 E317 M318 L319 L381 L384 M385 M388	V226-L315 HydrophobicContact CG1-CD1 3.86Å; T230-L315 HydrophobicContact CG2-CB 4.49Å; T230-L315 HydrophobicContact CG2-CD1 4.16Å; T230-L315 HydrophobicContact CG2-CD2 4.15Å; G311-L315 PolarHBondContact O-N 3.11Å; G312-L315 PolarHBondContact O-N 3.02Å; L315-E317 VanDerWaalsContact C-N 3.3Å; L315-E317 PolarHBondContact O-N 3.38Å; L315-M318 PolarHBondContact O-N 3.22Å; L315-L319 HydrophobicContact CD1-CD1 3.95Å; L315-L319 HydrophobicContact CD1-CG 4.15Å; L315-L319 HydrophobicContact CG-CD1 4.26Å; L315-L319 WeakPolarHBondContact O-CG 3.42Å; L315-L319 PolarHBondContact O-N 3.5Å; L315-L381 HydrophobicContact CD1-CB 4.49Å; L315-L381 HydrophobicContact CD1-CD2 4.26Å; L315-L384 HydrophobicContact CD2-CD2 3.92Å; L315-L384 HydrophobicContact CD2-CG 3.96Å; L315-M385 HydrophobicContact CD2-CB 3.73Å; L315-M385 HydrophobicContact CD2-CG 4.34Å; L315-M385 HydrophobicContact CG-CB 4.24Å; L315-M385 HydrophobicContact CG-CG 4.43Å; L315-M388 HydrophobicContact CD2-SD 4.36Å
316	A	98	Very high	97.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-57.5	-44.1	174.5	0	0	0	0	0	112	G312 C313 V314 L319 R320 L324 F373 M385	G312-A316 WeakPolarHBondContact O-CB 3.49Å; G312-A316 PolarHBondContact O-N 3.19Å; C313-A316 WeakPolarHBondContact O-CB 3.42Å; C313-A316 PolarHBondContact O-N 3.05Å; V314-A316 VanDerWaalsContact C-N 3.33Å; V314-A316 PolarHBondContact O-N 2.98Å; A316-L319 PolarHBondContact O-N 3.02Å; A316-R320 WeakPolarHBondContact O-CD 3.27Å; A316-R320 WeakPolarHBondContact O-CG 3.48Å; A316-R320 PolarHBondContact O-N 3.23Å; A316-R320 VanDerWaalsContact O-N 3.15Å; A316-L324 HydrophobicContact CB-CB 3.82Å; A316-L324 HydrophobicContact CB-CD2 3.73Å; A316-L324 HydrophobicContact CB-CG 4.29Å; A316-F373 HydrophobicContact CB-CE1 4.11Å; A316-F373 HydrophobicContact CB-CZ 3.93Å; A316-M385 HydrophobicContact CB-CG 4.45Å; A316-M385 HydrophobicContact CB-SD 3.58Å; A316-M385 VanDerWaalsContact CB-SD 3.58Å
317	E	98.1	Very high	97.5	Very high	10 Å²	10	16 Å²	16	5%	0.047	8%	0.077	C	C	.	.	H	α-helix	trans	-62	-45.2	178.5	-170.8	178.3	-128.9	0	0	112.1	I211 S252 Y290 C313 V314 L315 L319 R320 Q321 C323	I211-E317 HydrophobicContact CD1-CG 4.01Å; S252-E317 WeakPolarHBondContact CB-OE2 3.42Å; S252-E317 PolarHBondContact OG-OE2 2.95Å; Y290-E317 PolarHBondContact OH-OE1 3.49Å; Y290-E317 PolarHBondContact OH-OE2 3.24Å; C313-E317 WeakPolarHBondContact O-CB 3.38Å; C313-E317 PolarHBondContact O-N 3.49Å; V314-E317 PolarHBondContact O-N 3.37Å; L315-E317 VanDerWaalsContact C-N 3.3Å; L315-E317 PolarHBondContact O-N 3.38Å; E317-L319 VanDerWaalsContact C-N 3.33Å; E317-L319 PolarHBondContact O-N 3.38Å; E317-R320 PolarHBondContact O-N 2.97Å; E317-Q321 WeakPolarHBondContact O-CA 3.3Å; E317-Q321 PolarHBondContact O-N 2.64Å; E317-C323 PolarHBondContact OE1-N 3.3Å; E317-C323 PolarHBondContact OE1-SG 3.4Å
318	M	98.1	Very high	97.3	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.02	10%	0.104	C	C	.	.	H	α-helix	trans	-58.8	-42.5	175.6	-75.8	-170.3	-74.7	0	0	112.6	L207 I211 I221 V226 F229 T230 V314 L315 R320	L207-M318 HydrophobicContact CD1-CG 4.1Å; L207-M318 HydrophobicContact CD1-SD 3.83Å; L207-M318 HydrophobicContact CD2-CE 4.43Å; L207-M318 HydrophobicContact CD2-CG 4.08Å; L207-M318 HydrophobicContact CD2-SD 3.83Å; L207-M318 HydrophobicContact CG-CG 4.38Å; L207-M318 HydrophobicContact CG-SD 4.38Å; I211-M318 HydrophobicContact CD1-CG 4.05Å; I211-M318 HydrophobicContact CG1-CG 4.38Å; I221-M318 HydrophobicContact CD1-CB 4.44Å; V226-M318 HydrophobicContact CG1-CB 3.99Å; V226-M318 HydrophobicContact CG1-CE 4.03Å; V226-M318 HydrophobicContact CG1-SD 4.2Å; V226-M318 HydrophobicContact CG2-CB 4.22Å; F229-M318 HydrophobicContact CB-SD 4.24Å; T230-M318 VanDerWaalsContact OG1-CE 3.22Å; T230-M318 WeakPolarHBondContact OG1-CE 3.06Å; V314-M318 HydrophobicContact CG1-CE 4.29Å; V314-M318 PolarHBondContact O-N 2.82Å; L315-M318 PolarHBondContact O-N 3.22Å; M318-R320 VanDerWaalsContact C-N 3.35Å; M318-R320 PolarHBondContact O-N 2.79Å
319	L	97.2	Very high	97.1	Very high	17 Å²	17	23 Å²	23	9%	0.089	12%	0.124	C	C	.	.	H	α-helix	trans	-70.3	-28.5	-177.8	-65	173.2	0	0	0	113.4	V226 L315 A316 E317 F373 T377 L381 L382	V226-L319 HydrophobicContact CG1-CD2 3.91Å; V226-L319 HydrophobicContact CG1-CG 4.41Å; L315-L319 HydrophobicContact CD1-CD1 3.95Å; L315-L319 HydrophobicContact CD1-CG 4.15Å; L315-L319 HydrophobicContact CG-CD1 4.26Å; L315-L319 WeakPolarHBondContact O-CG 3.42Å; L315-L319 PolarHBondContact O-N 3.5Å; A316-L319 PolarHBondContact O-N 3.02Å; E317-L319 VanDerWaalsContact C-N 3.33Å; E317-L319 PolarHBondContact O-N 3.38Å; L319-F373 HydrophobicContact CB-CD1 3.86Å; L319-F373 HydrophobicContact CB-CE1 4Å; L319-F373 HydrophobicContact CD1-CE1 4.41Å; L319-T377 HydrophobicContact CB-CG2 4.13Å; L319-T377 HydrophobicContact CD1-CG2 3.93Å; L319-T377 HydrophobicContact CD2-CG2 4Å; L319-T377 HydrophobicContact CG-CG2 4.24Å; L319-L381 HydrophobicContact CD1-CB 4.23Å; L319-L381 HydrophobicContact CD2-CB 4.46Å; L319-L381 HydrophobicContact CD2-CD1 3.88Å; L319-L382 HydrophobicContact CD1-CD2 4.26Å
320	R	95	Very high	96.8	Very high	49 Å²	49	25 Å²	25	19%	0.185	14%	0.139	C	C	.	.	H	α-helix	trans	-114.9	-11	-173.1	78.9	-157.4	-72.1	84.8	18.2	115.1	A316 E317 M318 H322 F372 F373	A316-R320 WeakPolarHBondContact O-CD 3.27Å; A316-R320 WeakPolarHBondContact O-CG 3.48Å; A316-R320 PolarHBondContact O-N 3.23Å; A316-R320 VanDerWaalsContact O-N 3.15Å; E317-R320 PolarHBondContact O-N 2.97Å; M318-R320 VanDerWaalsContact C-N 3.35Å; M318-R320 PolarHBondContact O-N 2.79Å; R320-H322 VanDerWaalsContact C-N 3.27Å; R320-H322 WeakPolarHBondContact CD-O 3.35Å; R320-H322 WeakPolarHBondContact CG-O 3.33Å; R320-H322 PolarHBondContact O-N 3.3Å; R320-F372 PolarHBondContact NH1-O 3.27Å; R320-F372 PolarHBondContact NH2-O 3.5Å; R320-F373 HydrophobicContact CB-CD1 4.06Å; R320-F373 HydrophobicContact CB-CE1 4.17Å; R320-F373 VanDerWaalsContact NH1-CD1 3.32Å
321	Q	95.1	Very high	96.4	Very high	10 Å²	10	26.7 Å²	26.7	5%	0.047	15%	0.149	C	C	.	.	S	Bend	trans	67	11.3	-178	-52.4	177.8	-79.3	0	0	116.8	I211 L219 E317	I211-Q321 HydrophobicContact CG2-CB 4.22Å; L219-Q321 PolarHBondContact O-NE2 2.8Å; E317-Q321 WeakPolarHBondContact O-CA 3.3Å; E317-Q321 PolarHBondContact O-N 2.64Å
322	H	94.7	Very high	96.2	Very high	102 Å²	102	28.7 Å²	28.7	47%	0.472	16%	0.159	S	C	.	.	S	Bend	trans	-144.5	150.5	176.4	-57.3	-54.2	0	0	0	109.7	R320 L324	R320-H322 VanDerWaalsContact C-N 3.27Å; R320-H322 WeakPolarHBondContact CD-O 3.35Å; R320-H322 WeakPolarHBondContact CG-O 3.33Å; R320-H322 PolarHBondContact O-N 3.3Å; H322-L324 PolarHBondContact O-N 2.72Å
323	C	96.9	Very high	96.1	Very high	17 Å²	17	28.7 Å²	28.7	12%	0.115	16%	0.159	C	C	.	.			trans	-50.9	133.6	174	-86.1	0	0	0	0	111.7	Y289 Y290 E317 M326	Y289-C323 HydrophobicContact CD2-CB 3.96Å; Y289-C323 VanDerWaalsContact CD2-SG 3.54Å; Y289-C323 HydrophobicContact CG-CB 4.21Å; Y290-C323 PolarHBondContact OH-SG 2.92Å; E317-C323 PolarHBondContact OE1-N 3.3Å; E317-C323 PolarHBondContact OE1-SG 3.4Å; C323-M326 HydrophobicContact CB-CG 3.6Å; C323-M326 HydrophobicContact CB-SD 4.29Å; C323-M326 WeakPolarHBondContact O-CG 3.26Å
324	L	96.3	Very high	95.9	Very high	19 Å²	19	29.1 Å²	29.1	10%	0.099	16%	0.161	C	C	.	.	S	Bend	trans	-67.2	-39.4	-179.4	-179.9	62.2	0	0	0	112.3	A316 H322 V340 F373 L389	A316-L324 HydrophobicContact CB-CB 3.82Å; A316-L324 HydrophobicContact CB-CD2 3.73Å; A316-L324 HydrophobicContact CB-CG 4.29Å; H322-L324 PolarHBondContact O-N 2.72Å; L324-V340 HydrophobicContact CD1-CG2 4.39Å; L324-F373 HydrophobicContact CD1-CE2 4.43Å; L324-F373 HydrophobicContact CD1-CZ 4.15Å; L324-L389 HydrophobicContact CD2-CD1 3.76Å
325	F	96.2	Very high	95.6	Very high	1 Å²	1	31.6 Å²	31.6	0%	0.004	18%	0.176	C	C	.	.			trans	-118.7	82.8	-174.3	-53.4	-61.4	0	0	0	110.7	Y289 W309 C313 G327 Q333 K336 V337 V340 L389	Y289-F325 WeakPolarHBondContact CA-O 3.42Å; Y289-F325 WeakPolarHBondContact CB-O 3.42Å; Y289-F325 VanDerWaalsContact CD1-O 3.27Å; Y289-F325 WeakPolarHBondContact CD1-O 3.43Å; W309-F325 HydrophobicContact CH2-CE2 4.37Å; W309-F325 HydrophobicContact CH2-CZ 4.45Å; W309-F325 HydrophobicContact CZ2-CD2 4.31Å; W309-F325 AromaticContact CZ2-CE2 3.67Å; W309-F325 HydrophobicContact CZ2-CE2 3.67Å; W309-F325 HydrophobicContact CZ2-CZ 4.15Å; C313-F325 VanDerWaalsContact SG-CD2 3.6Å; F325-G327 PolarHBondContact O-N 2.72Å; F325-Q333 PolarHBondContact O-NE2 3Å; F325-Q333 PolarHBondContact O-OE1 3.04Å; F325-K336 HydrophobicContact CB-CB 4.07Å; F325-K336 HydrophobicContact CD1-CB 4.08Å; F325-V337 HydrophobicContact CD1-CB 4.46Å; F325-V337 HydrophobicContact CD1-CG2 3.87Å; F325-V337 HydrophobicContact CD2-CG2 4.18Å; F325-V337 HydrophobicContact CE1-CB 4.32Å; F325-V337 HydrophobicContact CE1-CG2 4Å; F325-V337 HydrophobicContact CE2-CG2 4.32Å; F325-V337 HydrophobicContact CG-CG2 3.95Å; F325-V337 HydrophobicContact CZ-CG2 4.22Å; F325-V340 HydrophobicContact CD1-CG2 4.27Å; F325-V340 HydrophobicContact CE1-CB 3.88Å; F325-V340 HydrophobicContact CE1-CG1 4.49Å; F325-V340 HydrophobicContact CE1-CG2 3.64Å; F325-L389 HydrophobicContact CE2-CD1 4.2Å; F325-L389 HydrophobicContact CE2-CD2 4.25Å; F325-L389 HydrophobicContact CZ-CD1 4.26Å
326	M	96.1	Very high	95.3	Very high	99 Å²	99	34.6 Å²	34.6	49%	0.488	19%	0.189	S	C	.	.			trans	-90.8	79.4	-179.2	-64.9	-179.6	73.3	0	0	112.2	Y289 C323 K336	Y289-M326 HydrophobicContact CE1-CB 4.32Å; C323-M326 HydrophobicContact CB-CG 3.6Å; C323-M326 HydrophobicContact CB-SD 4.29Å; C323-M326 WeakPolarHBondContact O-CG 3.26Å; M326-K336 WeakPolarHBondContact O-CE 3.5Å
327	G	95.9	Very high	95.2	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.01	19%	0.189	C	C	.	.			trans	-85	136.6	178.2	0	0	0	0	0	114.8	R288 Y289 F325 D329 D332 Q333	R288-G327 WeakPolarHBondContact CD-O 3.3Å; R288-G327 PolarHBondContact NH1-O 2.93Å; Y289-G327 WeakPolarHBondContact CE1-O 3.3Å; F325-G327 PolarHBondContact O-N 2.72Å; G327-D329 VanDerWaalsContact C-N 3.32Å; G327-D329 PolarHBondContact O-N 3.06Å; G327-D332 WeakPolarHBondContact CA-OD2 3.43Å; G327-Q333 VanDerWaalsContact CA-OE1 3.31Å
328	A	95.4	Very high	94.9	Very high	70 Å²	70	34.5 Å²	34.5	58%	0.579	19%	0.189	S	C	*	.	S	Bend	trans	-66.9	-30.3	173.8	0	0	0	0	0	113.5	R288 D332	R288-A328 VanDerWaalsContact NH1-C 3.33Å; R288-A328 PolarHBondContact NH1-O 2.68Å; R288-A328 PolarHBondContact NH2-O 2.62Å; A328-D332 HydrophobicContact CB-CB 4.26Å; A328-D332 PolarHBondContact N-OD2 2.99Å
329	D	94.9	Very high	94.6	Very high	80 Å²	80	41.7 Å²	41.7	43%	0.428	22%	0.216	S	C	.	.	S	Bend	trans	-150.5	-171.6	175.3	60	46.1	0	0	0	109.9	G327 V331 D332 Q333	G327-D329 VanDerWaalsContact C-N 3.32Å; G327-D329 PolarHBondContact O-N 3.06Å; D329-V331 VanDerWaalsContact C-N 3.28Å; D329-V331 PolarHBondContact O-N 3.37Å; D329-V331 WeakPolarHBondContact OD1-CA 3.47Å; D329-V331 VanDerWaalsContact OD1-CB 3.31Å; D329-V331 WeakPolarHBondContact OD1-CB 3.02Å; D329-V331 PolarHBondContact OD1-N 3.15Å; D329-D332 PolarHBondContact OD1-N 3.04Å; D329-Q333 WeakPolarHBondContact O-CB 3.28Å; D329-Q333 PolarHBondContact O-N 3.09Å
330	S	92	Very high	94.3	Very high	44 Å²	44	41.2 Å²	41.2	31%	0.308	21%	0.214	S	C	.	.	H	α-helix	trans	-65.9	-25.4	179.8	-58.9	0	0	0	0	114.4	L334	S330-L334 PolarHBondContact O-N 3.05Å
331	V	91.5	Very high	94.3	Very high	35 Å²	35	41 Å²	41	21%	0.212	22%	0.216	C	C	.	.	H	α-helix	trans	-81.3	-50.2	179.8	178.3	0	0	0	0	109.4	D329 Q333 L334 V335 L618 F621	D329-V331 VanDerWaalsContact C-N 3.28Å; D329-V331 PolarHBondContact O-N 3.37Å; D329-V331 WeakPolarHBondContact OD1-CA 3.47Å; D329-V331 VanDerWaalsContact OD1-CB 3.31Å; D329-V331 WeakPolarHBondContact OD1-CB 3.02Å; D329-V331 PolarHBondContact OD1-N 3.15Å; V331-Q333 PolarHBondContact O-N 2.93Å; V331-L334 WeakPolarHBondContact O-CB 3.26Å; V331-L334 PolarHBondContact O-N 2.83Å; V331-V335 WeakPolarHBondContact O-CG2 3.48Å; V331-V335 PolarHBondContact O-N 3.18Å; V331-L618 HydrophobicContact CG1-CD1 4.08Å; V331-F621 HydrophobicContact CB-CD1 4.37Å; V331-F621 HydrophobicContact CB-CG 4.33Å; V331-F621 HydrophobicContact CG1-CD1 3.99Å; V331-F621 HydrophobicContact CG1-CD2 3.5Å; V331-F621 HydrophobicContact CG1-CE1 3.95Å; V331-F621 HydrophobicContact CG1-CE2 3.45Å; V331-F621 VanDerWaalsContact CG1-CE2 3.45Å; V331-F621 HydrophobicContact CG1-CG 3.76Å; V331-F621 HydrophobicContact CG1-CZ 3.67Å; V331-F621 HydrophobicContact CG2-CB 3.87Å; V331-F621 HydrophobicContact CG2-CD1 3.43Å; V331-F621 VanDerWaalsContact CG2-CD1 3.43Å; V331-F621 HydrophobicContact CG2-CD2 4.24Å; V331-F621 HydrophobicContact CG2-CE1 3.94Å; V331-F621 HydrophobicContact CG2-CG 3.59Å
332	D	94.4	Very high	94.2	Very high	41 Å²	41	40.8 Å²	40.8	22%	0.219	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-31.6	175.9	-173.7	47.7	0	0	0	111.6	G327 A328 D329 V335 K336	G327-D332 WeakPolarHBondContact CA-OD2 3.43Å; A328-D332 HydrophobicContact CB-CB 4.26Å; A328-D332 PolarHBondContact N-OD2 2.99Å; D329-D332 PolarHBondContact OD1-N 3.04Å; D332-V335 PolarHBondContact O-N 3.44Å; D332-K336 WeakPolarHBondContact O-CD 3.3Å; D332-K336 VanDerWaalsContact O-CG 3.27Å; D332-K336 WeakPolarHBondContact O-CG 3.31Å; D332-K336 PolarHBondContact O-N 3.13Å; D332-K336 WeakPolarHBondContact OD1-CE 3.1Å; D332-K336 IonicContact OD1-NZ 2.76Å; D332-K336 PolarHBondContact OD1-NZ 2.95Å; D332-K336 WeakPolarHBondContact OD2-CE 3.48Å; D332-K336 IonicContact OD2-NZ 3.53Å; D332-K336 PolarHBondContact OD2-NZ 3.26Å
333	Q	96.2	Very high	94.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-47.8	169.6	-171.7	66.7	26.6	0	0	111.7	R288 Y289 L296 F325 G327 D329 V331 V335 K336 V337	R288-Q333 HydrophobicContact CG-CB 4.38Å; R288-Q333 HydrophobicContact CG-CG 4.25Å; R288-Q333 VanDerWaalsContact O-CD 3.24Å; R288-Q333 PolarHBondContact O-NE2 2.97Å; Y289-Q333 PolarHBondContact O-NE2 2.84Å; L296-Q333 HydrophobicContact CD1-CB 4.2Å; L296-Q333 HydrophobicContact CD1-CG 3.79Å; L296-Q333 HydrophobicContact CD2-CB 4.21Å; L296-Q333 HydrophobicContact CD2-CG 4.02Å; F325-Q333 PolarHBondContact O-NE2 3Å; F325-Q333 PolarHBondContact O-OE1 3.04Å; G327-Q333 VanDerWaalsContact CA-OE1 3.31Å; D329-Q333 WeakPolarHBondContact O-CB 3.28Å; D329-Q333 PolarHBondContact O-N 3.09Å; V331-Q333 PolarHBondContact O-N 2.93Å; Q333-V335 VanDerWaalsContact C-N 3.34Å; Q333-K336 PolarHBondContact O-N 3.27Å; Q333-V337 PolarHBondContact O-N 3.17Å; Q333-V337 VanDerWaalsContact O-N 3.14Å
334	L	93.9	Very high	93.9	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-66	-37.2	177.6	-176	58.1	0	0	0	111.5	L296 F297 S330 V331 K336 V337 I338 F361	L296-L334 HydrophobicContact CD1-CB 4.03Å; L296-L334 HydrophobicContact CD1-CD1 4.34Å; F297-L334 HydrophobicContact CE1-CD2 4.36Å; F297-L334 HydrophobicContact CE2-CD1 4.05Å; F297-L334 HydrophobicContact CE2-CD2 4.25Å; F297-L334 HydrophobicContact CZ-CD1 4.38Å; F297-L334 HydrophobicContact CZ-CD2 3.92Å; S330-L334 PolarHBondContact O-N 3.05Å; V331-L334 WeakPolarHBondContact O-CB 3.26Å; V331-L334 PolarHBondContact O-N 2.83Å; L334-K336 VanDerWaalsContact C-N 3.33Å; L334-K336 PolarHBondContact O-N 3.39Å; L334-V337 PolarHBondContact O-N 3.41Å; L334-I338 HydrophobicContact CD1-CD1 4.43Å; L334-I338 HydrophobicContact CG-CD1 4.06Å; L334-I338 WeakPolarHBondContact O-CG1 3.37Å; L334-I338 PolarHBondContact O-N 2.89Å; L334-F361 HydrophobicContact CD2-CE1 3.66Å; L334-F361 HydrophobicContact CD2-CZ 3.76Å; L334-F361 HydrophobicContact CG-CE1 4.37Å
335	V	92.2	Very high	93.7	Very high	52 Å²	52	39.4 Å²	39.4	32%	0.315	22%	0.216	S	C	.	.	H	α-helix	trans	-62.4	-37.4	172.4	174.4	0	0	0	0	111.8	V331 D332 Q333 V337 R339 L618	V331-V335 WeakPolarHBondContact O-CG2 3.48Å; V331-V335 PolarHBondContact O-N 3.18Å; D332-V335 PolarHBondContact O-N 3.44Å; Q333-V335 VanDerWaalsContact C-N 3.34Å; V335-V337 VanDerWaalsContact C-N 3.34Å; V335-R339 WeakPolarHBondContact O-CB 3.34Å; V335-R339 PolarHBondContact O-N 2.77Å; V335-L618 HydrophobicContact CG2-CD1 4.07Å
336	K	93.4	Very high	93.4	Very high	63 Å²	63	44.1 Å²	44.1	27%	0.274	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-40.4	173.2	-55.3	-31.3	-173.8	-155.8	0	111.6	F325 M326 D332 Q333 L334 R339 V340	F325-K336 HydrophobicContact CB-CB 4.07Å; F325-K336 HydrophobicContact CD1-CB 4.08Å; M326-K336 WeakPolarHBondContact O-CE 3.5Å; D332-K336 WeakPolarHBondContact O-CD 3.3Å; D332-K336 VanDerWaalsContact O-CG 3.27Å; D332-K336 WeakPolarHBondContact O-CG 3.31Å; D332-K336 PolarHBondContact O-N 3.13Å; D332-K336 WeakPolarHBondContact OD1-CE 3.1Å; D332-K336 IonicContact OD1-NZ 2.76Å; D332-K336 PolarHBondContact OD1-NZ 2.95Å; D332-K336 WeakPolarHBondContact OD2-CE 3.48Å; D332-K336 IonicContact OD2-NZ 3.53Å; D332-K336 PolarHBondContact OD2-NZ 3.26Å; Q333-K336 PolarHBondContact O-N 3.27Å; L334-K336 VanDerWaalsContact C-N 3.33Å; L334-K336 PolarHBondContact O-N 3.39Å; K336-R339 PolarHBondContact O-N 2.81Å; K336-V340 PolarHBondContact O-N 3.36Å
337	V	94.9	Very high	93.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-49.9	177.9	174.7	0	0	0	0	111	W309 F325 Q333 L334 V335 R339 V340 L341 Y391	W309-V337 HydrophobicContact CH2-CG1 3.67Å; W309-V337 HydrophobicContact CH2-CG2 4.36Å; W309-V337 HydrophobicContact CZ2-CG1 4.07Å; W309-V337 HydrophobicContact CZ2-CG2 3.9Å; F325-V337 HydrophobicContact CD1-CB 4.46Å; F325-V337 HydrophobicContact CD1-CG2 3.87Å; F325-V337 HydrophobicContact CD2-CG2 4.18Å; F325-V337 HydrophobicContact CE1-CB 4.32Å; F325-V337 HydrophobicContact CE1-CG2 4Å; F325-V337 HydrophobicContact CE2-CG2 4.32Å; F325-V337 HydrophobicContact CG-CG2 3.95Å; F325-V337 HydrophobicContact CZ-CG2 4.22Å; Q333-V337 PolarHBondContact O-N 3.17Å; Q333-V337 VanDerWaalsContact O-N 3.14Å; L334-V337 PolarHBondContact O-N 3.41Å; V335-V337 VanDerWaalsContact C-N 3.34Å; V337-R339 PolarHBondContact O-N 3.33Å; V337-V340 PolarHBondContact O-N 3.23Å; V337-L341 HydrophobicContact CG1-CD1 3.89Å; V337-L341 HydrophobicContact CG1-CG 4.34Å; V337-L341 PolarHBondContact O-N 3.13Å; V337-Y391 HydrophobicContact CG1-CE1 3.65Å
338	I	93.4	Very high	93.2	Very high	9 Å²	9	47.3 Å²	47.3	5%	0.046	26%	0.261	C	S	.	.	H	α-helix	trans	-56.9	-38.1	176.3	-70.7	168.2	0	0	0	111.5	L334 V340 G342 F361 V364 Y391	L334-I338 HydrophobicContact CD1-CD1 4.43Å; L334-I338 HydrophobicContact CG-CD1 4.06Å; L334-I338 WeakPolarHBondContact O-CG1 3.37Å; L334-I338 PolarHBondContact O-N 2.89Å; I338-V340 PolarHBondContact O-N 2.75Å; I338-G342 CarbonylContact O-C 3.44Å; I338-G342 WeakPolarHBondContact O-CA 3.19Å; I338-G342 PolarHBondContact O-N 3.48Å; I338-F361 HydrophobicContact CD1-CD1 3.54Å; I338-F361 HydrophobicContact CD1-CE1 3.93Å; I338-F361 HydrophobicContact CD1-CG 4Å; I338-V364 HydrophobicContact CG2-CB 3.72Å; I338-V364 HydrophobicContact CG2-CG1 4.1Å; I338-V364 HydrophobicContact CG2-CG2 3.93Å; I338-Y391 WeakPolarHBondContact CA-OH 3.34Å; I338-Y391 WeakPolarHBondContact CG1-OH 3.48Å
339	R	90.4	Very high	93.1	Very high	154 Å²	154	45 Å²	45	58%	0.581	24%	0.239	S	C	*	.	H	α-helix	trans	-64.6	-23.5	178.3	-168.3	172.3	-177.3	169.8	2.7	113.9	V335 K336 V337 F372	V335-R339 WeakPolarHBondContact O-CB 3.34Å; V335-R339 PolarHBondContact O-N 2.77Å; K336-R339 PolarHBondContact O-N 2.81Å; V337-R339 PolarHBondContact O-N 3.33Å; R339-F372 WeakPolarHBondContact O-CZ 3.39Å
340	V	92.1	Very high	93	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-96.7	-48.6	177.1	-178	0	0	0	0	111.5	L324 F325 K336 V337 I338 F372	L324-V340 HydrophobicContact CD1-CG2 4.39Å; F325-V340 HydrophobicContact CD1-CG2 4.27Å; F325-V340 HydrophobicContact CE1-CB 3.88Å; F325-V340 HydrophobicContact CE1-CG1 4.49Å; F325-V340 HydrophobicContact CE1-CG2 3.64Å; K336-V340 PolarHBondContact O-N 3.36Å; V337-V340 PolarHBondContact O-N 3.23Å; I338-V340 PolarHBondContact O-N 2.75Å; V340-F372 HydrophobicContact CB-CE2 4.09Å; V340-F372 HydrophobicContact CB-CZ 4.23Å; V340-F372 HydrophobicContact CG1-CD2 4.1Å; V340-F372 HydrophobicContact CG1-CE2 3.92Å; V340-F372 HydrophobicContact CG2-CD1 4.32Å; V340-F372 HydrophobicContact CG2-CD2 4.32Å; V340-F372 HydrophobicContact CG2-CE1 3.92Å; V340-F372 HydrophobicContact CG2-CE2 3.92Å; V340-F372 HydrophobicContact CG2-CZ 3.71Å
341	L	93.7	Very high	93.2	Very high	46 Å²	46	43.3 Å²	43.3	24%	0.241	24%	0.236	C	C	.	.	H	α-helix	trans	-89.6	-10.6	-173	-59.3	-173.7	0	0	0	114.2	W309 V337 L389 Y391	W309-L341 HydrophobicContact CH2-CD1 3.66Å; W309-L341 HydrophobicContact CZ3-CD1 3.87Å; V337-L341 HydrophobicContact CG1-CD1 3.89Å; V337-L341 HydrophobicContact CG1-CG 4.34Å; V337-L341 PolarHBondContact O-N 3.13Å; L341-L389 VanDerWaalsContact CD1-O 3.29Å; L341-L389 WeakPolarHBondContact CD1-O 3.36Å; L341-L389 WeakPolarHBondContact CD2-O 3.3Å; L341-Y391 HydrophobicContact CB-CD2 4.43Å; L341-Y391 HydrophobicContact CB-CE2 3.67Å; L341-Y391 HydrophobicContact CD1-CD1 4.46Å; L341-Y391 HydrophobicContact CD1-CD2 4.32Å; L341-Y391 HydrophobicContact CD1-CE1 4.28Å; L341-Y391 HydrophobicContact CD1-CE2 4.13Å; L341-Y391 HydrophobicContact CD1-CG 4.47Å
342	G	93.3	Very high	93.4	Very high	5 Å²	5	42 Å²	42	5%	0.052	23%	0.228	C	C	.	.			trans	80.7	174.8	-165.7	0	0	0	0	0	112.6	I338 V364 Y391	I338-G342 CarbonylContact O-C 3.44Å; I338-G342 WeakPolarHBondContact O-CA 3.19Å; I338-G342 PolarHBondContact O-N 3.48Å; G342-V364 CarbonylContact C-O 3.5Å; G342-V364 WeakPolarHBondContact CA-O 3.36Å; G342-Y391 WeakPolarHBondContact O-CE2 3.45Å; G342-Y391 PolarHBondContact O-OH 2.84Å
343	T	92.6	Very high	93.3	Very high	38 Å²	38	41 Å²	41	23%	0.233	22%	0.223	C	C	.	.	S	Bend	trans	-68.3	129.5	177.8	-71	0	0	0	0	111.1	F361 P362 V364	T343-F361 HydrophobicContact CG2-CB 3.81Å; T343-P362 PolarHBondContact OG1-O 2.92Å; T343-V364 PolarHBondContact N-O 3.01Å; T343-V364 PolarHBondContact OG1-N 2.89Å; T343-V364 VanDerWaalsContact OG1-N 3.08Å
344	P	92.8	Very high	92.9	Very high	8 Å²	8	46.5 Å²	46.5	5%	0.052	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-66.4	141.7	-179.1	27.3	-35.2	0	0	0	111.5	D348 I349 M352 F361 Y391	P344-D348 HydrophobicContact CB-CB 3.82Å; P344-I349 HydrophobicContact CB-CG1 4.16Å; P344-I349 HydrophobicContact CG-CD1 4.36Å; P344-I349 HydrophobicContact CG-CG1 4.07Å; P344-M352 HydrophobicContact CB-CE 4.1Å; P344-F361 HydrophobicContact CG-CD2 4.19Å; P344-F361 HydrophobicContact CG-CE2 4.22Å; P344-Y391 HydrophobicContact CB-CD1 4.21Å; P344-Y391 HydrophobicContact CB-CD2 3.9Å; P344-Y391 HydrophobicContact CB-CE1 4.11Å; P344-Y391 HydrophobicContact CB-CE2 3.79Å; P344-Y391 HydrophobicContact CB-CG 4.11Å; P344-Y391 HydrophobicContact CG-CE1 4.38Å
345	T	91.9	Very high	92.4	Very high	63 Å²	63	53.1 Å²	53.1	39%	0.387	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-68.7	162.1	174.9	66.8	0	0	0	0	111.4	Q347 D348 I349	T345-Q347 PolarHBondContact O-N 3.15Å; T345-Q347 PolarHBondContact OG1-N 2.89Å; T345-D348 WeakPolarHBondContact CB-OD2 3.29Å; T345-D348 WeakPolarHBondContact CG2-OD2 3.19Å; T345-D348 PolarHBondContact N-OD2 2.91Å; T345-D348 WeakPolarHBondContact O-CB 3.44Å; T345-D348 PolarHBondContact O-N 3.1Å; T345-D348 VanDerWaalsContact OG1-CG 3.27Å; T345-D348 PolarHBondContact OG1-N 2.94Å; T345-D348 PolarHBondContact OG1-OD2 3.3Å; T345-I349 WeakPolarHBondContact O-CG1 3.44Å; T345-I349 PolarHBondContact O-N 2.66Å
346	P	90.9	Very high	91.8	Very high	99 Å²	99	53.9 Å²	53.9	64%	0.643	29%	0.288	S	S	*	.	H	α-helix	trans	-54.3	-33.4	170.3	-26.6	35.9	0	0	0	113	A350	P346-A350 WeakPolarHBondContact O-CB 3.25Å; P346-A350 PolarHBondContact O-N 3.31Å
347	Q	93.1	Very high	90.7	Very high	136 Å²	136	53.4 Å²	53.4	64%	0.636	30%	0.301	S	S	*	.	H	α-helix	trans	-69.2	-40.8	175.6	-67.9	76.4	4.3	0	0	111.8	T345 A350 S351	T345-Q347 PolarHBondContact O-N 3.15Å; T345-Q347 PolarHBondContact OG1-N 2.89Å; Q347-A350 PolarHBondContact O-N 2.68Å; Q347-S351 WeakPolarHBondContact O-CB 3.31Å; Q347-S351 PolarHBondContact O-N 2.65Å; Q347-S351 PolarHBondContact O-OG 3.48Å
348	D	94.5	Very high	89.4	Confident	32 Å²	32	59.8 Å²	59.8	17%	0.171	35%	0.346	C	S	.	.	H	α-helix	trans	-60.9	-49.5	172.3	-69.8	-62.2	0	0	0	110.9	P344 T345 A350 S351 M352 Y391	P344-D348 HydrophobicContact CB-CB 3.82Å; T345-D348 WeakPolarHBondContact CB-OD2 3.29Å; T345-D348 WeakPolarHBondContact CG2-OD2 3.19Å; T345-D348 PolarHBondContact N-OD2 2.91Å; T345-D348 WeakPolarHBondContact O-CB 3.44Å; T345-D348 PolarHBondContact O-N 3.1Å; T345-D348 VanDerWaalsContact OG1-CG 3.27Å; T345-D348 PolarHBondContact OG1-N 2.94Å; T345-D348 PolarHBondContact OG1-OD2 3.3Å; D348-A350 VanDerWaalsContact C-N 3.35Å; D348-A350 PolarHBondContact O-N 3.05Å; D348-S351 WeakPolarHBondContact CA-OG 3.38Å; D348-S351 PolarHBondContact O-N 2.76Å; D348-S351 VanDerWaalsContact O-N 3.11Å; D348-S351 PolarHBondContact O-OG 2.58Å; D348-M352 HydrophobicContact CB-CE 4.19Å; D348-M352 WeakPolarHBondContact O-CE 3.31Å; D348-M352 WeakPolarHBondContact O-CG 3.41Å; D348-M352 PolarHBondContact O-N 3.1Å; D348-Y391 HydrophobicContact CB-CG 4.38Å; D348-Y391 WeakPolarHBondContact OD1-CB 3.11Å
349	I	93.1	Very high	88.2	Confident	21 Å²	21	63.1 Å²	63.1	11%	0.108	36%	0.358	C	S	.	.	H	α-helix	trans	-57.7	-48.4	179	-63.1	168.1	0	0	0	110.4	F297 P344 T345 S351 M352 N353 F361	F297-I349 HydrophobicContact CE1-CG2 4.46Å; F297-I349 HydrophobicContact CZ-CG1 4.4Å; P344-I349 HydrophobicContact CB-CG1 4.16Å; P344-I349 HydrophobicContact CG-CD1 4.36Å; P344-I349 HydrophobicContact CG-CG1 4.07Å; T345-I349 WeakPolarHBondContact O-CG1 3.44Å; T345-I349 PolarHBondContact O-N 2.66Å; I349-S351 VanDerWaalsContact C-N 3.32Å; I349-S351 PolarHBondContact O-N 2.71Å; I349-M352 HydrophobicContact CG1-CE 4.47Å; I349-M352 PolarHBondContact O-N 3.18Å; I349-N353 PolarHBondContact O-N 3.42Å; I349-F361 HydrophobicContact CD1-CD2 4.23Å; I349-F361 HydrophobicContact CD1-CE2 3.94Å
350	A	93.1	Very high	87.1	Confident	51 Å²	51	60.8 Å²	60.8	42%	0.421	37%	0.365	S	S	.	.	H	α-helix	trans	-61.6	-36.9	176.6	0	0	0	0	0	112.8	P346 Q347 D348 P354	P346-A350 WeakPolarHBondContact O-CB 3.25Å; P346-A350 PolarHBondContact O-N 3.31Å; Q347-A350 PolarHBondContact O-N 2.68Å; D348-A350 VanDerWaalsContact C-N 3.35Å; D348-A350 PolarHBondContact O-N 3.05Å; A350-P354 VanDerWaalsContact O-CD 3.26Å; A350-P354 WeakPolarHBondContact O-CD 3.24Å; A350-P354 VanDerWaalsContact O-CG 3.28Å; A350-P354 WeakPolarHBondContact O-CG 3.47Å
351	S	95.2	Very high	86.3	Confident	38 Å²	38	62 Å²	62	27%	0.266	37%	0.37	S	S	.	.	H	α-helix	trans	-72.5	-26.2	176.9	74.5	0	0	0	0	113.9	Q347 D348 I349 N392	Q347-S351 WeakPolarHBondContact O-CB 3.31Å; Q347-S351 PolarHBondContact O-N 2.65Å; Q347-S351 PolarHBondContact O-OG 3.48Å; D348-S351 WeakPolarHBondContact CA-OG 3.38Å; D348-S351 PolarHBondContact O-N 2.76Å; D348-S351 VanDerWaalsContact O-N 3.11Å; D348-S351 PolarHBondContact O-OG 2.58Å; I349-S351 VanDerWaalsContact C-N 3.32Å; I349-S351 PolarHBondContact O-N 2.71Å; S351-N392 VanDerWaalsContact OG-CA 3.28Å; S351-N392 WeakPolarHBondContact OG-CA 3.41Å; S351-N392 VanDerWaalsContact OG-CB 3.3Å; S351-N392 WeakPolarHBondContact OG-CB 3.31Å; S351-N392 VanDerWaalsContact OG-CG 3.31Å
352	M	95.4	Very high	85.5	Confident	7 Å²	7	63.3 Å²	63.3	3%	0.034	38%	0.382	C	S	.	.	H	α-helix	trans	-82.4	-45.1	176.7	-74.2	-175.2	-70.6	0	0	112	P293 E294 F297 A299 P344 D348 I349 Y391	P293-M352 HydrophobicContact CB-SD 3.59Å; P293-M352 VanDerWaalsContact CB-SD 3.59Å; P293-M352 HydrophobicContact CG-SD 3.58Å; P293-M352 VanDerWaalsContact CG-SD 3.58Å; E294-M352 HydrophobicContact CB-CB 3.87Å; E294-M352 HydrophobicContact CB-CG 4.2Å; E294-M352 WeakPolarHBondContact CB-O 3.44Å; F297-M352 HydrophobicContact CD2-CB 4.29Å; F297-M352 HydrophobicContact CD2-CE 3.91Å; F297-M352 HydrophobicContact CD2-SD 3.95Å; F297-M352 HydrophobicContact CE2-CE 3.43Å; F297-M352 VanDerWaalsContact CE2-CE 3.43Å; F297-M352 HydrophobicContact CE2-SD 3.93Å; F297-M352 HydrophobicContact CZ-CE 4.21Å; A299-M352 WeakPolarHBondContact CB-O 3.33Å; P344-M352 HydrophobicContact CB-CE 4.1Å; D348-M352 HydrophobicContact CB-CE 4.19Å; D348-M352 WeakPolarHBondContact O-CE 3.31Å; D348-M352 WeakPolarHBondContact O-CG 3.41Å; D348-M352 PolarHBondContact O-N 3.1Å; I349-M352 HydrophobicContact CG1-CE 4.47Å; I349-M352 PolarHBondContact O-N 3.18Å; M352-Y391 HydrophobicContact CE-CD1 3.81Å; M352-Y391 HydrophobicContact CE-CG 4.24Å; M352-Y391 WeakPolarHBondContact CG-O 3.48Å; M352-Y391 HydrophobicContact SD-CD1 3.75Å; M352-Y391 HydrophobicContact SD-CG 4.36Å
353	N	93.8	Very high	85	Confident	21 Å²	21	69 Å²	69	11%	0.112	41%	0.411	C	S	.	.			trans	-152	100.7	173.2	-175.4	1.7	0	0	0	111.4	F297 A299 I349 M355 Y356	F297-N353 HydrophobicContact CB-CB 4.07Å; F297-N353 PolarHBondContact O-ND2 3.02Å; A299-N353 HydrophobicContact CB-CB 4.09Å; I349-N353 PolarHBondContact O-N 3.42Å; N353-M355 PolarHBondContact O-N 2.95Å; N353-M355 WeakPolarHBondContact OD1-CB 3.44Å; N353-M355 PolarHBondContact OD1-N 3.27Å; N353-Y356 WeakPolarHBondContact O-CB 3.26Å; N353-Y356 PolarHBondContact O-N 3.39Å
354	P	87.8	Confident	84.5	Confident	114 Å²	114	69.6 Å²	69.6	74%	0.74	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-17.2	177.3	-23	31	0	0	0	115.1	A350	A350-P354 VanDerWaalsContact O-CD 3.26Å; A350-P354 WeakPolarHBondContact O-CD 3.24Å; A350-P354 VanDerWaalsContact O-CG 3.28Å; A350-P354 WeakPolarHBondContact O-CG 3.47Å
355	M	83.8	Confident	83.8	Confident	151 Å²	151	76.1 Å²	76.1	74%	0.744	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-1.9	177.9	-60.1	-179.2	175.4	0	0	113	Y301 N353	Y301-M355 HydrophobicContact CE2-CE 4.15Å; N353-M355 PolarHBondContact O-N 2.95Å; N353-M355 WeakPolarHBondContact OD1-CB 3.44Å; N353-M355 PolarHBondContact OD1-N 3.27Å
356	Y	78.6	Confident	83.1	Confident	69 Å²	69	76.6 Å²	76.6	27%	0.271	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-81.3	127.5	178.9	-152.7	-94.8	0	0	0	110.5	F297 N353 Y359	F297-Y356 HydrophobicContact CB-CD2 4.23Å; F297-Y356 AromaticContact CD1-CD1 3.69Å; F297-Y356 HydrophobicContact CD1-CD1 3.69Å; F297-Y356 AromaticContact CD1-CD2 3.91Å; F297-Y356 HydrophobicContact CD1-CD2 3.91Å; F297-Y356 AromaticContact CD1-CE1 3.67Å; F297-Y356 HydrophobicContact CD1-CE1 3.67Å; F297-Y356 AromaticContact CD1-CE2 3.89Å; F297-Y356 HydrophobicContact CD1-CE2 3.89Å; F297-Y356 AromaticContact CD1-CG 3.81Å; F297-Y356 HydrophobicContact CD1-CG 3.81Å; F297-Y356 AromaticContact CD1-CZ 3.77Å; F297-Y356 HydrophobicContact CE1-CD1 4.01Å; F297-Y356 AromaticContact CE1-CE1 3.84Å; F297-Y356 HydrophobicContact CE1-CE1 3.84Å; F297-Y356 WeakPolarHBondContact O-CD2 3.34Å; N353-Y356 WeakPolarHBondContact O-CB 3.26Å; N353-Y356 PolarHBondContact O-N 3.39Å; Y356-Y359 HydrophobicContact CE1-CG 4.48Å
357	G	70.4	Confident	82.5	Confident	53 Å²	53	73.9 Å²	73.9	55%	0.546	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-66.3	162.8	178.3	0	0	0	0	0	112.9	Y359	G357-Y359 PolarHBondContact O-N 3.17Å; G357-Y359 VanDerWaalsContact O-N 3.13Å
358	S	67.4	Low	81.8	Confident	133 Å²	133	71.5 Å²	71.5	93%	0.93	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-56.1	116.6	176.4	54.3	0	0	0	0	111.4
359	Y	68.3	Low	80.9	Confident	80 Å²	80	71.9 Å²	71.9	31%	0.314	43%	0.432	S	S	.	.			trans	-118.2	130.8	179.7	-166.9	-84.6	0	0	0	111.1	Y356 G357 F361 F621	Y356-Y359 HydrophobicContact CE1-CG 4.48Å; G357-Y359 PolarHBondContact O-N 3.17Å; G357-Y359 VanDerWaalsContact O-N 3.13Å; Y359-F361 AromaticContact CD1-CD1 3.8Å; Y359-F361 HydrophobicContact CD1-CD1 3.8Å; Y359-F361 AromaticContact CD1-CD2 3.96Å; Y359-F361 HydrophobicContact CD1-CD2 3.96Å; Y359-F361 AromaticContact CD1-CE1 3.59Å; Y359-F361 HydrophobicContact CD1-CE1 3.59Å; Y359-F361 AromaticContact CD1-CE2 3.76Å; Y359-F361 HydrophobicContact CD1-CE2 3.76Å; Y359-F361 AromaticContact CD1-CG 3.97Å; Y359-F361 HydrophobicContact CD1-CG 3.97Å; Y359-F361 AromaticContact CD1-CZ 3.55Å; Y359-F361 HydrophobicContact CD1-CZ 3.55Å; Y359-F361 AromaticContact CE1-CD1 3.82Å; Y359-F361 HydrophobicContact CE1-CD1 3.82Å; Y359-F361 AromaticContact CE1-CE1 3.74Å; Y359-F361 HydrophobicContact CE1-CE1 3.74Å; Y359-F361 HydrophobicContact CE1-CG 4.33Å; Y359-F361 HydrophobicContact CE1-CZ 4.17Å; Y359-F361 HydrophobicContact CG-CE2 4.41Å; Y359-F361 HydrophobicContact CG-CZ 4.24Å; Y359-F361 PolarHBondContact O-N 3.33Å; Y359-F621 AromaticContact CE1-CZ 3.97Å; Y359-F621 HydrophobicContact CE1-CZ 3.97Å; Y359-F621 HydrophobicContact CE2-CE1 4.2Å; Y359-F621 HydrophobicContact CE2-CZ 4.15Å; Y359-F621 AromaticContact CZ-CE1 3.98Å; Y359-F621 AromaticContact CZ-CE2 3.99Å; Y359-F621 AromaticContact CZ-CZ 3.46Å; Y359-F621 VanDerWaalsContact CZ-CZ 3.46Å; Y359-F621 WeakPolarHBondContact OH-CE2 3.41Å; Y359-F621 WeakPolarHBondContact OH-CZ 3.38Å
360	S	67.8	Low	80.3	Confident	104 Å²	104	77.4 Å²	77.4	73%	0.727	46%	0.456	S	S	*	.			trans	-88.4	94.7	175.3	58.7	0	0	0	0	110.7
361	F	74.3	Confident	80	Confident	33 Å²	33	81.3 Å²	81.3	15%	0.145	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-70.4	150.5	160.8	-63.5	-71.4	0	0	0	109.6	F297 L334 I338 T343 P344 I349 Y359	F297-F361 HydrophobicContact CE1-CE2 4.04Å; F297-F361 AromaticContact CE1-CZ 3.72Å; F297-F361 HydrophobicContact CE1-CZ 3.72Å; F297-F361 AromaticContact CZ-CE2 3.83Å; F297-F361 HydrophobicContact CZ-CE2 3.83Å; F297-F361 AromaticContact CZ-CZ 3.6Å; F297-F361 HydrophobicContact CZ-CZ 3.6Å; L334-F361 HydrophobicContact CD2-CE1 3.66Å; L334-F361 HydrophobicContact CD2-CZ 3.76Å; L334-F361 HydrophobicContact CG-CE1 4.37Å; I338-F361 HydrophobicContact CD1-CD1 3.54Å; I338-F361 HydrophobicContact CD1-CE1 3.93Å; I338-F361 HydrophobicContact CD1-CG 4Å; T343-F361 HydrophobicContact CG2-CB 3.81Å; P344-F361 HydrophobicContact CG-CD2 4.19Å; P344-F361 HydrophobicContact CG-CE2 4.22Å; I349-F361 HydrophobicContact CD1-CD2 4.23Å; I349-F361 HydrophobicContact CD1-CE2 3.94Å; Y359-F361 AromaticContact CD1-CD1 3.8Å; Y359-F361 HydrophobicContact CD1-CD1 3.8Å; Y359-F361 AromaticContact CD1-CD2 3.96Å; Y359-F361 HydrophobicContact CD1-CD2 3.96Å; Y359-F361 AromaticContact CD1-CE1 3.59Å; Y359-F361 HydrophobicContact CD1-CE1 3.59Å; Y359-F361 AromaticContact CD1-CE2 3.76Å; Y359-F361 HydrophobicContact CD1-CE2 3.76Å; Y359-F361 AromaticContact CD1-CG 3.97Å; Y359-F361 HydrophobicContact CD1-CG 3.97Å; Y359-F361 AromaticContact CD1-CZ 3.55Å; Y359-F361 HydrophobicContact CD1-CZ 3.55Å; Y359-F361 AromaticContact CE1-CD1 3.82Å; Y359-F361 HydrophobicContact CE1-CD1 3.82Å; Y359-F361 AromaticContact CE1-CE1 3.74Å; Y359-F361 HydrophobicContact CE1-CE1 3.74Å; Y359-F361 HydrophobicContact CE1-CG 4.33Å; Y359-F361 HydrophobicContact CE1-CZ 4.17Å; Y359-F361 HydrophobicContact CG-CE2 4.41Å; Y359-F361 HydrophobicContact CG-CZ 4.24Å; Y359-F361 PolarHBondContact O-N 3.33Å
362	P	78.5	Confident	79.6	Confident	74 Å²	74	81.8 Å²	81.8	48%	0.481	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-54.4	143.3	160.6	-20.2	32.6	0	0	0	109.4	T343 V364	T343-P362 PolarHBondContact OG1-O 2.92Å; P362-V364 HydrophobicContact CB-CG2 4.31Å; P362-V364 PolarHBondContact O-N 3.44Å
363	D	81.2	Confident	79.4	Confident	125 Å²	125	82.2 Å²	82.2	67%	0.668	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-70.3	121.5	169.3	-175.9	34.6	0	0	0	109.1	Q365	D363-Q365 PolarHBondContact OD2-NE2 2.95Å
364	V	83.4	Confident	79.3	Confident	49 Å²	49	83.6 Å²	83.6	30%	0.297	48%	0.478	S	S	.	.			trans	-131.4	108.9	-178.3	179.3	0	0	0	0	106.8	I338 G342 T343 P362	I338-V364 HydrophobicContact CG2-CB 3.72Å; I338-V364 HydrophobicContact CG2-CG1 4.1Å; I338-V364 HydrophobicContact CG2-CG2 3.93Å; G342-V364 CarbonylContact C-O 3.5Å; G342-V364 WeakPolarHBondContact CA-O 3.36Å; T343-V364 PolarHBondContact N-O 3.01Å; T343-V364 PolarHBondContact OG1-N 2.89Å; T343-V364 VanDerWaalsContact OG1-N 3.08Å; P362-V364 HydrophobicContact CB-CG2 4.31Å; P362-V364 PolarHBondContact O-N 3.44Å
365	Q	77.7	Confident	79.1	Confident	145 Å²	145	85.5 Å²	85.5	68%	0.678	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-64.7	138.6	174.3	-62.6	-60.7	-47.3	0	0	109.9	D363 C367	D363-Q365 PolarHBondContact OD2-NE2 2.95Å; Q365-C367 PolarHBondContact O-N 3.22Å
366	S	77.7	Confident	79.4	Confident	74 Å²	74	86.3 Å²	86.3	52%	0.517	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-62.9	124.3	-178.2	58.6	0	0	0	0	111
367	C	77.8	Confident	80.1	Confident	41 Å²	41	83.9 Å²	83.9	28%	0.277	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-74.1	126.6	173.3	178.5	0	0	0	0	109.4	Q365 V369 F372	Q365-C367 PolarHBondContact O-N 3.22Å; C367-V369 PolarHBondContact O-N 3.23Å; C367-V369 VanDerWaalsContact O-N 3.08Å; C367-F372 HydrophobicContact CB-CE2 3.57Å; C367-F372 HydrophobicContact CB-CZ 3.62Å; C367-F372 VanDerWaalsContact SG-CE2 3.59Å
368	P	77.3	Confident	81.3	Confident	87 Å²	87	83 Å²	83	57%	0.565	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-51	118	-178.1	-30.2	34.9	0	0	0	112.5	K370 L371	P368-K370 PolarHBondContact O-N 3.47Å; P368-L371 HydrophobicContact CB-CD1 4.27Å; P368-L371 HydrophobicContact CB-CG 4.36Å; P368-L371 HydrophobicContact CG-CD1 4.3Å; P368-L371 WeakPolarHBondContact O-CB 3.45Å; P368-L371 PolarHBondContact O-N 2.88Å
369	V	77.5	Confident	82.6	Confident	39 Å²	39	80.4 Å²	80.4	24%	0.236	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-46.3	-41.7	-168.1	178.5	0	0	0	0	112.8	C367 L371 F372 F373 L382 M385	C367-V369 PolarHBondContact O-N 3.23Å; C367-V369 VanDerWaalsContact O-N 3.08Å; V369-L371 PolarHBondContact O-N 2.99Å; V369-L371 VanDerWaalsContact O-N 3.16Å; V369-F372 PolarHBondContact O-N 2.94Å; V369-F373 HydrophobicContact CG1-CD2 4.34Å; V369-F373 HydrophobicContact CG1-CE2 3.98Å; V369-F373 VanDerWaalsContact O-CD2 3.31Å; V369-F373 WeakPolarHBondContact O-CD2 3.22Å; V369-L382 HydrophobicContact CG1-CD2 4.48Å; V369-M385 HydrophobicContact CG1-CE 3.43Å; V369-M385 VanDerWaalsContact CG1-CE 3.43Å
370	K	79.9	Confident	83.9	Confident	138 Å²	138	78.7 Å²	78.7	60%	0.6	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-52.9	-34.6	178.5	-169.2	177.6	-178.2	179.8	0	113.9	P368 F372 F373	P368-K370 PolarHBondContact O-N 3.47Å; K370-F372 PolarHBondContact O-N 2.95Å; K370-F373 PolarHBondContact O-N 3.45Å
371	L	85.4	Confident	85.3	Confident	132 Å²	132	73.8 Å²	73.8	69%	0.691	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-65.9	-19.1	-179.5	-64.5	178.5	0	0	0	113.5	P368 V369	P368-L371 HydrophobicContact CB-CD1 4.27Å; P368-L371 HydrophobicContact CB-CG 4.36Å; P368-L371 HydrophobicContact CG-CD1 4.3Å; P368-L371 WeakPolarHBondContact O-CB 3.45Å; P368-L371 PolarHBondContact O-N 2.88Å; V369-L371 PolarHBondContact O-N 2.99Å; V369-L371 VanDerWaalsContact O-N 3.16Å
372	F	87.3	Confident	86.4	Confident	48 Å²	48	73 Å²	73	21%	0.211	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-79.4	-19.6	173	-65.5	-79.8	0	0	0	112.9	R320 R339 V340 C367 V369 K370	R320-F372 PolarHBondContact NH1-O 3.27Å; R320-F372 PolarHBondContact NH2-O 3.5Å; R339-F372 WeakPolarHBondContact O-CZ 3.39Å; V340-F372 HydrophobicContact CB-CE2 4.09Å; V340-F372 HydrophobicContact CB-CZ 4.23Å; V340-F372 HydrophobicContact CG1-CD2 4.1Å; V340-F372 HydrophobicContact CG1-CE2 3.92Å; V340-F372 HydrophobicContact CG2-CD1 4.32Å; V340-F372 HydrophobicContact CG2-CD2 4.32Å; V340-F372 HydrophobicContact CG2-CE1 3.92Å; V340-F372 HydrophobicContact CG2-CE2 3.92Å; V340-F372 HydrophobicContact CG2-CZ 3.71Å; C367-F372 HydrophobicContact CB-CE2 3.57Å; C367-F372 HydrophobicContact CB-CZ 3.62Å; C367-F372 VanDerWaalsContact SG-CE2 3.59Å; V369-F372 PolarHBondContact O-N 2.94Å; K370-F372 PolarHBondContact O-N 2.95Å
373	F	92.2	Very high	87.2	Confident	16 Å²	16	71.6 Å²	71.6	7%	0.07	40%	0.396	C	S	.	.	S	Bend	trans	-112.9	158.5	-167.7	-67.6	-93.5	0	0	0	112.5	A316 L319 R320 L324 V369 K370 T377 L382 M385	A316-F373 HydrophobicContact CB-CE1 4.11Å; A316-F373 HydrophobicContact CB-CZ 3.93Å; L319-F373 HydrophobicContact CB-CD1 3.86Å; L319-F373 HydrophobicContact CB-CE1 4Å; L319-F373 HydrophobicContact CD1-CE1 4.41Å; R320-F373 HydrophobicContact CB-CD1 4.06Å; R320-F373 HydrophobicContact CB-CE1 4.17Å; R320-F373 VanDerWaalsContact NH1-CD1 3.32Å; L324-F373 HydrophobicContact CD1-CE2 4.43Å; L324-F373 HydrophobicContact CD1-CZ 4.15Å; V369-F373 HydrophobicContact CG1-CD2 4.34Å; V369-F373 HydrophobicContact CG1-CE2 3.98Å; V369-F373 VanDerWaalsContact O-CD2 3.31Å; V369-F373 WeakPolarHBondContact O-CD2 3.22Å; K370-F373 PolarHBondContact O-N 3.45Å; F373-T377 HydrophobicContact CB-CG2 4.19Å; F373-T377 HydrophobicContact CD1-CG2 4.42Å; F373-L382 HydrophobicContact CB-CD2 4.41Å; F373-L382 HydrophobicContact CD1-CD2 4.13Å; F373-L382 HydrophobicContact CD2-CD2 3.74Å; F373-L382 HydrophobicContact CE1-CD2 4.37Å; F373-L382 HydrophobicContact CE2-CD2 4.02Å; F373-L382 HydrophobicContact CG-CD2 3.82Å; F373-L382 HydrophobicContact CZ-CD2 4.33Å; F373-M385 HydrophobicContact CE1-SD 4.11Å; F373-M385 HydrophobicContact CE2-CE 3.74Å; F373-M385 HydrophobicContact CE2-SD 4.12Å; F373-M385 HydrophobicContact CZ-CE 3.73Å; F373-M385 HydrophobicContact CZ-SD 3.45Å; F373-M385 WeakPolarHBondContact CZ-SD 3.5Å
374	P	90.4	Very high	88	Confident	50 Å²	50	65.7 Å²	65.7	33%	0.325	36%	0.364	S	S	.	.			trans	-52.1	143.7	172.9	-27.2	35	0	0	0	112.7	H376 T377	P374-H376 PolarHBondContact O-N 2.93Å; P374-T377 WeakPolarHBondContact CD-OG1 3.47Å; P374-T377 VanDerWaalsContact O-CB 3.28Å; P374-T377 WeakPolarHBondContact O-CB 3.33Å; P374-T377 PolarHBondContact O-N 2.88Å; P374-T377 PolarHBondContact O-OG1 3.2Å
375	Q	85.4	Confident	88.7	Confident	154 Å²	154	63.5 Å²	63.5	72%	0.72	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-34	-172.5	-175.2	174.7	-2.4	0	0	114.6
376	H	88.9	Confident	89.6	Confident	168 Å²	168	59.2 Å²	59.2	78%	0.778	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	19.9	-179.4	-50.3	-71	0	0	0	113.8	P374	P374-H376 PolarHBondContact O-N 2.93Å
377	T	94.1	Very high	90.6	Very high	19 Å²	19	59.9 Å²	59.9	12%	0.117	33%	0.331	C	S	.	.			trans	-65.6	129.7	176.9	-57.6	0	0	0	0	110.3	L319 F373 P374 A379 L382	L319-T377 HydrophobicContact CB-CG2 4.13Å; L319-T377 HydrophobicContact CD1-CG2 3.93Å; L319-T377 HydrophobicContact CD2-CG2 4Å; L319-T377 HydrophobicContact CG-CG2 4.24Å; F373-T377 HydrophobicContact CB-CG2 4.19Å; F373-T377 HydrophobicContact CD1-CG2 4.42Å; P374-T377 WeakPolarHBondContact CD-OG1 3.47Å; P374-T377 VanDerWaalsContact O-CB 3.28Å; P374-T377 WeakPolarHBondContact O-CB 3.33Å; P374-T377 PolarHBondContact O-N 2.88Å; P374-T377 PolarHBondContact O-OG1 3.2Å; T377-A379 PolarHBondContact O-N 3Å; T377-L382 HydrophobicContact CG2-CD1 3.99Å; T377-L382 HydrophobicContact CG2-CD2 3.93Å; T377-L382 HydrophobicContact CG2-CG 3.83Å
378	P	94.7	Very high	91.5	Very high	35 Å²	35	58 Å²	58	23%	0.227	32%	0.317	C	S	.	.			trans	-58.2	125.4	-178.4	-25.5	34.7	0	0	0	112.7	A223 D380 L381 L382	A223-P378 HydrophobicContact CB-CG 3.8Å; P378-D380 VanDerWaalsContact C-N 3.3Å; P378-D380 WeakPolarHBondContact CB-OD1 3.41Å; P378-D380 PolarHBondContact O-N 2.61Å; P378-L381 HydrophobicContact CB-CB 4.38Å; P378-L381 HydrophobicContact CB-CD1 4.1Å; P378-L381 HydrophobicContact CB-CG 4.29Å; P378-L381 HydrophobicContact CG-CD1 4.13Å; P378-L381 PolarHBondContact O-N 2.94Å; P378-L382 PolarHBondContact O-N 3.39Å; P378-L382 VanDerWaalsContact O-N 3.14Å
379	A	94.7	Very high	92.5	Very high	77 Å²	77	54 Å²	54	64%	0.636	29%	0.292	S	S	*	.	H	α-helix	trans	-70.4	-27.2	-174.2	0	0	0	0	0	113.1	T377 L382 A383	T377-A379 PolarHBondContact O-N 3Å; A379-L382 PolarHBondContact O-N 2.86Å; A379-A383 WeakPolarHBondContact O-CB 3.4Å; A379-A383 PolarHBondContact O-N 3.37Å
380	D	96.6	Very high	93.5	Very high	45 Å²	45	54 Å²	54	24%	0.241	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-44.3	172.6	60.1	-18.4	0	0	0	111.6	K227 P378 A383 L384 C407	K227-D380 VanDerWaalsContact CE-OD2 3.24Å; K227-D380 WeakPolarHBondContact CE-OD2 3.12Å; K227-D380 IonicContact NZ-OD2 3.22Å; K227-D380 PolarHBondContact NZ-OD2 3.01Å; P378-D380 VanDerWaalsContact C-N 3.3Å; P378-D380 WeakPolarHBondContact CB-OD1 3.41Å; P378-D380 PolarHBondContact O-N 2.61Å; D380-A383 PolarHBondContact O-N 2.78Å; D380-L384 PolarHBondContact O-N 3.38Å; D380-L384 VanDerWaalsContact O-N 3.1Å; D380-C407 HydrophobicContact CB-CB 3.65Å; D380-C407 VanDerWaalsContact OD2-CA 3.25Å; D380-C407 WeakPolarHBondContact OD2-CA 3.14Å; D380-C407 WeakPolarHBondContact OD2-CB 3.09Å
381	L	97.2	Very high	94.3	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70	-36.5	174.6	-69.1	175	0	0	0	112.3	V226 K227 L315 L319 P378 A383 L384 M385 C407	V226-L381 HydrophobicContact CB-CD1 4.35Å; V226-L381 HydrophobicContact CG1-CD1 4.05Å; K227-L381 HydrophobicContact CG-CD1 4.13Å; K227-L381 HydrophobicContact CG-CD2 4.05Å; K227-L381 HydrophobicContact CG-CG 4.4Å; L315-L381 HydrophobicContact CD1-CB 4.49Å; L315-L381 HydrophobicContact CD1-CD2 4.26Å; L319-L381 HydrophobicContact CD1-CB 4.23Å; L319-L381 HydrophobicContact CD2-CB 4.46Å; L319-L381 HydrophobicContact CD2-CD1 3.88Å; P378-L381 HydrophobicContact CB-CB 4.38Å; P378-L381 HydrophobicContact CB-CD1 4.1Å; P378-L381 HydrophobicContact CB-CG 4.29Å; P378-L381 HydrophobicContact CG-CD1 4.13Å; P378-L381 PolarHBondContact O-N 2.94Å; L381-A383 VanDerWaalsContact C-N 3.34Å; L381-L384 PolarHBondContact O-N 2.72Å; L381-M385 WeakPolarHBondContact O-CB 3.47Å; L381-M385 PolarHBondContact O-N 3.45Å; L381-C407 HydrophobicContact CD2-CB 3.83Å; L381-C407 HydrophobicContact CG-CB 4.23Å
382	L	96.2	Very high	94.9	Very high	17 Å²	17	43.3 Å²	43.3	9%	0.089	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-35	173.2	-69.9	176	0	0	0	112.2	L319 V369 F373 T377 P378 A379 M385 S386	L319-L382 HydrophobicContact CD1-CD2 4.26Å; V369-L382 HydrophobicContact CG1-CD2 4.48Å; F373-L382 HydrophobicContact CB-CD2 4.41Å; F373-L382 HydrophobicContact CD1-CD2 4.13Å; F373-L382 HydrophobicContact CD2-CD2 3.74Å; F373-L382 HydrophobicContact CE1-CD2 4.37Å; F373-L382 HydrophobicContact CE2-CD2 4.02Å; F373-L382 HydrophobicContact CG-CD2 3.82Å; F373-L382 HydrophobicContact CZ-CD2 4.33Å; T377-L382 HydrophobicContact CG2-CD1 3.99Å; T377-L382 HydrophobicContact CG2-CD2 3.93Å; T377-L382 HydrophobicContact CG2-CG 3.83Å; P378-L382 PolarHBondContact O-N 3.39Å; P378-L382 VanDerWaalsContact O-N 3.14Å; A379-L382 PolarHBondContact O-N 2.86Å; L382-M385 HydrophobicContact CD2-CE 4.07Å; L382-M385 HydrophobicContact CD2-SD 4.47Å; L382-S386 WeakPolarHBondContact O-CB 3.39Å; L382-S386 PolarHBondContact O-N 2.74Å; L382-S386 PolarHBondContact O-OG 3.34Å
383	A	96.1	Very high	95.4	Very high	45 Å²	45	41.8 Å²	41.8	37%	0.372	24%	0.236	S	C	.	.	H	α-helix	trans	-66.5	-46.8	174.7	0	0	0	0	0	111.6	A379 D380 L381 S386 K387	A379-A383 WeakPolarHBondContact O-CB 3.4Å; A379-A383 PolarHBondContact O-N 3.37Å; D380-A383 PolarHBondContact O-N 2.78Å; L381-A383 VanDerWaalsContact C-N 3.34Å; A383-S386 PolarHBondContact O-N 2.92Å; A383-K387 WeakPolarHBondContact O-CG 3.34Å; A383-K387 PolarHBondContact O-N 3.5Å; A383-K387 VanDerWaalsContact O-N 3.16Å
384	L	98.2	Very high	95.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.9	-51.9	172	165.8	62	0	0	0	111.2	T230 L234 L315 D380 L381 S386 K387 M388 A402 E405 F408	T230-L384 HydrophobicContact CG2-CD2 3.98Å; L234-L384 HydrophobicContact CD1-CD1 4.38Å; L234-L384 HydrophobicContact CD1-CD2 4.12Å; L315-L384 HydrophobicContact CD2-CD2 3.92Å; L315-L384 HydrophobicContact CD2-CG 3.96Å; D380-L384 PolarHBondContact O-N 3.38Å; D380-L384 VanDerWaalsContact O-N 3.1Å; L381-L384 PolarHBondContact O-N 2.72Å; L384-S386 VanDerWaalsContact C-N 3.26Å; L384-S386 PolarHBondContact O-N 2.89Å; L384-K387 WeakPolarHBondContact O-CB 3.18Å; L384-K387 PolarHBondContact O-N 3.49Å; L384-M388 HydrophobicContact CD1-CG 4.13Å; L384-M388 HydrophobicContact CD1-SD 3.73Å; L384-M388 HydrophobicContact CG-SD 3.91Å; L384-M388 WeakPolarHBondContact O-CG 3.38Å; L384-M388 PolarHBondContact O-N 3.5Å; L384-A402 HydrophobicContact CD1-CB 3.85Å; L384-E405 HydrophobicContact CD1-CG 4.15Å; L384-F408 HydrophobicContact CD2-CE2 3.83Å; L384-F408 HydrophobicContact CD2-CZ 3.63Å
385	M	97.7	Very high	96	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-56.7	-40.3	179.5	-171.9	-162.1	72.6	0	0	112.2	L315 A316 V369 F373 L381 L382 K387 M388 L389	L315-M385 HydrophobicContact CD2-CB 3.73Å; L315-M385 HydrophobicContact CD2-CG 4.34Å; L315-M385 HydrophobicContact CG-CB 4.24Å; L315-M385 HydrophobicContact CG-CG 4.43Å; A316-M385 HydrophobicContact CB-CG 4.45Å; A316-M385 HydrophobicContact CB-SD 3.58Å; A316-M385 VanDerWaalsContact CB-SD 3.58Å; V369-M385 HydrophobicContact CG1-CE 3.43Å; V369-M385 VanDerWaalsContact CG1-CE 3.43Å; F373-M385 HydrophobicContact CE1-SD 4.11Å; F373-M385 HydrophobicContact CE2-CE 3.74Å; F373-M385 HydrophobicContact CE2-SD 4.12Å; F373-M385 HydrophobicContact CZ-CE 3.73Å; F373-M385 HydrophobicContact CZ-SD 3.45Å; F373-M385 WeakPolarHBondContact CZ-SD 3.5Å; L381-M385 WeakPolarHBondContact O-CB 3.47Å; L381-M385 PolarHBondContact O-N 3.45Å; L382-M385 HydrophobicContact CD2-CE 4.07Å; L382-M385 HydrophobicContact CD2-SD 4.47Å; M385-K387 VanDerWaalsContact C-N 3.3Å; M385-K387 PolarHBondContact O-N 3.05Å; M385-M388 PolarHBondContact O-N 3.05Å; M385-M388 VanDerWaalsContact O-N 3.1Å; M385-L389 HydrophobicContact CE-CD1 4.45Å; M385-L389 HydrophobicContact CG-CD1 3.85Å; M385-L389 HydrophobicContact CG-CG 4.37Å; M385-L389 PolarHBondContact O-N 3.28Å; M385-L389 HydrophobicContact SD-CD1 4.26Å
386	S	96.2	Very high	96.6	Very high	55 Å²	55	42.6 Å²	42.6	39%	0.385	25%	0.25	S	S	.	.	H	α-helix	trans	-67	-29.6	178	-55.2	0	0	0	0	112.8	L382 A383 L384 M388 V390	L382-S386 WeakPolarHBondContact O-CB 3.39Å; L382-S386 PolarHBondContact O-N 2.74Å; L382-S386 PolarHBondContact O-OG 3.34Å; A383-S386 PolarHBondContact O-N 2.92Å; L384-S386 VanDerWaalsContact C-N 3.26Å; L384-S386 PolarHBondContact O-N 2.89Å; S386-M388 VanDerWaalsContact C-N 3.33Å; S386-V390 WeakPolarHBondContact O-CG2 3.32Å
387	K	98	Very high	97.1	Very high	88 Å²	88	35.6 Å²	35.6	38%	0.383	22%	0.218	S	C	.	.	H	α-helix	trans	-76.4	-17.6	172.3	-65.6	170.7	176.4	177	0	113.3	A383 L384 M385 R396 I397 E405	A383-K387 WeakPolarHBondContact O-CG 3.34Å; A383-K387 PolarHBondContact O-N 3.5Å; A383-K387 VanDerWaalsContact O-N 3.16Å; L384-K387 WeakPolarHBondContact O-CB 3.18Å; L384-K387 PolarHBondContact O-N 3.49Å; M385-K387 VanDerWaalsContact C-N 3.3Å; M385-K387 PolarHBondContact O-N 3.05Å; K387-R396 WeakPolarHBondContact O-CA 3.41Å; K387-I397 HydrophobicContact CB-CB 4.04Å; K387-I397 HydrophobicContact CB-CG2 3.83Å; K387-I397 HydrophobicContact CD-CD1 4.21Å; K387-I397 PolarHBondContact O-N 3.18Å; K387-E405 IonicContact NZ-OE1 3.84Å; K387-E405 PolarHBondContact NZ-OE1 3.44Å; K387-E405 IonicContact NZ-OE2 2.95Å; K387-E405 PolarHBondContact NZ-OE2 3.3Å
388	M	98.6	Very high	97.3	Very high	0 Å²	0	39 Å²	39	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-92.1	-37.3	177.4	-63	172.5	76.7	0	0	112.3	L234 T308 L315 L384 M385 S386 V390 R396 I397	L234-M388 HydrophobicContact CD2-CE 3.67Å; L234-M388 HydrophobicContact CD2-SD 4.36Å; T308-M388 HydrophobicContact CG2-CB 4.14Å; T308-M388 HydrophobicContact CG2-CE 4.36Å; T308-M388 HydrophobicContact CG2-CG 4.12Å; T308-M388 WeakPolarHBondContact O-CE 3.12Å; L315-M388 HydrophobicContact CD2-SD 4.36Å; L384-M388 HydrophobicContact CD1-CG 4.13Å; L384-M388 HydrophobicContact CD1-SD 3.73Å; L384-M388 HydrophobicContact CG-SD 3.91Å; L384-M388 WeakPolarHBondContact O-CG 3.38Å; L384-M388 PolarHBondContact O-N 3.5Å; M385-M388 PolarHBondContact O-N 3.05Å; M385-M388 VanDerWaalsContact O-N 3.1Å; S386-M388 VanDerWaalsContact C-N 3.33Å; M388-V390 VanDerWaalsContact C-N 3.34Å; M388-V390 PolarHBondContact O-N 3.2Å; M388-R396 WeakPolarHBondContact O-CD 2.94Å; M388-R396 WeakPolarHBondContact O-CG 3.1Å; M388-I397 HydrophobicContact CG-CG2 3.66Å
389	L	98	Very high	97.5	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.026	23%	0.226	C	C	.	.	S	Bend	trans	-91.6	56.3	-177.8	-62.8	-179.3	0	0	0	112.4	W309 L324 F325 L341 M385	W309-L389 HydrophobicContact CD2-CD2 3.76Å; W309-L389 HydrophobicContact CE3-CB 4.45Å; W309-L389 HydrophobicContact CE3-CD2 3.96Å; W309-L389 HydrophobicContact CG-CD2 4.2Å; W309-L389 HydrophobicContact CH2-CD2 4.39Å; W309-L389 HydrophobicContact CZ2-CD2 4.21Å; W309-L389 HydrophobicContact CZ3-CB 4.21Å; W309-L389 HydrophobicContact CZ3-CD2 4.28Å; W309-L389 WeakPolarHBondContact O-CD2 3.28Å; L324-L389 HydrophobicContact CD2-CD1 3.76Å; F325-L389 HydrophobicContact CE2-CD1 4.2Å; F325-L389 HydrophobicContact CE2-CD2 4.25Å; F325-L389 HydrophobicContact CZ-CD1 4.26Å; L341-L389 VanDerWaalsContact CD1-O 3.29Å; L341-L389 WeakPolarHBondContact CD1-O 3.36Å; L341-L389 WeakPolarHBondContact CD2-O 3.3Å; M385-L389 HydrophobicContact CE-CD1 4.45Å; M385-L389 HydrophobicContact CG-CD1 3.85Å; M385-L389 HydrophobicContact CG-CG 4.37Å; M385-L389 PolarHBondContact O-N 3.28Å; M385-L389 HydrophobicContact SD-CD1 4.26Å
390	V	97.7	Very high	97.7	Very high	38 Å²	38	37.1 Å²	37.1	23%	0.23	22%	0.218	C	C	.	.			trans	-101.2	140.2	176.8	-175.4	0	0	0	0	110.1	S386 M388 L395 R396	S386-V390 WeakPolarHBondContact O-CG2 3.32Å; M388-V390 VanDerWaalsContact C-N 3.34Å; M388-V390 PolarHBondContact O-N 3.2Å; V390-L395 HydrophobicContact CG1-CB 4Å; V390-R396 HydrophobicContact CB-CG 3.96Å; V390-R396 PolarHBondContact O-NE 2.97Å; V390-R396 PolarHBondContact O-NH2 2.94Å
391	Y	97.5	Very high	97.7	Very high	13 Å²	13	40 Å²	40	5%	0.051	23%	0.23	C	C	.	.	S	Bend	trans	-58.4	-62.6	176.9	-79.8	-61	0	0	0	111.6	P293 V337 I338 L341 G342 P344 D348 M352 P393 R396	P293-Y391 HydrophobicContact CB-CD1 4.18Å; P293-Y391 HydrophobicContact CB-CE1 4.44Å; P293-Y391 HydrophobicContact CG-CD1 4.02Å; V337-Y391 HydrophobicContact CG1-CE1 3.65Å; I338-Y391 WeakPolarHBondContact CA-OH 3.34Å; I338-Y391 WeakPolarHBondContact CG1-OH 3.48Å; L341-Y391 HydrophobicContact CB-CD2 4.43Å; L341-Y391 HydrophobicContact CB-CE2 3.67Å; L341-Y391 HydrophobicContact CD1-CD1 4.46Å; L341-Y391 HydrophobicContact CD1-CD2 4.32Å; L341-Y391 HydrophobicContact CD1-CE1 4.28Å; L341-Y391 HydrophobicContact CD1-CE2 4.13Å; L341-Y391 HydrophobicContact CD1-CG 4.47Å; G342-Y391 WeakPolarHBondContact O-CE2 3.45Å; G342-Y391 PolarHBondContact O-OH 2.84Å; P344-Y391 HydrophobicContact CB-CD1 4.21Å; P344-Y391 HydrophobicContact CB-CD2 3.9Å; P344-Y391 HydrophobicContact CB-CE1 4.11Å; P344-Y391 HydrophobicContact CB-CE2 3.79Å; P344-Y391 HydrophobicContact CB-CG 4.11Å; P344-Y391 HydrophobicContact CG-CE1 4.38Å; D348-Y391 HydrophobicContact CB-CG 4.38Å; D348-Y391 WeakPolarHBondContact OD1-CB 3.11Å; M352-Y391 HydrophobicContact CE-CD1 3.81Å; M352-Y391 HydrophobicContact CE-CG 4.24Å; M352-Y391 WeakPolarHBondContact CG-O 3.48Å; M352-Y391 HydrophobicContact SD-CD1 3.75Å; M352-Y391 HydrophobicContact SD-CG 4.36Å; Y391-P393 VanDerWaalsContact O-CD 3.27Å; Y391-P393 WeakPolarHBondContact O-CD 3.42Å; Y391-R396 PolarHBondContact O-NH2 3.5Å
392	N	97.6	Very high	97.8	Very high	33 Å²	33	40 Å²	40	18%	0.176	23%	0.23	C	C	.	.	S	Bend	trans	-57.5	114.1	176.8	-175.3	-27.8	0	0	0	111.5	S351 S394 L395	S351-N392 VanDerWaalsContact OG-CA 3.28Å; S351-N392 WeakPolarHBondContact OG-CA 3.41Å; S351-N392 VanDerWaalsContact OG-CB 3.3Å; S351-N392 WeakPolarHBondContact OG-CB 3.31Å; S351-N392 VanDerWaalsContact OG-CG 3.31Å; N392-S394 PolarHBondContact O-N 2.94Å; N392-S394 WeakPolarHBondContact OD1-CB 3.39Å; N392-S394 PolarHBondContact OD1-N 3.4Å; N392-L395 HydrophobicContact CB-CB 4.27Å; N392-L395 HydrophobicContact CB-CD1 3.98Å; N392-L395 HydrophobicContact CB-CG 4.06Å; N392-L395 PolarHBondContact O-N 3.11Å; N392-L395 VanDerWaalsContact O-N 3.11Å
393	P	98	Very high	97.9	Very high	16 Å²	16	40.3 Å²	40.3	10%	0.104	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-62.6	-28.2	-175	-22.4	33.9	0	0	0	113.6	E294 A305 Y391 L395	E294-P393 HydrophobicContact CB-CG 4.44Å; E294-P393 HydrophobicContact CG-CG 4.25Å; E294-P393 WeakPolarHBondContact OE1-CG 3.22Å; A305-P393 HydrophobicContact CB-CB 4.12Å; A305-P393 WeakPolarHBondContact CB-O 3.41Å; Y391-P393 VanDerWaalsContact O-CD 3.27Å; Y391-P393 WeakPolarHBondContact O-CD 3.42Å; P393-L395 VanDerWaalsContact C-N 3.3Å; P393-L395 PolarHBondContact O-N 3.42Å
394	S	97.1	Very high	97.9	Very high	110 Å²	110	42.5 Å²	42.5	77%	0.769	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-79.2	-9.9	-179.4	-55.1	0	0	0	0	113.8	N392	N392-S394 PolarHBondContact O-N 2.94Å; N392-S394 WeakPolarHBondContact OD1-CB 3.39Å; N392-S394 PolarHBondContact OD1-N 3.4Å
395	L	98.1	Very high	97.9	Very high	118 Å²	118	43.7 Å²	43.7	62%	0.618	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-103.5	-1.7	177.1	-61.9	-177.5	0	0	0	113.2	V390 N392 P393	V390-L395 HydrophobicContact CG1-CB 4Å; N392-L395 HydrophobicContact CB-CB 4.27Å; N392-L395 HydrophobicContact CB-CD1 3.98Å; N392-L395 HydrophobicContact CB-CG 4.06Å; N392-L395 PolarHBondContact O-N 3.11Å; N392-L395 VanDerWaalsContact O-N 3.11Å; P393-L395 VanDerWaalsContact C-N 3.3Å; P393-L395 PolarHBondContact O-N 3.42Å
396	R	98.4	Very high	97.9	Very high	9 Å²	9	47.2 Å²	47.2	3%	0.034	27%	0.273	C	S	.	.	S	Bend	trans	-71.8	136.5	173	-61.9	178.5	-166.6	145.4	12.6	109.7	E294 A305 T308 K387 M388 V390 Y391 L398	E294-R396 IonicContact OE1-CZ 2.71Å; E294-R396 IonicContact OE1-NH1 3.22Å; E294-R396 PolarHBondContact OE1-NH1 2.83Å; E294-R396 IonicContact OE1-NH2 2.65Å; E294-R396 PolarHBondContact OE1-NH2 2.69Å; E294-R396 IonicContact OE2-CZ 3.1Å; E294-R396 IonicContact OE2-NH1 3.57Å; E294-R396 PolarHBondContact OE2-NH1 2.98Å; E294-R396 IonicContact OE2-NH2 2.74Å; E294-R396 PolarHBondContact OE2-NH2 2.94Å; A305-R396 PolarHBondContact O-NH1 3.31Å; T308-R396 HydrophobicContact CG2-CB 4.08Å; K387-R396 WeakPolarHBondContact O-CA 3.41Å; M388-R396 WeakPolarHBondContact O-CD 2.94Å; M388-R396 WeakPolarHBondContact O-CG 3.1Å; V390-R396 HydrophobicContact CB-CG 3.96Å; V390-R396 PolarHBondContact O-NE 2.97Å; V390-R396 PolarHBondContact O-NH2 2.94Å; Y391-R396 PolarHBondContact O-NH2 3.5Å; R396-L398 PolarHBondContact O-N 3.21Å
397	I	98.7	Very high	98	Very high	20 Å²	20	44.7 Å²	44.7	10%	0.103	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-57.4	132	177.3	-170.4	166.7	0	0	0	111.3	T308 K387 M388 Q401 A402 E405	T308-I397 VanDerWaalsContact CG2-O 3.23Å; T308-I397 WeakPolarHBondContact CG2-O 3.45Å; K387-I397 HydrophobicContact CB-CB 4.04Å; K387-I397 HydrophobicContact CB-CG2 3.83Å; K387-I397 HydrophobicContact CD-CD1 4.21Å; K387-I397 PolarHBondContact O-N 3.18Å; M388-I397 HydrophobicContact CG-CG2 3.66Å; I397-Q401 HydrophobicContact CD1-CB 4.29Å; I397-Q401 HydrophobicContact CG1-CB 3.85Å; I397-A402 HydrophobicContact CD1-CB 3.94Å; I397-A402 HydrophobicContact CG1-CB 4.06Å; I397-A402 HydrophobicContact CG2-CB 4.13Å; I397-E405 HydrophobicContact CD1-CG 3.82Å; I397-E405 WeakPolarHBondContact CD1-OE1 3.42Å
398	L	98.6	Very high	98	Very high	92 Å²	92	40.5 Å²	40.5	48%	0.482	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-67.9	140.1	175.6	-60.4	177.9	0	0	0	109.2	R396 S400 Q401 A402	R396-L398 PolarHBondContact O-N 3.21Å; L398-S400 PolarHBondContact O-N 2.82Å; L398-S400 VanDerWaalsContact O-N 3.13Å; L398-Q401 HydrophobicContact CB-CB 4.41Å; L398-Q401 HydrophobicContact CB-CG 4.11Å; L398-Q401 WeakPolarHBondContact O-CA 3.49Å; L398-Q401 WeakPolarHBondContact O-CB 3.4Å; L398-Q401 PolarHBondContact O-N 2.92Å; L398-A402 PolarHBondContact O-N 2.78Å
399	P	98.6	Very high	97.8	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-56.3	-35.3	-177.5	-27.6	35.5	0	0	0	113.6	L234 L237 A238 Q401 A402 L403	L234-P399 HydrophobicContact CD2-CB 4.14Å; L234-P399 WeakPolarHBondContact O-CB 3.33Å; L237-P399 HydrophobicContact CB-CB 3.84Å; L237-P399 HydrophobicContact CB-CG 3.8Å; A238-P399 HydrophobicContact CB-CB 4.17Å; P399-Q401 PolarHBondContact O-N 3.27Å; P399-A402 WeakPolarHBondContact O-CB 3.38Å; P399-A402 PolarHBondContact O-N 3.2Å; P399-L403 WeakPolarHBondContact O-CG 3.4Å; P399-L403 PolarHBondContact O-N 3.21Å
400	S	97.6	Very high	97.6	Very high	69 Å²	69	47.8 Å²	47.8	48%	0.483	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-34.6	173.6	50.4	0	0	0	0	114	L398	L398-S400 PolarHBondContact O-N 2.82Å; L398-S400 VanDerWaalsContact O-N 3.13Å
401	Q	98.2	Very high	97.5	Very high	106 Å²	106	46 Å²	46	50%	0.495	26%	0.263	S	S	.	.	H	α-helix	trans	-75.1	-38.7	172.7	-65.8	169.7	-31.9	0	0	110.9	I397 L398 P399 L403 S404	I397-Q401 HydrophobicContact CD1-CB 4.29Å; I397-Q401 HydrophobicContact CG1-CB 3.85Å; L398-Q401 HydrophobicContact CB-CB 4.41Å; L398-Q401 HydrophobicContact CB-CG 4.11Å; L398-Q401 WeakPolarHBondContact O-CA 3.49Å; L398-Q401 WeakPolarHBondContact O-CB 3.4Å; L398-Q401 PolarHBondContact O-N 2.92Å; P399-Q401 PolarHBondContact O-N 3.27Å; Q401-L403 VanDerWaalsContact C-N 3.25Å; Q401-L403 PolarHBondContact O-N 3.4Å; Q401-S404 WeakPolarHBondContact O-CB 3.29Å; Q401-S404 PolarHBondContact O-N 3.29Å
402	A	98.6	Very high	97.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-31.1	-178.8	0	0	0	0	0	113	L234 L384 I397 L398 P399 S404 E405 F408	L234-A402 HydrophobicContact CD1-CB 3.74Å; L234-A402 HydrophobicContact CD2-CB 3.91Å; L234-A402 HydrophobicContact CG-CB 4.39Å; L384-A402 HydrophobicContact CD1-CB 3.85Å; I397-A402 HydrophobicContact CD1-CB 3.94Å; I397-A402 HydrophobicContact CG1-CB 4.06Å; I397-A402 HydrophobicContact CG2-CB 4.13Å; L398-A402 PolarHBondContact O-N 2.78Å; P399-A402 WeakPolarHBondContact O-CB 3.38Å; P399-A402 PolarHBondContact O-N 3.2Å; A402-S404 PolarHBondContact O-N 2.93Å; A402-S404 VanDerWaalsContact O-N 3.15Å; A402-E405 WeakPolarHBondContact O-CB 3.45Å; A402-E405 WeakPolarHBondContact O-CG 3.48Å; A402-E405 PolarHBondContact O-N 3.05Å; A402-F408 WeakPolarHBondContact O-CD2 3.43Å; A402-F408 VanDerWaalsContact O-CE2 3.28Å; A402-F408 WeakPolarHBondContact O-CE2 3.31Å
403	L	97.8	Very high	97.2	Very high	23 Å²	23	53 Å²	53	12%	0.12	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.1	172.2	-65.4	173	0	0	0	113.1	Y231 L234 K235 A238 P399 Q401 R412	Y231-L403 HydrophobicContact CD1-CD2 4.14Å; Y231-L403 HydrophobicContact CD2-CD2 3.69Å; Y231-L403 HydrophobicContact CE1-CD2 3.99Å; Y231-L403 HydrophobicContact CE2-CB 3.92Å; Y231-L403 HydrophobicContact CE2-CD2 3.55Å; Y231-L403 HydrophobicContact CE2-CG 4.3Å; Y231-L403 HydrophobicContact CG-CD2 3.99Å; Y231-L403 WeakPolarHBondContact O-CD2 3.43Å; L234-L403 HydrophobicContact CB-CD2 3.75Å; L234-L403 HydrophobicContact CB-CG 4.38Å; K235-L403 HydrophobicContact CB-CD1 4.35Å; K235-L403 HydrophobicContact CB-CD2 4.08Å; K235-L403 HydrophobicContact CG-CD1 4.49Å; A238-L403 HydrophobicContact CB-CD1 4.48Å; P399-L403 WeakPolarHBondContact O-CG 3.4Å; P399-L403 PolarHBondContact O-N 3.21Å; Q401-L403 VanDerWaalsContact C-N 3.25Å; Q401-L403 PolarHBondContact O-N 3.4Å; L403-R412 PolarHBondContact O-NH1 3.47Å
404	S	97.4	Very high	96.9	Very high	90 Å²	90	54.6 Å²	54.6	63%	0.629	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	0.1	179.4	-59	0	0	0	0	114.1	Q401 A402 R412	Q401-S404 WeakPolarHBondContact O-CB 3.29Å; Q401-S404 PolarHBondContact O-N 3.29Å; A402-S404 PolarHBondContact O-N 2.93Å; A402-S404 VanDerWaalsContact O-N 3.15Å; S404-R412 PolarHBondContact O-NH2 3.13Å
405	E	98.3	Very high	96.6	Very high	25 Å²	25	50 Å²	50	12%	0.117	28%	0.28	C	S	.	.	S	Bend	trans	-65.8	150.1	-179.3	-75.4	-75.4	143.9	0	0	112.6	L384 K387 I397 A402 C407 F408 R412	L384-E405 HydrophobicContact CD1-CG 4.15Å; K387-E405 IonicContact NZ-OE1 3.84Å; K387-E405 PolarHBondContact NZ-OE1 3.44Å; K387-E405 IonicContact NZ-OE2 2.95Å; K387-E405 PolarHBondContact NZ-OE2 3.3Å; I397-E405 HydrophobicContact CD1-CG 3.82Å; I397-E405 WeakPolarHBondContact CD1-OE1 3.42Å; A402-E405 WeakPolarHBondContact O-CB 3.45Å; A402-E405 WeakPolarHBondContact O-CG 3.48Å; A402-E405 PolarHBondContact O-N 3.05Å; E405-C407 PolarHBondContact O-N 3.29Å; E405-F408 PolarHBondContact O-N 3.43Å; E405-R412 PolarHBondContact O-NH2 3.32Å
406	P	97.7	Very high	96	Very high	79 Å²	79	46.6 Å²	46.6	51%	0.513	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-59.9	-24.6	-172.2	-27	35.7	0	0	0	115.1	F408 D409	P406-F408 PolarHBondContact O-N 3.16Å; P406-D409 VanDerWaalsContact CA-OD2 3.31Å; P406-D409 WeakPolarHBondContact CA-OD2 3.36Å; P406-D409 WeakPolarHBondContact O-CB 3.46Å; P406-D409 PolarHBondContact O-N 3.14Å
407	C	97.1	Very high	95.4	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.007	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-57.7	-20.9	176.3	64.5	0	0	0	0	113.8	K227 D380 L381 E405	K227-C407 WeakPolarHBondContact CD-O 3.1Å; K227-C407 WeakPolarHBondContact CE-O 2.94Å; K227-C407 PolarHBondContact NZ-O 3.29Å; D380-C407 HydrophobicContact CB-CB 3.65Å; D380-C407 VanDerWaalsContact OD2-CA 3.25Å; D380-C407 WeakPolarHBondContact OD2-CA 3.14Å; D380-C407 WeakPolarHBondContact OD2-CB 3.09Å; L381-C407 HydrophobicContact CD2-CB 3.83Å; L381-C407 HydrophobicContact CG-CB 4.23Å; E405-C407 PolarHBondContact O-N 3.29Å
408	F	97.5	Very high	94.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-100.4	2.1	178.8	-53.7	-53.9	0	0	0	114.4	K227 T230 Y231 L234 L384 A402 E405 P406 E410 L411 R412	K227-F408 HydrophobicContact CB-CD1 4.45Å; K227-F408 WeakPolarHBondContact O-CE1 3.31Å; T230-F408 HydrophobicContact CG2-CZ 3.97Å; Y231-F408 HydrophobicContact CD2-CB 3.96Å; Y231-F408 AromaticContact CD2-CD1 3.86Å; Y231-F408 HydrophobicContact CD2-CD1 3.86Å; Y231-F408 AromaticContact CD2-CD2 3.85Å; Y231-F408 HydrophobicContact CD2-CD2 3.85Å; Y231-F408 HydrophobicContact CD2-CE1 4.31Å; Y231-F408 HydrophobicContact CD2-CE2 4.29Å; Y231-F408 AromaticContact CD2-CG 3.61Å; Y231-F408 HydrophobicContact CD2-CG 3.61Å; Y231-F408 HydrophobicContact CE2-CB 4.33Å; Y231-F408 HydrophobicContact CE2-CD2 4.47Å; Y231-F408 HydrophobicContact CE2-CG 4.36Å; Y231-F408 HydrophobicContact CG-CD1 4.41Å; L234-F408 HydrophobicContact CD1-CE2 3.74Å; L234-F408 HydrophobicContact CD1-CZ 3.79Å; L384-F408 HydrophobicContact CD2-CE2 3.83Å; L384-F408 HydrophobicContact CD2-CZ 3.63Å; A402-F408 WeakPolarHBondContact O-CD2 3.43Å; A402-F408 VanDerWaalsContact O-CE2 3.28Å; A402-F408 WeakPolarHBondContact O-CE2 3.31Å; E405-F408 PolarHBondContact O-N 3.43Å; P406-F408 PolarHBondContact O-N 3.16Å; F408-E410 VanDerWaalsContact C-N 3.27Å; F408-E410 PolarHBondContact O-N 3.4Å; F408-L411 HydrophobicContact CD1-CD1 4.01Å; F408-L411 WeakPolarHBondContact O-CB 3.2Å; F408-L411 PolarHBondContact O-N 2.92Å; F408-L411 VanDerWaalsContact O-N 3.07Å; F408-R412 PolarHBondContact O-N 3.43Å
409	D	96.4	Very high	94.5	Very high	82 Å²	82	52.5 Å²	52.5	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-35.2	177	-74.1	-32.4	0	0	0	112.4	P406 L411 R412 S413	P406-D409 VanDerWaalsContact CA-OD2 3.31Å; P406-D409 WeakPolarHBondContact CA-OD2 3.36Å; P406-D409 WeakPolarHBondContact O-CB 3.46Å; P406-D409 PolarHBondContact O-N 3.14Å; D409-L411 VanDerWaalsContact C-N 3.3Å; D409-L411 PolarHBondContact O-N 2.93Å; D409-R412 PolarHBondContact O-N 3.31Å; D409-R412 IonicContact OD1-CZ 3.71Å; D409-R412 IonicContact OD1-NE 2.7Å; D409-R412 PolarHBondContact OD1-NE 2.98Å; D409-R412 IonicContact OD1-NH2 2.72Å; D409-R412 PolarHBondContact OD1-NH2 3.46Å; D409-S413 VanDerWaalsContact O-CB 3.27Å; D409-S413 WeakPolarHBondContact O-CB 3.49Å; D409-S413 PolarHBondContact O-N 3.15Å
410	E	93.1	Very high	94	Very high	77 Å²	77	52.6 Å²	52.6	36%	0.36	30%	0.301	S	S	.	.	H	α-helix	trans	-54.7	-45.6	170.9	-176.8	-178.4	173.3	0	0	111.5	K227 F408 S413 I414	K227-E410 VanDerWaalsContact CD-OE2 3.31Å; K227-E410 WeakPolarHBondContact CD-OE2 3.42Å; K227-E410 WeakPolarHBondContact CE-OE2 3.44Å; K227-E410 IonicContact NZ-OE2 2.76Å; K227-E410 PolarHBondContact NZ-OE2 2.71Å; F408-E410 VanDerWaalsContact C-N 3.27Å; F408-E410 PolarHBondContact O-N 3.4Å; E410-S413 PolarHBondContact O-N 3.38Å; E410-I414 HydrophobicContact CG-CD1 4.18Å; E410-I414 WeakPolarHBondContact O-CD1 3.46Å; E410-I414 VanDerWaalsContact O-CG1 3.25Å; E410-I414 WeakPolarHBondContact O-CG1 3.49Å; E410-I414 PolarHBondContact O-N 3.34Å
411	L	95.3	Very high	93.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-69.6	-41.2	179.7	-53.4	-172.7	0	0	0	111.4	K227 V228 Y231 F408 D409 S413 I414 G415 L420 M426 F431	K227-L411 HydrophobicContact CB-CD1 4.15Å; K227-L411 HydrophobicContact CB-CD2 4.37Å; K227-L411 HydrophobicContact CB-CG 4.42Å; V228-L411 HydrophobicContact CG2-CD1 3.98Å; V228-L411 HydrophobicContact CG2-CD2 3.59Å; V228-L411 HydrophobicContact CG2-CG 4.45Å; Y231-L411 HydrophobicContact CG-CD1 4.43Å; F408-L411 HydrophobicContact CD1-CD1 4.01Å; F408-L411 WeakPolarHBondContact O-CB 3.2Å; F408-L411 PolarHBondContact O-N 2.92Å; F408-L411 VanDerWaalsContact O-N 3.07Å; D409-L411 VanDerWaalsContact C-N 3.3Å; D409-L411 PolarHBondContact O-N 2.93Å; L411-S413 VanDerWaalsContact C-N 3.33Å; L411-I414 PolarHBondContact O-N 2.77Å; L411-G415 PolarHBondContact O-N 3.07Å; L411-L420 HydrophobicContact CD2-CD2 4.31Å; L411-M426 HydrophobicContact CB-CE 3.89Å; L411-M426 HydrophobicContact CD2-CE 4.23Å; L411-M426 HydrophobicContact CD2-SD 4.43Å; L411-M426 HydrophobicContact CG-CE 4.49Å; L411-F431 VanDerWaalsContact C-CZ 3.5Å; L411-F431 HydrophobicContact CB-CZ 3.89Å; L411-F431 WeakPolarHBondContact O-CE2 3.28Å; L411-F431 WeakPolarHBondContact O-CZ 3.31Å
412	R	94.7	Very high	92.5	Very high	84 Å²	84	51.7 Å²	51.7	32%	0.317	30%	0.302	S	S	.	.	H	α-helix	trans	-60.5	-42.5	175.5	-74.7	-177.4	-85.6	-83.9	7.1	111.8	L403 S404 E405 F408 D409 G415 F431	L403-R412 PolarHBondContact O-NH1 3.47Å; S404-R412 PolarHBondContact O-NH2 3.13Å; E405-R412 PolarHBondContact O-NH2 3.32Å; F408-R412 PolarHBondContact O-N 3.43Å; D409-R412 PolarHBondContact O-N 3.31Å; D409-R412 IonicContact OD1-CZ 3.71Å; D409-R412 IonicContact OD1-NE 2.7Å; D409-R412 PolarHBondContact OD1-NE 2.98Å; D409-R412 IonicContact OD1-NH2 2.72Å; D409-R412 PolarHBondContact OD1-NH2 3.46Å; R412-G415 PolarHBondContact O-N 3.3Å; R412-F431 HydrophobicContact CG-CE1 4.35Å; R412-F431 HydrophobicContact CG-CZ 4.48Å
413	S	93.7	Very high	91.8	Very high	108 Å²	108	62.4 Å²	62.4	76%	0.755	34%	0.343	S	S	*	.	H	α-helix	trans	-66.8	-39.6	179.2	-172.2	0	0	0	0	112.6	D409 E410 L411	D409-S413 VanDerWaalsContact O-CB 3.27Å; D409-S413 WeakPolarHBondContact O-CB 3.49Å; D409-S413 PolarHBondContact O-N 3.15Å; E410-S413 PolarHBondContact O-N 3.38Å; L411-S413 VanDerWaalsContact C-N 3.33Å
414	I	92	Very high	91.3	Very high	51 Å²	51	62.9 Å²	62.9	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-69	-35.1	174.1	-66.7	167.3	0	0	0	111.4	E410 L411 G418 L420 M426	E410-I414 HydrophobicContact CG-CD1 4.18Å; E410-I414 WeakPolarHBondContact O-CD1 3.46Å; E410-I414 VanDerWaalsContact O-CG1 3.25Å; E410-I414 WeakPolarHBondContact O-CG1 3.49Å; E410-I414 PolarHBondContact O-N 3.34Å; L411-I414 PolarHBondContact O-N 2.77Å; I414-G418 WeakPolarHBondContact O-CA 3.45Å; I414-G418 PolarHBondContact O-N 3.46Å; I414-L420 HydrophobicContact CD1-CD2 3.78Å; I414-L420 HydrophobicContact CG2-CD2 4.44Å; I414-M426 HydrophobicContact CG2-CG 3.68Å
415	G	90.4	Very high	91	Very high	12 Å²	12	65.5 Å²	65.5	12%	0.124	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	173.3	176.7	0	0	0	0	0	114.7	L411 R412 H417 G418 M426	L411-G415 PolarHBondContact O-N 3.07Å; R412-G415 PolarHBondContact O-N 3.3Å; G415-H417 PolarHBondContact O-N 3.18Å; G415-G418 PolarHBondContact O-N 3.39Å; G415-M426 WeakPolarHBondContact O-CG 3.47Å
416	P	85.4	Confident	90.7	Very high	47 Å²	47	64.4 Å²	64.4	31%	0.305	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-2.3	-171.1	31.3	-36	0	0	0	114.1	F431	P416-F431 HydrophobicContact CB-CD2 4.2Å
417	H	86.4	Confident	90.4	Very high	136 Å²	136	60.9 Å²	60.9	63%	0.63	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	-6.6	179.3	-62.6	-10.7	0	0	0	113.3	G415	G415-H417 PolarHBondContact O-N 3.18Å
418	G	87.9	Confident	89.8	Confident	19 Å²	19	64 Å²	64	20%	0.196	33%	0.334	C	S	.	.			trans	-72.3	175.8	179.1	0	0	0	0	0	113.7	I414 G415 M426	I414-G418 WeakPolarHBondContact O-CA 3.45Å; I414-G418 PolarHBondContact O-N 3.46Å; G415-G418 PolarHBondContact O-N 3.39Å; G418-M426 PolarHBondContact O-N 3.34Å
419	V	89.9	Confident	89.4	Confident	90 Å²	90	68.9 Å²	68.9	55%	0.545	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-119	132.2	-177.7	178.5	0	0	0	0	108.3
420	L	88.1	Confident	89.2	Confident	5 Å²	5	65 Å²	65	3%	0.026	34%	0.336	C	S	.	.			trans	-75.9	166.2	-178.8	-66.1	175.4	0	0	0	111.7	C224 V228 M262 L411 I414 N422 R423 V424 M426	C224-L420 WeakPolarHBondContact SG-CD2 3.43Å; V228-L420 HydrophobicContact CG2-CD1 3.93Å; V228-L420 HydrophobicContact CG2-CD2 4.47Å; M262-L420 HydrophobicContact CE-CD1 3.47Å; M262-L420 VanDerWaalsContact CE-CD1 3.47Å; M262-L420 HydrophobicContact CG-CD1 4.26Å; L411-L420 HydrophobicContact CD2-CD2 4.31Å; I414-L420 HydrophobicContact CD1-CD2 3.78Å; I414-L420 HydrophobicContact CG2-CD2 4.44Å; L420-N422 VanDerWaalsContact CB-OD1 3.3Å; L420-N422 WeakPolarHBondContact CB-OD1 3.43Å; L420-N422 PolarHBondContact O-N 3.36Å; L420-N422 VanDerWaalsContact O-N 3.13Å; L420-R423 WeakPolarHBondContact O-CA 3.38Å; L420-R423 PolarHBondContact O-N 3.41Å; L420-V424 WeakPolarHBondContact CB-O 3.47Å; L420-V424 PolarHBondContact N-O 2.95Å; L420-M426 HydrophobicContact CD1-SD 3.87Å; L420-M426 HydrophobicContact CD2-CG 3.98Å; L420-M426 HydrophobicContact CD2-SD 3.3Å; L420-M426 WeakPolarHBondContact CD2-SD 3.17Å; L420-M426 HydrophobicContact CG-CG 4.14Å; L420-M426 HydrophobicContact CG-SD 3.72Å
421	S	83.4	Confident	89.2	Confident	97 Å²	97	64.2 Å²	64.2	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.3	179.4	50.1	0	0	0	0	114.1	R423	S421-R423 VanDerWaalsContact C-N 3.28Å; S421-R423 PolarHBondContact O-N 3.49Å
422	N	80.8	Confident	89.1	Confident	60 Å²	60	67.3 Å²	67.3	32%	0.321	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	7.7	171.8	71	-11.5	0	0	0	114.2	L420 V424	L420-N422 VanDerWaalsContact CB-OD1 3.3Å; L420-N422 WeakPolarHBondContact CB-OD1 3.43Å; L420-N422 PolarHBondContact O-N 3.36Å; L420-N422 VanDerWaalsContact O-N 3.13Å; N422-V424 WeakPolarHBondContact ND2-CG2 3.48Å; N422-V424 PolarHBondContact O-N 3.39Å; N422-V424 WeakPolarHBondContact OD1-CB 3.27Å; N422-V424 PolarHBondContact OD1-N 2.72Å
423	R	85.1	Confident	88.9	Confident	225 Å²	225	69 Å²	69	85%	0.849	37%	0.37	S	S	*	.	S	Bend	trans	66.9	6.1	-174.7	-55.9	178.4	178.7	-94.7	-0.7	116.1	L420 S421	L420-R423 WeakPolarHBondContact O-CA 3.38Å; L420-R423 PolarHBondContact O-N 3.41Å; S421-R423 VanDerWaalsContact C-N 3.28Å; S421-R423 PolarHBondContact O-N 3.49Å
424	V	87.5	Confident	88.8	Confident	32 Å²	32	66.7 Å²	66.7	19%	0.194	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-79.7	143.1	171.5	-173.8	0	0	0	0	109.6	D260 M262 L420 N422	D260-V424 VanDerWaalsContact O-CG1 3.28Å; D260-V424 WeakPolarHBondContact O-CG1 3.45Å; M262-V424 HydrophobicContact CB-CG1 4.48Å; M262-V424 HydrophobicContact CG-CB 4.04Å; M262-V424 HydrophobicContact CG-CG1 3.6Å; L420-V424 WeakPolarHBondContact CB-O 3.47Å; L420-V424 PolarHBondContact N-O 2.95Å; N422-V424 WeakPolarHBondContact ND2-CG2 3.48Å; N422-V424 PolarHBondContact O-N 3.39Å; N422-V424 WeakPolarHBondContact OD1-CB 3.27Å; N422-V424 PolarHBondContact OD1-N 2.72Å
425	R	90.4	Very high	88.7	Confident	146 Å²	146	66.3 Å²	66.3	55%	0.551	35%	0.35	S	S	*	.	B	Isolated β-bridge	trans	-71	146.2	175.9	-167.1	-178.8	-177.7	-169.6	-2.6	110.2
426	M	91.3	Very high	88.5	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.005	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-57.2	141.1	169.6	-79.1	-67.9	-85.5	0	0	111.6	V228 L411 I414 G415 G418 L420 I430 F431	V228-M426 HydrophobicContact CG2-SD 4.23Å; L411-M426 HydrophobicContact CB-CE 3.89Å; L411-M426 HydrophobicContact CD2-CE 4.23Å; L411-M426 HydrophobicContact CD2-SD 4.43Å; L411-M426 HydrophobicContact CG-CE 4.49Å; I414-M426 HydrophobicContact CG2-CG 3.68Å; G415-M426 WeakPolarHBondContact O-CG 3.47Å; G418-M426 PolarHBondContact O-N 3.34Å; L420-M426 HydrophobicContact CD1-SD 3.87Å; L420-M426 HydrophobicContact CD2-CG 3.98Å; L420-M426 HydrophobicContact CD2-SD 3.3Å; L420-M426 WeakPolarHBondContact CD2-SD 3.17Å; L420-M426 HydrophobicContact CG-CG 4.14Å; L420-M426 HydrophobicContact CG-SD 3.72Å; M426-I430 HydrophobicContact CE-CD1 3.82Å; M426-I430 HydrophobicContact CE-CG2 4.06Å; M426-F431 HydrophobicContact CE-CE2 4.03Å; M426-F431 HydrophobicContact CE-CZ 4.06Å
427	P	91.6	Very high	88.4	Confident	6 Å²	6	72.6 Å²	72.6	4%	0.039	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-58.8	125.8	172	-21.5	32.1	0	0	0	109.6	V228 M262 V263 H429 I430	V228-P427 HydrophobicContact CG1-CG 4.16Å; M262-P427 HydrophobicContact CB-CG 4.02Å; M262-P427 WeakPolarHBondContact O-CG 3.31Å; V263-P427 HydrophobicContact CG2-CB 4.3Å; P427-H429 VanDerWaalsContact C-N 3.33Å; P427-H429 PolarHBondContact O-N 3.14Å; P427-I430 HydrophobicContact CB-CB 4.4Å; P427-I430 WeakPolarHBondContact O-CB 3.4Å; P427-I430 WeakPolarHBondContact O-CG2 3.03Å; P427-I430 PolarHBondContact O-N 2.61Å
428	P	85.5	Confident	88.2	Confident	65 Å²	65	67.1 Å²	67.1	42%	0.422	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-39.4	-166.2	21.2	-32.3	0	0	0	112.8	I430	P428-I430 VanDerWaalsContact C-N 3.29Å; P428-I430 PolarHBondContact O-N 2.83Å
429	H	88.9	Confident	87.8	Confident	104 Å²	104	71.2 Å²	71.2	48%	0.481	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	15.1	-175.9	-55.9	-63.3	0	0	0	114.4	P158 K235 P427 F431 D432	P158-H429 HydrophobicContact CB-CB 4.09Å; P158-H429 HydrophobicContact CG-CB 4.31Å; K235-H429 PolarHBondContact NZ-O 3.47Å; P427-H429 VanDerWaalsContact C-N 3.33Å; P427-H429 PolarHBondContact O-N 3.14Å; H429-F431 PolarHBondContact O-N 2.97Å; H429-D432 IonicContact CE1-OD2 2.69Å; H429-D432 IonicContact CG-OD2 2.68Å; H429-D432 IonicContact ND1-OD2 3.22Å; H429-D432 PolarHBondContact ND1-OD2 3.32Å
430	I	92.3	Very high	86.8	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.005	38%	0.382	C	S	.	.	S	Bend	trans	-64.7	-41.7	-174.7	-166.4	173.8	0	0	0	111.9	V228 Y231 Q232 K235 M426 P427 P428	V228-I430 HydrophobicContact CG1-CD1 4.46Å; Y231-I430 HydrophobicContact CD1-CD1 3.83Å; Y231-I430 HydrophobicContact CD1-CG1 3.53Å; Y231-I430 HydrophobicContact CE1-CD1 4.38Å; Y231-I430 HydrophobicContact CE1-CG1 3.71Å; Y231-I430 WeakPolarHBondContact CE1-O 3.35Å; Y231-I430 HydrophobicContact CG-CD1 4.5Å; Q232-I430 HydrophobicContact CG-CD1 4.48Å; Q232-I430 HydrophobicContact CG-CG1 4.31Å; K235-I430 PolarHBondContact NZ-O 3.01Å; M426-I430 HydrophobicContact CE-CD1 3.82Å; M426-I430 HydrophobicContact CE-CG2 4.06Å; P427-I430 HydrophobicContact CB-CB 4.4Å; P427-I430 WeakPolarHBondContact O-CB 3.4Å; P427-I430 WeakPolarHBondContact O-CG2 3.03Å; P427-I430 PolarHBondContact O-N 2.61Å; P428-I430 VanDerWaalsContact C-N 3.29Å; P428-I430 PolarHBondContact O-N 2.83Å
431	F	93.3	Very high	85.4	Confident	59 Å²	59	74 Å²	74	26%	0.259	39%	0.393	S	S	.	.	S	Bend	trans	-100.2	-1	-178.2	-59	-52.4	0	0	0	114.9	Y231 L411 R412 P416 M426 H429	Y231-F431 HydrophobicContact CE1-CD1 4.1Å; Y231-F431 HydrophobicContact CE1-CE1 4.01Å; Y231-F431 HydrophobicContact CE2-CE1 4.19Å; Y231-F431 AromaticContact CZ-CD1 3.85Å; Y231-F431 AromaticContact CZ-CE1 3.71Å; Y231-F431 WeakPolarHBondContact OH-CD1 3.34Å; L411-F431 VanDerWaalsContact C-CZ 3.5Å; L411-F431 HydrophobicContact CB-CZ 3.89Å; L411-F431 WeakPolarHBondContact O-CE2 3.28Å; L411-F431 WeakPolarHBondContact O-CZ 3.31Å; R412-F431 HydrophobicContact CG-CE1 4.35Å; R412-F431 HydrophobicContact CG-CZ 4.48Å; P416-F431 HydrophobicContact CB-CD2 4.2Å; M426-F431 HydrophobicContact CE-CE2 4.03Å; M426-F431 HydrophobicContact CE-CZ 4.06Å; H429-F431 PolarHBondContact O-N 2.97Å
432	D	92.3	Very high	83.6	Confident	66 Å²	66	74 Å²	74	35%	0.353	39%	0.393	S	S	.	.	S	Bend	trans	-57.5	145.9	174.4	-64.4	17.1	0	0	0	110.4	K235 H429	K235-D432 WeakPolarHBondContact CE-O 3.36Å; K235-D432 PolarHBondContact NZ-O 3.05Å; H429-D432 IonicContact CE1-OD2 2.69Å; H429-D432 IonicContact CG-OD2 2.68Å; H429-D432 IonicContact ND1-OD2 3.22Å; H429-D432 PolarHBondContact ND1-OD2 3.32Å
433	P	91.6	Very high	81.9	Confident	118 Å²	118	75.2 Å²	75.2	77%	0.766	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-60.7	150.4	173.1	27.6	-35	0	0	0	111
434	D	91.3	Very high	79.5	Confident	61 Å²	61	70.7 Å²	70.7	33%	0.326	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-63.6	133.4	174.3	-67.6	-12.7	0	0	0	109.5	H157 K235 Y239	H157-D434 IonicContact CD2-OD1 3.6Å; H157-D434 IonicContact NE2-OD1 3.75Å; H157-D434 PolarHBondContact NE2-OD1 3.18Å; K235-D434 WeakPolarHBondContact CE-OD1 3.16Å; Y239-D434 HydrophobicContact CD2-CB 4.02Å
435	P	89.9	Confident	77.2	Confident	42 Å²	42	72.9 Å²	72.9	27%	0.273	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-74.4	153	-179.1	30.6	-34.7	0	0	0	111.4	N156 H157 Y239	N156-P435 HydrophobicContact CB-CB 4.12Å; N156-P435 HydrophobicContact CB-CG 3.83Å; H157-P435 HydrophobicContact CB-CG 4.46Å; Y239-P435 WeakPolarHBondContact CE2-O 3.16Å
436	E	86	Confident	74.6	Confident	159 Å²	159	70 Å²	70	74%	0.743	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-56.4	144.9	169.1	-71	-63.8	143.6	0	0	111.5	N156	N156-E436 PolarHBondContact ND2-O 3.17Å
437	P	82.8	Confident	72.2	Confident	32 Å²	32	71.3 Å²	71.3	21%	0.208	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-67.7	152.5	178.6	33.1	-36.9	0	0	0	109.9	R153 H243	R153-P437 HydrophobicContact CG-CB 3.99Å; H243-P437 WeakPolarHBondContact NE2-CB 3.36Å; H243-P437 VanDerWaalsContact NE2-CD 3.33Å; H243-P437 WeakPolarHBondContact NE2-CD 3.46Å; H243-P437 WeakPolarHBondContact NE2-CG 3.42Å
438	N	82.7	Confident	69.9	Low	22 Å²	22	76.9 Å²	76.9	12%	0.118	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-63.9	137.5	168.8	-63.8	-67.6	0	0	0	109.4	Q75 Q152 R153 N156	Q75-N438 VanDerWaalsContact CD-CG 3.41Å; Q75-N438 PolarHBondContact NE2-ND2 2.91Å; Q75-N438 VanDerWaalsContact OE1-CB 3.28Å; Q75-N438 PolarHBondContact OE1-ND2 3.46Å; Q75-N438 PolarHBondContact OE1-OD1 2.96Å; Q152-N438 PolarHBondContact O-ND2 3.01Å; R153-N438 PolarHBondContact O-N 3.14Å; R153-N438 PolarHBondContact O-ND2 2.94Å; N156-N438 VanDerWaalsContact ND2-CG 3.3Å; N156-N438 PolarHBondContact ND2-ND2 3.2Å; N156-N438 PolarHBondContact ND2-OD1 2.88Å; N156-N438 PolarHBondContact OD1-ND2 3.33Å; N156-N438 PolarHBondContact OD1-OD1 3.05Å
439	P	78.9	Confident	67.8	Low	104 Å²	104	80.2 Å²	80.2	68%	0.675	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-58.3	147.9	178.6	25.3	-34.4	0	0	0	109.9	T441	P439-T441 PolarHBondContact O-N 3.36Å
440	P	69.1	Low	65.4	Low	113 Å²	113	77.7 Å²	77.7	73%	0.734	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-53.5	119	176.4	-24.8	34	0	0	0	109.9	S442	P440-S442 PolarHBondContact O-N 2.95Å
441	T	59.8	Low	63.1	Low	40 Å²	40	79.4 Å²	79.4	25%	0.245	49%	0.486	C	S	.	.			trans	-57.9	109.5	-174.7	43.4	0	0	0	0	109.6	Q152 P439 V443	Q152-T441 HydrophobicContact CB-CG2 4.46Å; Q152-T441 PolarHBondContact OE1-OG1 3.32Å; P439-T441 PolarHBondContact O-N 3.36Å; T441-V443 VanDerWaalsContact C-N 3.34Å; T441-V443 WeakPolarHBondContact O-CG2 3.41Å; T441-V443 PolarHBondContact O-N 2.94Å
442	S	44.4	Very low	60.6	Low	98 Å²	98	81.6 Å²	81.6	69%	0.685	49%	0.493	S	S	*	.			trans	-71.5	90.5	-177.2	56.3	0	0	0	0	109.1	P440 T444	P440-S442 PolarHBondContact O-N 2.95Å; S442-T444 PolarHBondContact O-N 3.39Å
443	V	44.8	Very low	58.1	Low	86 Å²	86	83.3 Å²	83.3	52%	0.521	50%	0.502	S	S	.	.			trans	-73.1	70.8	177.7	-167.6	0	0	0	0	109.7	T441 D445	T441-V443 VanDerWaalsContact C-N 3.34Å; T441-V443 WeakPolarHBondContact O-CG2 3.41Å; T441-V443 PolarHBondContact O-N 2.94Å; V443-D445 HydrophobicContact CG1-CB 3.91Å; V443-D445 PolarHBondContact O-N 2.89Å
444	T	35.1	Very low	55.9	Low	130 Å²	130	84.1 Å²	84.1	80%	0.798	50%	0.5	S	S	*	.			trans	-75.6	55.7	168.7	52.9	0	0	0	0	109.6	S442	S442-T444 PolarHBondContact O-N 3.39Å
445	D	39.5	Very low	53.3	Low	77 Å²	77	88 Å²	88	41%	0.412	51%	0.511	S	S	.	.			trans	-146	100.7	-164.9	-139	26.8	0	0	0	111.3	R72 V443 T447	R72-D445 IonicContact NH2-OD2 2.74Å; V443-D445 HydrophobicContact CG1-CB 3.91Å; V443-D445 PolarHBondContact O-N 2.89Å; D445-T447 HydrophobicContact CB-CG2 4.39Å; D445-T447 PolarHBondContact O-N 2.84Å; D445-T447 WeakPolarHBondContact OD1-CG2 3.27Å; D445-T447 WeakPolarHBondContact OD2-CG2 2.92Å; D445-T447 PolarHBondContact OD2-OG1 2.77Å
446	G	35.1	Very low	50.7	Low	85 Å²	85	91.7 Å²	91.7	88%	0.876	53%	0.527	S	S	*	.			trans	-73.5	21.9	171.9	0	0	0	0	0	113.5
447	T	42	Very low	48.3	Very low	30 Å²	30	88.7 Å²	88.7	18%	0.184	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.6	-162.6	60.9	0	0	0	0	114.4	D445 L449 S450 A451	D445-T447 HydrophobicContact CB-CG2 4.39Å; D445-T447 PolarHBondContact O-N 2.84Å; D445-T447 WeakPolarHBondContact OD1-CG2 3.27Å; D445-T447 WeakPolarHBondContact OD2-CG2 2.92Å; D445-T447 PolarHBondContact OD2-OG1 2.77Å; T447-L449 CarbonylContact O-C 3.57Å; T447-L449 PolarHBondContact O-N 3.49Å; T447-S450 VanDerWaalsContact CA-OG 3.27Å; T447-S450 WeakPolarHBondContact CA-OG 3.45Å; T447-S450 VanDerWaalsContact CB-OG 3.3Å; T447-S450 WeakPolarHBondContact CB-OG 3.08Å; T447-S450 PolarHBondContact O-N 2.93Å; T447-S450 PolarHBondContact O-OG 3.06Å; T447-A451 WeakPolarHBondContact O-CB 3.46Å; T447-A451 PolarHBondContact O-N 3.13Å
448	N	43.6	Very low	46.1	Very low	123 Å²	123	94.7 Å²	94.7	66%	0.658	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-14.2	176.8	-93.8	-3.1	0	0	0	113.9
449	L	39.7	Very low	43.9	Very low	134 Å²	134	101.9 Å²	101.9	70%	0.702	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-41.1	165	-99.7	67.8	0	0	0	113.4	T447 A451 Y452 N453	T447-L449 CarbonylContact O-C 3.57Å; T447-L449 PolarHBondContact O-N 3.49Å; L449-A451 PolarHBondContact O-N 3.03Å; L449-Y452 WeakPolarHBondContact O-CB 3.15Å; L449-Y452 PolarHBondContact O-N 3.26Å; L449-Y452 VanDerWaalsContact O-N 3.13Å; L449-N453 PolarHBondContact O-N 3.28Å; L449-N453 VanDerWaalsContact O-N 3.12Å
450	S	39	Very low	41.7	Very low	51 Å²	51	104.3 Å²	104.3	36%	0.357	59%	0.586	S	S	.	*	H	α-helix	trans	-69.1	-34.4	-177.4	58.3	0	0	0	0	113.2	T447 Y452 N453 N454	T447-S450 VanDerWaalsContact CA-OG 3.27Å; T447-S450 WeakPolarHBondContact CA-OG 3.45Å; T447-S450 VanDerWaalsContact CB-OG 3.3Å; T447-S450 WeakPolarHBondContact CB-OG 3.08Å; T447-S450 PolarHBondContact O-N 2.93Å; T447-S450 PolarHBondContact O-OG 3.06Å; S450-Y452 PolarHBondContact O-N 3.06Å; S450-N453 PolarHBondContact O-N 3.16Å; S450-N454 VanDerWaalsContact O-CG 3.3Å; S450-N454 PolarHBondContact O-N 2.78Å; S450-N454 VanDerWaalsContact O-N 3.1Å; S450-N454 PolarHBondContact O-OD1 2.73Å
451	A	44.2	Very low	40.1	Very low	38 Å²	38	108.9 Å²	108.9	31%	0.314	59%	0.594	S	S	.	*	H	α-helix	trans	-64	-26.1	172.2	0	0	0	0	0	112.8	T447 L449	T447-A451 WeakPolarHBondContact O-CB 3.46Å; T447-A451 PolarHBondContact O-N 3.13Å; L449-A451 PolarHBondContact O-N 3.03Å
452	Y	41	Very low	38.9	Very low	105 Å²	105	115.1 Å²	115.1	41%	0.412	62%	0.621	S	S	.	*	H	α-helix	trans	-77.8	-41	175.1	-161.8	-90.8	0	0	0	111.5	T170 V194 L449 S450	T170-Y452 HydrophobicContact CG2-CE2 4.48Å; V194-Y452 HydrophobicContact CG2-CE2 4.07Å; L449-Y452 WeakPolarHBondContact O-CB 3.15Å; L449-Y452 PolarHBondContact O-N 3.26Å; L449-Y452 VanDerWaalsContact O-N 3.13Å; S450-Y452 PolarHBondContact O-N 3.06Å
453	N	38.6	Very low	38.4	Very low	102 Å²	102	113.8 Å²	113.8	55%	0.545	62%	0.623	S	S	.	*	H	α-helix	trans	-67.3	-35.6	179.4	-66.8	-9.6	0	0	0	112.6	L449 S450 W455 L456	L449-N453 PolarHBondContact O-N 3.28Å; L449-N453 VanDerWaalsContact O-N 3.12Å; S450-N453 PolarHBondContact O-N 3.16Å; N453-W455 PolarHBondContact O-N 2.94Å; N453-W455 VanDerWaalsContact O-N 3.11Å; N453-L456 PolarHBondContact O-N 2.67Å
454	N	45.4	Very low	38	Very low	134 Å²	134	115.8 Å²	115.8	72%	0.717	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	2.8	-177.4	-69	4.5	0	0	0	115	S450	S450-N454 VanDerWaalsContact O-CG 3.3Å; S450-N454 PolarHBondContact O-N 2.78Å; S450-N454 VanDerWaalsContact O-N 3.1Å; S450-N454 PolarHBondContact O-OD1 2.73Å
455	W	38.2	Very low	38	Very low	144 Å²	144	114.9 Å²	114.9	55%	0.545	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.6	8.3	179.2	-86	82.3	0	0	0	114	Q70 N453	Q70-W455 HydrophobicContact CB-CZ2 4.06Å; N453-W455 PolarHBondContact O-N 2.94Å; N453-W455 VanDerWaalsContact O-N 3.11Å
456	L	34.5	Very low	37.9	Very low	119 Å²	119	118.7 Å²	118.7	62%	0.623	66%	0.66	S	S	*	*	S	Bend	trans	-88.3	124	169.2	-83.6	155.7	0	0	0	109.9	N453 D458	N453-L456 PolarHBondContact O-N 2.67Å; L456-D458 PolarHBondContact O-N 2.85Å
457	P	36.6	Very low	37.9	Very low	96 Å²	96	123.4 Å²	123.4	62%	0.623	66%	0.656	S	S	*	*			trans	-68.1	129.6	168.4	-17.1	31.1	0	0	0	110.5	H459	P457-H459 VanDerWaalsContact C-N 3.3Å; P457-H459 PolarHBondContact O-N 2.92Å
458	D	36.4	Very low	37.5	Very low	157 Å²	157	132.1 Å²	132.1	84%	0.84	69%	0.691	S	S	*	*			trans	-66.9	85.5	172.5	-86.6	-45.2	0	0	0	111	L456 H460	L456-D458 PolarHBondContact O-N 2.85Å; D458-H460 PolarHBondContact O-N 3.03Å
459	H	36	Very low	37.1	Very low	174 Å²	174	131.2 Å²	131.2	81%	0.806	70%	0.695	S	S	*	*			trans	-72.3	91.4	173.7	-95.9	-65.9	0	0	0	110.7	P457 K461	P457-H459 VanDerWaalsContact C-N 3.3Å; P457-H459 PolarHBondContact O-N 2.92Å; H459-K461 PolarHBondContact O-N 3.24Å
460	H	33.2	Very low	36.9	Very low	155 Å²	155	131.8 Å²	131.8	72%	0.718	70%	0.704	S	S	*	*			trans	-38	123.5	172.6	-71.1	-99.2	0	0	0	113.1	D458 H462	D458-H460 PolarHBondContact O-N 3.03Å; H460-H462 AromaticContact ND1-CD2 3.83Å; H460-H462 AromaticContact ND1-NE2 3.75Å
461	K	35.7	Very low	36.8	Very low	208 Å²	208	135.2 Å²	135.2	90%	0.904	73%	0.725	S	S	*	*			trans	-123	85.4	150.5	-79.2	-164.6	173.2	-174.3	0	110.1	H459	H459-K461 PolarHBondContact O-N 3.24Å
462	H	34.5	Very low	36.2	Very low	171 Å²	171	140.5 Å²	140.5	79%	0.792	75%	0.748	S	S	*	*			trans	-61.7	150	156.5	-79.4	-88.5	0	0	0	109.8	H460	H460-H462 AromaticContact ND1-CD2 3.83Å; H460-H462 AromaticContact ND1-NE2 3.75Å
463	G	33.6	Very low	36	Very low	71 Å²	71	141.7 Å²	141.7	73%	0.732	77%	0.766	S	S	*	*			trans	101.5	78.2	160	0	0	0	0	0	116.3
464	S	36.4	Very low	35.9	Very low	128 Å²	128	140.3 Å²	140.3	90%	0.895	78%	0.776	S	S	*	*				-171.7	129.9	109.4	-81.4	0	0	0	0	112
465	S	34.4	Very low	35.2	Very low	111 Å²	111	141.4 Å²	141.4	78%	0.776	78%	0.782	S	S	*	*			trans	-85.4	128.9	171.1	54.2	0	0	0	0	110.9
466	N	37.4	Very low	35.1	Very low	156 Å²	156	142.8 Å²	142.8	83%	0.834	80%	0.799	S	S	*	*			trans	-156.2	152.3	133.9	-117.9	-37.2	0	0	0	115.4
467	K	35.5	Very low	34.8	Very low	185 Å²	185	146.4 Å²	146.4	80%	0.804	81%	0.812	S	S	*	*			trans	-75.2	139.9	-171.3	-56.5	152.8	178.9	171.9	0	111.6
468	K	34.6	Very low	34.7	Very low	212 Å²	212	145.8 Å²	145.8	92%	0.922	82%	0.824	S	S	*	*				-173.7	162.8	101.8	-102.4	176.5	178.6	-178.8	0	112.7
469	S	33.4	Very low	34.5	Very low	104 Å²	104	144 Å²	144	73%	0.727	82%	0.824	S	S	*	*			trans	-118.9	142.5	-171.3	52.8	0	0	0	0	112.1
470	T	36.7	Very low	34.6	Very low	146 Å²	146	143.2 Å²	143.2	90%	0.896	83%	0.825	S	S	*	*			trans	-164.7	143.8	140	22.7	0	0	0	0	109.5
471	P	35.9	Very low	34.6	Very low	123 Å²	123	144.3 Å²	144.3	80%	0.799	83%	0.828	S	S	*	*			trans	-121.7	170.3	178.1	41.9	-32.3	0	0	0	115.2
472	N	33.3	Very low	34.6	Very low	150 Å²	150	144 Å²	144	80%	0.802	83%	0.827	S	S	*	*			trans	97.7	152.7	137.9	-149.4	18.5	0	0	0	121.2
473	V	36.1	Very low	34.6	Very low	130 Å²	130	143.5 Å²	143.5	79%	0.788	83%	0.83	S	S	*	*			trans	72.7	131.2	166.3	-163.9	0	0	0	0	118.1
474	G	35.7	Very low	34.3	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	83%	0.832	S	S	*	*			trans	168.1	36	171.4	0	0	0	0	0	118.1
475	D	30.6	Very low	34	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	83%	0.832	S	S	*	*			trans	-66.5	145.8	172.4	-74.9	-70.9	0	0	0	112.6
476	L	36.2	Very low	33.8	Very low	173 Å²	173	150.1 Å²	150.1	91%	0.906	84%	0.835	S	S	*	*			trans	-161.1	128.1	147.2	-113.4	168.1	0	0	0	111.5
477	Q	29.2	Very low	33.6	Very low	194 Å²	194	148.2 Å²	148.2	91%	0.907	83%	0.834	S	S	*	*			trans	-94.8	143.7	173.9	-68.3	177.7	-6.8	0	0	110.5
478	G	34.2	Very low	33.3	Very low	83 Å²	83	144.8 Å²	144.8	86%	0.856	83%	0.833	S	S	*	*			trans	-145.2	103.2	172	0	0	0	0	0	109.7
479	S	31.6	Very low	33.2	Very low	120 Å²	120	142.5 Å²	142.5	84%	0.839	83%	0.831	S	S	*	*			trans	-104.7	142.9	177.9	60.5	0	0	0	0	110.7
480	D	38	Very low	33	Very low	157 Å²	157	142.6 Å²	142.6	84%	0.84	83%	0.832	S	S	*	*			trans	-151.8	163.7	146.8	-137.1	-31.2	0	0	0	112.9
481	K	32.9	Very low	32.8	Very low	178 Å²	178	147.3 Å²	147.3	77%	0.774	83%	0.833	S	S	*	*			trans	-118.3	146.4	-172.8	-60.3	166.5	-178.7	168.4	0	109.9
482	K	37.3	Very low	32.5	Very low	203 Å²	203	150 Å²	150	88%	0.883	84%	0.835	S	S	*	*				174.2	151.9	113.2	-94.2	155.1	-170.8	167.8	0	115.5
483	N	33	Very low	32.5	Very low	159 Å²	159	150.1 Å²	150.1	85%	0.85	83%	0.834	S	S	*	*			trans	85.5	136.1	149	-130.1	5.2	0	0	0	119.4
484	C	27.1	Very low	32.5	Very low	117 Å²	117	149.3 Å²	149.3	79%	0.791	83%	0.832	S	S	*	*			trans	-132.7	139.8	-179.7	-53.9	0	0	0	0	109.7
485	K	31.8	Very low	32.1	Very low	202 Å²	202	150.7 Å²	150.7	88%	0.878	84%	0.836	S	S	*	*			trans	-141.7	139.8	149.5	-87.1	-169.8	175.6	179	0	108.6
486	P	29.5	Very low	32	Very low	131 Å²	131	150 Å²	150	85%	0.851	83%	0.832	S	S	*	*			trans	-87.8	143.5	-177.9	34.4	-33.6	0	0	0	111.7
487	S	32.8	Very low	31.7	Very low	116 Å²	116	153 Å²	153	81%	0.811	83%	0.831	S	S	*	*			trans	-140.9	147	159.4	54	0	0	0	0	109.9
488	S	29.1	Very low	31.7	Very low	113 Å²	113	153 Å²	153	79%	0.79	83%	0.831	S	S	*	*			trans	-59.2	138.6	179.4	49.3	0	0	0	0	112.2
489	N	32.1	Very low	31.4	Very low	163 Å²	163	160.5 Å²	160.5	87%	0.872	83%	0.834	S	S	*	*			trans	-145.4	138.6	152.7	-119.7	-16.2	0	0	0	112.6
490	S	29.9	Very low	31.3	Very low	107 Å²	107	165.4 Å²	165.4	75%	0.748	84%	0.84	S	S	*	*			trans	-62.9	140.7	-178.5	-54.1	0	0	0	0	111.5	E492	S490-E492 PolarHBondContact O-N 3.49Å
491	R	32	Very low	30.9	Very low	244 Å²	244	161.6 Å²	161.6	92%	0.921	84%	0.838	S	S	*	*			trans	-82.3	92.2	165.8	-85	-174.9	171.2	165.9	-1.7	110
492	E	30.5	Very low	30.7	Very low	180 Å²	180	163.6 Å²	163.6	84%	0.841	84%	0.841	S	S	*	*			trans	-63	142.5	158.8	-62.3	-173.9	139.9	0	0	109.7	S490	S490-E492 PolarHBondContact O-N 3.49Å
493	I	33.8	Very low	30.2	Very low	153 Å²	153	158.8 Å²	158.8	79%	0.785	84%	0.839	S	S	*	*			trans	-112.2	116.6	174	-61.3	177.1	0	0	0	106.8	A495	I493-A495 PolarHBondContact O-N 3.27Å
494	P	34.2	Very low	30.1	Very low	113 Å²	113	157.3 Å²	157.3	73%	0.734	83%	0.829	S	S	*	*			trans	-59.1	132.5	-177	-27.4	35.7	0	0	0	113.5
495	A	29.1	Very low	30.1	Very low	101 Å²	101	154.9 Å²	154.9	84%	0.835	82%	0.824	S	S	*	*			trans	-105.8	70.3	-173.5	0	0	0	0	0	112.6	I493	I493-A495 PolarHBondContact O-N 3.27Å
496	D	28.7	Very low	29.7	Very low	142 Å²	142	151.2 Å²	151.2	76%	0.759	82%	0.824	S	S	*	*			trans	-109.6	67.6	-176.8	-85.4	-56	0	0	0	113.9
497	W	29.2	Very low	29.6	Very low	237 Å²	237	152.5 Å²	152.5	90%	0.898	82%	0.824	S	S	*	*			trans	-132.8	53.1	167.8	-83.2	81.5	0	0	0	112.6
498	Q	28.7	Very low	29.3	Very low	193 Å²	193	154.5 Å²	154.5	90%	0.902	83%	0.826	S	S	*	*			trans	-130.2	161.1	164.4	-75.6	-168.3	-12	0	0	111.7
499	R	28.8	Very low	29.2	Very low	241 Å²	241	154.8 Å²	154.8	91%	0.909	83%	0.827	S	S	*	*			trans	72.3	64.4	170.4	-157.6	-171.9	-61.3	-110.2	-1.3	117.7
500	K	29.5	Very low	29.1	Very low	224 Å²	224	150.5 Å²	150.5	97%	0.974	81%	0.81	S	S	*	*			trans	-151.9	59.9	144.6	-117.7	167.9	-169.6	173.5	0	113.9
501	G	29.8	Very low	29.3	Very low	77 Å²	77	151.6 Å²	151.6	79%	0.794	80%	0.803	S	S	*	*			trans	-137.2	89.9	171.8	0	0	0	0	0	110.7
502	R	28	Very low	29.1	Very low	219 Å²	219	148.7 Å²	148.7	83%	0.826	80%	0.797	S	S	*	*			trans	-79.1	124.6	-178.3	-171.1	178.4	-174.1	179.3	1.5	109.2	I504	R502-I504 PolarHBondContact O-N 3.36Å
503	A	26.6	Very low	29.1	Very low	102 Å²	102	144.3 Å²	144.3	84%	0.843	79%	0.786	S	S	*	*			trans	-55.7	127.1	-175.7	0	0	0	0	0	112.8
504	I	29.9	Very low	28.9	Very low	128 Å²	128	138.1 Å²	138.1	66%	0.656	76%	0.76	S	S	*	*			trans	-144.5	126.5	167.3	-61.7	-178.4	0	0	0	107.2	R502	R502-I504 PolarHBondContact O-N 3.36Å
505	G	27	Very low	28.7	Very low	66 Å²	66	137.4 Å²	137.4	68%	0.68	76%	0.758	S	S	*	*			trans	54.5	108.3	153.5	0	0	0	0	0	118.8	N507	G505-N507 PolarHBondContact O-N 3.08Å
506	S	25.3	Very low	28.9	Very low	125 Å²	125	138.3 Å²	138.3	87%	0.874	75%	0.753	S	S	*	*			trans	-53	126	157.9	-52.9	0	0	0	0	110.6
507	N	26.9	Very low	29.3	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	76%	0.756	S	S	*	*			trans	-149.7	130.2	163.1	-104.3	-36.8	0	0	0	109.5	G505 S509	G505-N507 PolarHBondContact O-N 3.08Å; N507-S509 PolarHBondContact O-N 2.75Å; N507-S509 VanDerWaalsContact O-N 3.13Å
508	N	25.9	Very low	29.4	Very low	159 Å²	159	131.4 Å²	131.4	85%	0.85	75%	0.749	S	S	*	*			trans	-75	102.2	-175.1	-70.1	-31.7	0	0	0	110.9	S510	N508-S510 PolarHBondContact O-N 3.01Å
509	S	28	Very low	29.6	Very low	118 Å²	118	125.7 Å²	125.7	83%	0.825	74%	0.741	S	S	*	*			trans	-73.4	74.9	156.4	58.9	0	0	0	0	108.7	N507 E511	N507-S509 PolarHBondContact O-N 2.75Å; N507-S509 VanDerWaalsContact O-N 3.13Å; S509-E511 PolarHBondContact O-N 3.41Å
510	S	30.2	Very low	29.9	Very low	73 Å²	73	120.7 Å²	120.7	51%	0.51	74%	0.74	S	S	.	*			trans	-60.7	128.4	-178.7	57.7	0	0	0	0	111.1	N508 K512	N508-S510 PolarHBondContact O-N 3.01Å; S510-K512 PolarHBondContact O-N 3.38Å
511	E	32.7	Very low	30.2	Very low	130 Å²	130	114 Å²	114	61%	0.607	74%	0.735	S	S	*	*			trans	-66.9	76.8	164.4	-69.1	176.8	129	0	0	109	Y289 S509 C513	Y289-E511 PolarHBondContact OH-OE2 2.91Å; S509-E511 PolarHBondContact O-N 3.41Å; E511-C513 PolarHBondContact O-N 2.65Å
512	K	28.8	Very low	30.4	Very low	183 Å²	183	114.3 Å²	114.3	80%	0.796	74%	0.738	S	S	*	*			trans	-81	59.5	-171.5	-124.5	-176.2	-175.9	-175	0	111.7	S510 G514	S510-K512 PolarHBondContact O-N 3.38Å; K512-G514 PolarHBondContact O-N 3.32Å
513	C	30.4	Very low	30.7	Very low	88 Å²	88	107.9 Å²	107.9	60%	0.595	74%	0.739	S	S	*	*			trans	-65	114.1	160.3	-150.8	0	0	0	0	107.2	E511 S515	E511-C513 PolarHBondContact O-N 2.65Å; C513-S515 PolarHBondContact O-N 2.76Å
514	G	28.2	Very low	31	Very low	24 Å²	24	107.2 Å²	107.2	25%	0.247	74%	0.743	C	S	.	*			trans	-73.8	91.4	-160.3	0	0	0	0	0	114.5	Q216 K512	Q216-G514 PolarHBondContact NE2-O 3.04Å; K512-G514 PolarHBondContact O-N 3.32Å
515	S	31.3	Very low	31.2	Very low	98 Å²	98	105 Å²	105	69%	0.685	75%	0.752	S	S	*	*			trans	-84.3	106.6	162.9	-171.6	0	0	0	0	110	C513	C513-S515 PolarHBondContact O-N 2.76Å
516	V	32.7	Very low	31.6	Very low	120 Å²	120	105.4 Å²	105.4	73%	0.727	76%	0.756	S	S	*	*			trans	-122.2	99.1	173.9	-179.3	0	0	0	0	107.8	G518	V516-G518 PolarHBondContact O-N 2.62Å
517	I	36.5	Very low	32.2	Very low	162 Å²	162	105.5 Å²	105.5	83%	0.831	76%	0.756	S	S	*	*			trans	-83.6	104.3	175.1	-60.8	173.7	0	0	0	107.8
518	G	31.2	Very low	32.8	Very low	72 Å²	72	106.5 Å²	106.5	74%	0.742	76%	0.756	S	S	*	*			trans	-87.6	115.1	175.6	0	0	0	0	0	112.2	V516	V516-G518 PolarHBondContact O-N 2.62Å
519	G	34.7	Very low	33.5	Very low	72 Å²	72	103.7 Å²	103.7	74%	0.742	75%	0.746	S	S	*	*			trans	-106	135.8	166.2	0	0	0	0	0	110.9
520	P	34.6	Very low	33.8	Very low	136 Å²	136	104.6 Å²	104.6	88%	0.883	74%	0.742	S	S	*	*			trans	-98.3	152.3	-173.1	36.3	-34.9	0	0	0	115.2
521	G	34.9	Very low	34.1	Very low	85 Å²	85	109.1 Å²	109.1	88%	0.876	76%	0.759	S	S	*	*			trans	111	144	157.3	0	0	0	0	0	116.2
522	G	34.6	Very low	34	Very low	83 Å²	83	110.6 Å²	110.6	86%	0.856	77%	0.766	S	S	*	*			trans	148	20.5	165.2	0	0	0	0	0	122.5
523	G	33.6	Very low	34.3	Very low	83 Å²	83	106.3 Å²	106.3	86%	0.856	76%	0.759	S	S	*	*			trans	43.8	121.7	153.1	0	0	0	0	0	124.1
524	G	34.1	Very low	34.5	Very low	89 Å²	89	111 Å²	111	92%	0.918	77%	0.769	S	S	*	*			trans	88.5	146.5	149.6	0	0	0	0	0	117.8
525	G	34.8	Very low	34.6	Very low	81 Å²	81	114.2 Å²	114.2	84%	0.835	79%	0.788	S	S	*	*			cis	172.7	132.5	-10	0	0	0	0	0	113.8
526	G	34.6	Very low	34.8	Very low	75 Å²	75	116.8 Å²	116.8	77%	0.773	79%	0.794	S	S	*	*			trans	80.6	153.3	175.9	0	0	0	0	0	115.7
527	S	36.9	Very low	34.7	Very low	126 Å²	126	120 Å²	120	88%	0.881	80%	0.801	S	S	*	*			cis	-154.4	155.9	-8.4	-80.9	0	0	0	0	112.6
528	H	39.6	Very low	34.6	Very low	180 Å²	180	120.3 Å²	120.3	83%	0.833	80%	0.804	S	S	*	*			trans	-51.8	173.5	174.8	-89	-125.9	0	0	0	117.2
529	P	41.9	Very low	34.6	Very low	100 Å²	100	123.1 Å²	123.1	65%	0.649	81%	0.807	S	S	*	*			cis	-146.5	-178.7	-27.5	39.5	-20.6	0	0	0	116.7
530	N	33	Very low	34.5	Very low	137 Å²	137	123.5 Å²	123.5	73%	0.733	81%	0.81	S	S	*	*			trans	9.1	144.6	146	-59.2	7.7	0	0	0	122.3
531	L	37.4	Very low	34.3	Very low	168 Å²	168	124.2 Å²	124.2	88%	0.88	81%	0.807	S	S	*	*				-153.6	149.3	112.1	-110.2	163.7	0	0	0	112.2
532	E	30.9	Very low	34	Very low	161 Å²	161	125.5 Å²	125.5	75%	0.752	80%	0.798	S	S	*	*			trans	-88.3	176.8	175.9	-55.5	154.3	89.5	0	0	109.2
533	S	34.9	Very low	34	Very low	93 Å²	93	129.4 Å²	129.4	65%	0.65	80%	0.799	S	S	*	*			cis	-176.8	169.1	33.6	55.4	0	0	0	0	111.2
534	K	33.8	Very low	33.7	Very low	185 Å²	185	130.3 Å²	130.3	80%	0.804	79%	0.792	S	S	*	*			trans	63.7	119.4	155.8	-70.1	168.2	-178.3	178.4	0	117.5
535	S	31.5	Very low	33.8	Very low	92 Å²	92	132 Å²	132	64%	0.643	79%	0.785	S	S	*	*				68.5	129.8	69.9	84.6	0	0	0	0	112
536	D	35.6	Very low	33.5	Very low	153 Å²	153	135 Å²	135	82%	0.818	78%	0.781	S	S	*	*				-153.7	-179.4	67.5	-71.1	-24.6	0	0	0	113.6
537	E	29.8	Very low	33.6	Very low	186 Å²	186	138.9 Å²	138.9	87%	0.869	78%	0.784	S	S	*	*			trans	-80.1	159.1	177.2	-58.4	173.3	92.1	0	0	113.1
538	L	33.9	Very low	33.3	Very low	170 Å²	170	140.9 Å²	140.9	89%	0.89	79%	0.785	S	S	*	*				-171.7	154.4	122.7	-102.5	162.5	0	0	0	114.3
539	T	30.6	Very low	33.1	Very low	131 Å²	131	137.2 Å²	137.2	80%	0.804	79%	0.786	S	S	*	*			trans	-73.5	147.3	-175.5	52.9	0	0	0	0	114.5
540	G	32.6	Very low	32.6	Very low	79 Å²	79	138 Å²	138	81%	0.814	79%	0.794	S	S	*	*			trans	-157.2	110.7	173.1	0	0	0	0	0	114.9
541	N	30.9	Very low	32.7	Very low	152 Å²	152	136 Å²	136	81%	0.813	79%	0.791	S	S	*	*			trans	-66.6	145.6	-174.5	-89	-7.4	0	0	0	116.3
542	T	30	Very low	32.7	Very low	111 Å²	111	136.4 Å²	136.4	68%	0.681	79%	0.786	S	S	*	*			trans	40.2	128.3	140	65.7	0	0	0	0	121.1
543	N	33.2	Very low	33	Very low	166 Å²	166	135.4 Å²	135.4	89%	0.888	78%	0.781	S	S	*	*				-167.5	165.1	100.9	-101	-44.1	0	0	0	113.6
544	S	27.6	Very low	33.1	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	78%	0.78	S	S	*	*			trans	-108.9	131.2	-176.4	-179.7	0	0	0	0	111.8
545	V	35.9	Very low	33.3	Very low	126 Å²	126	135.4 Å²	135.4	76%	0.764	77%	0.774	S	S	*	*			trans	-144	122.7	164.9	-173.3	0	0	0	0	109
546	N	29.2	Very low	33.5	Very low	142 Å²	142	138.5 Å²	138.5	76%	0.759	78%	0.778	S	S	*	*			trans	-83.8	147.2	167.4	-64.8	-38.6	0	0	0	109.8
547	N	37.2	Very low	33.6	Very low	157 Å²	157	139.7 Å²	139.7	84%	0.84	78%	0.779	S	S	*	*			trans	-157.1	120.7	155	-94.1	-43.2	0	0	0	110.7
548	D	30.5	Very low	33.7	Very low	168 Å²	168	139.4 Å²	139.4	90%	0.898	78%	0.777	S	S	*	*			trans	-87	134.9	166.8	-77.5	-66.2	0	0	0	110.1
549	A	35.1	Very low	34	Very low	104 Å²	104	139.5 Å²	139.5	86%	0.86	77%	0.773	S	S	*	*			trans	-154.5	121.1	164.6	0	0	0	0	0	112.5
550	S	31.8	Very low	34.3	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	77%	0.767	S	S	*	*			trans	-67.5	158.4	176	-47.3	0	0	0	0	113.6
551	S	34.2	Very low	34.3	Very low	96 Å²	96	146 Å²	146	67%	0.671	77%	0.767	S	S	*	*				168.9	131.7	119.7	-83.7	0	0	0	0	116.4
552	K	37.9	Very low	34.5	Very low	175 Å²	175	144 Å²	144	76%	0.761	76%	0.762	S	S	*	*			trans	67.4	152.4	146	-59.2	168.6	178.4	174.6	0	116.9
553	Q	36.9	Very low	34.6	Very low	141 Å²	141	145.7 Å²	145.7	66%	0.659	77%	0.766	S	S	*	*			cis	-157	177.3	-10.8	-112.7	160.2	-128.7	0	0	106
554	Q	36.9	Very low	34.8	Very low	133 Å²	133	145.2 Å²	145.2	62%	0.621	76%	0.763	S	S	*	*			cis	-160.3	171.2	14.7	-138.4	159.8	-79.4	0	0	111.2
555	Q	37.3	Very low	35	Very low	144 Å²	144	148.1 Å²	148.1	67%	0.673	77%	0.766	S	S	*	*			trans	21.7	152.2	137.6	-77.2	171.5	-14.2	0	0	123.1
556	Q	36.8	Very low	34.9	Very low	158 Å²	158	148.8 Å²	148.8	74%	0.738	77%	0.765	S	S	*	*			cis	-173.5	162.1	-15.3	-137.6	165.9	-2.1	0	0	105.4
557	Q	37.1	Very low	35.1	Very low	178 Å²	178	148.8 Å²	148.8	83%	0.832	77%	0.765	S	S	*	*			cis	-153.9	-179.2	39.1	-61.9	179.8	-2.2	0	0	111.7
558	Q	33.3	Very low	35.1	Very low	180 Å²	180	148.2 Å²	148.2	84%	0.841	76%	0.761	S	S	*	*			trans	-123.3	163.8	178.7	-60.9	170.8	-18.6	0	0	110.8
559	H	40.4	Very low	35.2	Very low	172 Å²	172	149.3 Å²	149.3	80%	0.796	76%	0.758	S	S	*	*			trans	-163.7	133.3	134	-110.2	70.5	0	0	0	113.7
560	N	35.8	Very low	34.9	Very low	129 Å²	129	148.9 Å²	148.9	69%	0.69	75%	0.749	S	S	*	*			trans	19.5	163.9	148.9	-58.6	-15.4	0	0	0	124.2
561	R	33.7	Very low	35.1	Very low	216 Å²	216	149 Å²	149	82%	0.815	75%	0.749	S	S	*	*			cis	176.5	142.7	-44.6	-122.8	-174.3	176.3	-180	-1	110.1
562	T	34.4	Very low	35.1	Very low	112 Å²	112	151 Å²	151	69%	0.687	75%	0.751	S	S	*	*			trans	65	132	150.5	44.2	0	0	0	0	124
563	N	32.3	Very low	34.9	Very low	145 Å²	145	149.3 Å²	149.3	78%	0.775	75%	0.75	S	S	*	*			trans	73.5	143.9	146	-57.9	11.3	0	0	0	118
564	N	36.6	Very low	34.7	Very low	156 Å²	156	147.4 Å²	147.4	83%	0.834	75%	0.749	S	S	*	*			cis	-148.8	176.7	33.5	-124.5	-2.2	0	0	0	114.1
565	E	32	Very low	34.3	Very low	163 Å²	163	146.8 Å²	146.8	76%	0.762	75%	0.754	S	S	*	*			trans	-102	172.8	179.2	-60.2	-178.5	133.2	0	0	114.9
566	N	33.3	Very low	34.2	Very low	139 Å²	139	149.7 Å²	149.7	74%	0.743	77%	0.765	S	S	*	*			trans	72.3	130.7	163.8	-53.6	-62	0	0	0	116.5
567	N	34.7	Very low	33.9	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	77%	0.769	S	S	*	*				-173.6	166.7	71.4	-128.3	-25.8	0	0	0	115.3
568	L	36.9	Very low	33.9	Very low	144 Å²	144	143.9 Å²	143.9	75%	0.754	77%	0.768	S	S	*	*			trans	54.2	134.3	166.7	-83.9	63.8	0	0	0	118.8
569	K	31.2	Very low	33.8	Very low	192 Å²	192	141.9 Å²	141.9	84%	0.835	77%	0.768	S	S	*	*			cis	94	112.9	24.6	-77.6	-166.5	170.2	-178.8	0	118.5
570	S	29.7	Very low	33.6	Very low	95 Å²	95	137 Å²	137	66%	0.664	77%	0.765	S	S	*	*			trans	62.1	113.6	136.5	62.3	0	0	0	0	123.5
571	S	35.7	Very low	33.5	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	77%	0.772	S	S	*	*				-164.1	136	121.8	-71.9	0	0	0	0	106.8
572	I	34.5	Very low	33.4	Very low	138 Å²	138	133.4 Å²	133.4	71%	0.708	77%	0.771	S	S	*	*			cis	87.3	125.8	28.1	-59.4	-179	0	0	0	114.2
573	D	34.2	Very low	33.4	Very low	140 Å²	140	134.5 Å²	134.5	75%	0.749	78%	0.778	S	S	*	*			trans	69.3	155.5	165	-75.2	-27.6	0	0	0	122.1
574	T	31	Very low	33.4	Very low	101 Å²	101	134.4 Å²	134.4	62%	0.62	78%	0.777	S	S	*	*			cis	-174	136.6	-38.6	-101.4	0	0	0	0	110.1
575	T	30.2	Very low	33.2	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	78%	0.777	S	S	*	*			trans	52.5	134.7	168.3	59	0	0	0	0	120.8
576	K	34.1	Very low	33.2	Very low	204 Å²	204	129.1 Å²	129.1	89%	0.887	78%	0.776	S	S	*	*				-169.8	161.1	97.8	-106	176.8	-179.1	175.5	0	114.2
577	V	31.7	Very low	32.9	Very low	136 Å²	136	128.3 Å²	128.3	82%	0.824	78%	0.78	S	S	*	*			trans	-88	146.7	-179.2	174.9	0	0	0	0	110.6	T579	V577-T579 HydrophobicContact CG1-CG2 4.09Å
578	G	36.4	Very low	33	Very low	79 Å²	79	126.7 Å²	126.7	81%	0.814	78%	0.778	S	S	*	*			trans	-147.8	128.8	165.6	0	0	0	0	0	110.7
579	T	31.3	Very low	32.7	Very low	137 Å²	137	124.9 Å²	124.9	84%	0.84	78%	0.777	S	S	*	*			trans	-121.2	143.2	-169.6	48.8	0	0	0	0	112.9	V577	V577-T579 HydrophobicContact CG1-CG2 4.09Å
580	G	35.4	Very low	32.8	Very low	71 Å²	71	123.4 Å²	123.4	73%	0.732	77%	0.773	S	S	*	*			trans	143.8	150.8	165.7	0	0	0	0	0	113.2
581	T	34.2	Very low	32.8	Very low	139 Å²	139	125.8 Å²	125.8	85%	0.853	78%	0.777	S	S	*	*			cis	-153.7	154.2	-8.8	-66.6	0	0	0	0	109
582	T	30.7	Very low	32.6	Very low	129 Å²	129	129 Å²	129	79%	0.791	78%	0.779	S	S	*	*			trans	-85.7	140.6	-173.6	49.3	0	0	0	0	115.8
583	V	35.4	Very low	32.3	Very low	135 Å²	135	129.7 Å²	129.7	82%	0.818	79%	0.785	S	S	*	*			trans	-146.8	116.5	150.3	-156.5	0	0	0	0	105.6
584	N	32.6	Very low	32.7	Very low	144 Å²	144	127.1 Å²	127.1	77%	0.77	78%	0.775	S	S	*	*				50.6	141.2	80.3	-81.6	5.8	0	0	0	114.8
585	V	31.6	Very low	32.7	Very low	138 Å²	138	129.1 Å²	129.1	84%	0.836	78%	0.782	S	S	*	*			cis	-164.2	152.4	-16.3	115.9	0	0	0	0	106.9
586	G	32.3	Very low	32.8	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	79%	0.785	S	S	*	*			trans	166.1	122.2	168.3	0	0	0	0	0	117.2
587	S	27.2	Very low	32.6	Very low	121 Å²	121	125.7 Å²	125.7	85%	0.846	78%	0.782	S	S	*	*			trans	-173.7	164.9	176.1	-86.2	0	0	0	0	108.4
588	P	37.6	Very low	32.3	Very low	110 Å²	110	124.6 Å²	124.6	71%	0.714	78%	0.779	S	S	*	*			cis	-133.5	-161	-26.4	38.6	-19.7	0	0	0	112.1
589	S	29.8	Very low	32.1	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	78%	0.78	S	S	*	*			trans	73.4	159.7	164.3	81.4	0	0	0	0	116.9
590	Q	32.8	Very low	31.9	Very low	160 Å²	160	128.5 Å²	128.5	75%	0.748	78%	0.776	S	S	*	*			cis	-130.6	148	7.7	-75	-172.2	6.2	0	0	111.8
591	I	29.9	Very low	31.8	Very low	145 Å²	145	132.5 Å²	132.5	74%	0.744	78%	0.781	S	S	*	*				52.7	113.3	103.8	-40.2	167.9	0	0	0	115.8
592	E	32.4	Very low	31.5	Very low	185 Å²	185	133.8 Å²	133.8	86%	0.864	78%	0.777	S	S	*	*				179.5	167	117.8	-96.5	-166.6	170.2	0	0	113.7
593	N	28.3	Very low	31.6	Very low	153 Å²	153	134.3 Å²	134.3	82%	0.818	78%	0.775	S	S	*	*			trans	-169.5	166.7	-167.6	-140.6	7	0	0	0	107.4
594	P	41	Very low	31.2	Very low	86 Å²	86	134.7 Å²	134.7	56%	0.558	77%	0.772	S	S	*	*			cis	-132.2	-160.7	-24.2	33.3	-10.6	0	0	0	112.6
595	N	30.9	Very low	31.3	Very low	143 Å²	143	135.7 Å²	135.7	77%	0.765	78%	0.776	S	S	*	*			trans	75.4	135.3	159	-54.9	-27.9	0	0	0	120.2
596	V	32.8	Very low	31.4	Very low	130 Å²	130	135.8 Å²	135.8	79%	0.788	77%	0.772	S	S	*	*				170.8	134.2	107	154.8	0	0	0	0	112.2
597	C	30	Very low	31.2	Very low	123 Å²	123	139.2 Å²	139.2	83%	0.831	77%	0.774	S	S	*	*			trans	50.1	145.4	160.4	-72.2	0	0	0	0	124.1
598	C	25	Very low	31.4	Very low	113 Å²	113	140.2 Å²	140.2	76%	0.764	77%	0.769	S	S	*	*			trans	-84.5	165.5	164.8	-51.1	0	0	0	0	111.4
599	N	32	Very low	31.2	Very low	156 Å²	156	142.7 Å²	142.7	83%	0.834	78%	0.777	S	S	*	*				-165.1	160.4	119.4	-102.7	6.9	0	0	0	111.1
600	D	28.7	Very low	31.2	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	78%	0.776	S	S	*	*			trans	-80.7	152.8	-170.6	-47	-90.5	0	0	0	113.5
601	N	32	Very low	31	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	77%	0.771	S	S	*	*				-165.2	164.6	116.4	-107.7	-39.4	0	0	0	114
602	E	27.6	Very low	30.9	Very low	166 Å²	166	140.8 Å²	140.8	78%	0.776	77%	0.771	S	S	*	*			trans	-68.3	148.5	-177.1	-52.3	170.6	121.5	0	0	112.8
603	N	33.2	Very low	30.7	Very low	140 Å²	140	136.7 Å²	136.7	75%	0.749	76%	0.758	S	S	*	*				-177.8	106.8	116.7	-101.5	-72.9	0	0	0	113.9	I605	N603-I605 PolarHBondContact O-N 3.08Å
604	N	28.5	Very low	30.7	Very low	143 Å²	143	133.9 Å²	133.9	77%	0.765	75%	0.747	S	S	*	*				25.6	93.1	127.4	-168.8	19.9	0	0	0	118.6
605	I	34.3	Very low	30.1	Very low	164 Å²	164	136.6 Å²	136.6	84%	0.841	76%	0.757	S	S	*	*			trans	-129.2	137	161	-65.2	-175.3	0	0	0	110.8	N603	N603-I605 PolarHBondContact O-N 3.08Å
606	N	32.8	Very low	30.1	Very low	140 Å²	140	134 Å²	134	75%	0.749	75%	0.746	S	S	*	*			trans	-63.6	158	-169.5	-75	-59.4	0	0	0	116.6	N608	N606-N608 PolarHBondContact O-N 2.84Å
607	N	29.5	Very low	30	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	74%	0.744	S	S	*	*			trans	-24.8	124.3	153.9	-72.2	-41	0	0	0	115
608	N	31.1	Very low	30.2	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	72%	0.724	S	S	*	*			trans	-154.4	85.6	143.9	-112.4	-26.3	0	0	0	110.3	N606 N610	N606-N608 PolarHBondContact O-N 2.84Å; N608-N610 PolarHBondContact O-N 3.23Å
609	N	32.4	Very low	30.4	Very low	163 Å²	163	136.2 Å²	136.2	87%	0.872	72%	0.723	S	S	*	*			trans	-74	67.6	173.1	-82.3	-22.4	0	0	0	110.6	S611	N609-S611 PolarHBondContact O-N 2.94Å; N609-S611 VanDerWaalsContact O-N 3.11Å
610	N	30.6	Very low	30.4	Very low	135 Å²	135	134 Å²	134	72%	0.722	72%	0.72	S	S	*	*			trans	-65.5	110.6	170.7	-101.2	-15.4	0	0	0	109.3	N608 I612	N608-N610 PolarHBondContact O-N 3.23Å; N610-I612 PolarHBondContact O-N 3.29Å
611	S	27.7	Very low	30.6	Very low	93 Å²	93	130.5 Å²	130.5	65%	0.65	70%	0.698	S	S	*	*			trans	-64.2	94.2	173.5	170.2	0	0	0	0	110.3	N609 T613	N609-S611 PolarHBondContact O-N 2.94Å; N609-S611 VanDerWaalsContact O-N 3.11Å; S611-T613 PolarHBondContact O-N 3.3Å; S611-T613 PolarHBondContact O-OG1 3.04Å
612	I	28.6	Very low	30.7	Very low	143 Å²	143	128.7 Å²	128.7	73%	0.733	69%	0.693	S	S	*	*			trans	-74.7	76.3	169.1	-55.8	-178.4	0	0	0	108.6	N610 T614	N610-I612 PolarHBondContact O-N 3.29Å; I612-T614 VanDerWaalsContact C-N 3.29Å; I612-T614 HydrophobicContact CG2-CG2 4.16Å; I612-T614 PolarHBondContact O-N 2.98Å
613	T	26.9	Very low	31	Very low	99 Å²	99	125.8 Å²	125.8	61%	0.607	69%	0.688	S	S	*	*			trans	-72.8	82	166.8	32.2	0	0	0	0	109.7	S611 N615	S611-T613 PolarHBondContact O-N 3.3Å; S611-T613 PolarHBondContact O-OG1 3.04Å; T613-N615 PolarHBondContact O-N 2.96Å
614	T	29.7	Very low	31.2	Very low	93 Å²	93	124.1 Å²	124.1	57%	0.571	69%	0.685	S	S	*	*			trans	-65.6	97	162.6	42	0	0	0	0	109.1	I612 V616	I612-T614 VanDerWaalsContact C-N 3.29Å; I612-T614 HydrophobicContact CG2-CG2 4.16Å; I612-T614 PolarHBondContact O-N 2.98Å; T614-V616 PolarHBondContact O-N 3.01Å
615	N	27	Very low	31.5	Very low	143 Å²	143	123.3 Å²	123.3	77%	0.765	69%	0.685	S	S	*	*			trans	-69.7	76.7	174.8	-80	-27.8	0	0	0	111	T613 H617	T613-N615 PolarHBondContact O-N 2.96Å; N615-H617 PolarHBondContact O-N 3.03Å
616	V	32.6	Very low	31.7	Very low	89 Å²	89	123.1 Å²	123.1	54%	0.539	68%	0.68	S	S	.	*			trans	-75.2	92.2	175.5	-170	0	0	0	0	109.2	T614 L618	T614-V616 PolarHBondContact O-N 3.01Å; V616-L618 VanDerWaalsContact C-N 3.32Å; V616-L618 HydrophobicContact CG1-CD2 4.48Å; V616-L618 HydrophobicContact CG1-CG 4.12Å; V616-L618 PolarHBondContact O-N 2.99Å
617	H	29.5	Very low	31.6	Very low	164 Å²	164	122.3 Å²	122.3	76%	0.759	68%	0.682	S	S	*	*			trans	-81.9	72.7	-174.1	-131.5	42.6	0	0	0	111.7	N615 K619	N615-H617 PolarHBondContact O-N 3.03Å; H617-K619 PolarHBondContact O-N 2.86Å
618	L	34.6	Very low	31.8	Very low	78 Å²	78	123.1 Å²	123.1	41%	0.408	69%	0.687	S	S	.	*			trans	-69	90.6	175.3	-71.7	174.8	0	0	0	111.2	V331 V335 V616 F621	V331-L618 HydrophobicContact CG1-CD1 4.08Å; V335-L618 HydrophobicContact CG2-CD1 4.07Å; V616-L618 VanDerWaalsContact C-N 3.32Å; V616-L618 HydrophobicContact CG1-CD2 4.48Å; V616-L618 HydrophobicContact CG1-CG 4.12Å; V616-L618 PolarHBondContact O-N 2.99Å; L618-F621 HydrophobicContact CB-CD2 4.46Å; L618-F621 HydrophobicContact CD1-CD2 4.42Å; L618-F621 HydrophobicContact CD1-CE2 3.98Å; L618-F621 HydrophobicContact CD2-CE2 4.2Å; L618-F621 HydrophobicContact CG-CE2 4.5Å
619	K	30.2	Very low	31.9	Very low	171 Å²	171	122 Å²	122	74%	0.743	69%	0.69	S	S	*	*			trans	-73.4	137.2	168.5	-72.2	-177.5	175.3	178.7	0	110.3	H617	H617-K619 PolarHBondContact O-N 2.86Å
620	S	30	Very low	31.9	Very low	109 Å²	109	119.3 Å²	119.3	76%	0.762	68%	0.684	S	S	*	*			trans	50.8	68.1	170.3	56.2	0	0	0	0	116.7
621	F	33	Very low	31.9	Very low	68 Å²	68	121.1 Å²	121.1	30%	0.298	69%	0.688	S	S	.	*			trans	-80.2	115.3	146.6	-97.4	-93.7	0	0	0	109.2	V331 Y359 L618	V331-F621 HydrophobicContact CB-CD1 4.37Å; V331-F621 HydrophobicContact CB-CG 4.33Å; V331-F621 HydrophobicContact CG1-CD1 3.99Å; V331-F621 HydrophobicContact CG1-CD2 3.5Å; V331-F621 HydrophobicContact CG1-CE1 3.95Å; V331-F621 HydrophobicContact CG1-CE2 3.45Å; V331-F621 VanDerWaalsContact CG1-CE2 3.45Å; V331-F621 HydrophobicContact CG1-CG 3.76Å; V331-F621 HydrophobicContact CG1-CZ 3.67Å; V331-F621 HydrophobicContact CG2-CB 3.87Å; V331-F621 HydrophobicContact CG2-CD1 3.43Å; V331-F621 VanDerWaalsContact CG2-CD1 3.43Å; V331-F621 HydrophobicContact CG2-CD2 4.24Å; V331-F621 HydrophobicContact CG2-CE1 3.94Å; V331-F621 HydrophobicContact CG2-CG 3.59Å; Y359-F621 AromaticContact CE1-CZ 3.97Å; Y359-F621 HydrophobicContact CE1-CZ 3.97Å; Y359-F621 HydrophobicContact CE2-CE1 4.2Å; Y359-F621 HydrophobicContact CE2-CZ 4.15Å; Y359-F621 AromaticContact CZ-CE1 3.98Å; Y359-F621 AromaticContact CZ-CE2 3.99Å; Y359-F621 AromaticContact CZ-CZ 3.46Å; Y359-F621 VanDerWaalsContact CZ-CZ 3.46Å; Y359-F621 WeakPolarHBondContact OH-CE2 3.41Å; Y359-F621 WeakPolarHBondContact OH-CZ 3.38Å; L618-F621 HydrophobicContact CB-CD2 4.46Å; L618-F621 HydrophobicContact CD1-CD2 4.42Å; L618-F621 HydrophobicContact CD1-CE2 3.98Å; L618-F621 HydrophobicContact CD2-CE2 4.2Å; L618-F621 HydrophobicContact CG-CE2 4.5Å
622	V	34.1	Very low	32.1	Very low	118 Å²	118	124.8 Å²	124.8	72%	0.715	70%	0.695	S	S	*	*			trans	-125.6	121	167.5	-179.4	0	0	0	0	106.9
623	P	35.4	Very low	32.1	Very low	105 Å²	105	128.8 Å²	128.8	68%	0.682	70%	0.701	S	S	*	*			trans	-66.7	140.5	175.9	28.7	-33.8	0	0	0	109.6	T625	P623-T625 PolarHBondContact O-N 2.84Å
624	P	37.1	Very low	32.5	Very low	104 Å²	104	129.8 Å²	129.8	68%	0.675	71%	0.707	S	S	*	*			trans	-65.7	111.2	-176.7	25.8	-33.8	0	0	0	111.1	H626	P624-H626 PolarHBondContact O-N 2.92Å
625	T	34.5	Very low	32.5	Very low	126 Å²	126	133 Å²	133	77%	0.773	72%	0.721	S	S	*	*			trans	-68.9	109.6	164.4	49.3	0	0	0	0	108.5	P623 P627	P623-T625 PolarHBondContact O-N 2.84Å; T625-P627 VanDerWaalsContact O-CD 3.29Å; T625-P627 WeakPolarHBondContact O-CD 3.41Å
626	H	37.7	Very low	32.9	Very low	161 Å²	161	134.5 Å²	134.5	75%	0.745	73%	0.728	S	S	*	*			trans	-56.4	119.9	178.8	-81.5	-80.5	0	0	0	111.4	P624 N628	P624-H626 PolarHBondContact O-N 2.92Å; H626-N628 PolarHBondContact O-N 3.45Å
627	P	30.6	Very low	32.9	Very low	122 Å²	122	134.5 Å²	134.5	79%	0.792	73%	0.732	S	S	*	*			trans	-83.2	92.7	172.4	32.5	-30.1	0	0	0	109	T625	T625-P627 VanDerWaalsContact O-CD 3.29Å; T625-P627 WeakPolarHBondContact O-CD 3.41Å
628	N	34.9	Very low	33.1	Very low	161 Å²	161	135.4 Å²	135.4	86%	0.861	74%	0.736	S	S	*	*			trans	-154.7	63.3	173.4	-112.2	-14.4	0	0	0	113.9	H626	H626-N628 PolarHBondContact O-N 3.45Å
629	S	32.6	Very low	33.3	Very low	116 Å²	116	137.3 Å²	137.3	81%	0.811	75%	0.751	S	S	*	*			trans	-156.9	88.1	154.9	62	0	0	0	0	108.7	E631	S629-E631 PolarHBondContact O-N 2.85Å
630	S	33.2	Very low	33.6	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	77%	0.772	S	S	*	*			trans	-67.1	126	-179.4	51.5	0	0	0	0	111.3	Q632	S630-Q632 VanDerWaalsContact C-N 3.33Å; S630-Q632 PolarHBondContact O-N 3.47Å
631	E	29.4	Very low	33.7	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	77%	0.773	S	S	*	*			trans	-68.3	84.4	173.1	-68.4	-168.1	128.2	0	0	111.6	S629 R633	S629-E631 PolarHBondContact O-N 2.85Å; E631-R633 VanDerWaalsContact C-N 3.29Å; E631-R633 PolarHBondContact O-N 3.11Å
632	Q	32.5	Very low	33.8	Very low	170 Å²	170	147 Å²	147	79%	0.794	80%	0.798	S	S	*	*			trans	-74.4	88.7	159.1	-80.9	-165.3	-22.2	0	0	109.4	S630 T634	S630-Q632 VanDerWaalsContact C-N 3.33Å; S630-Q632 PolarHBondContact O-N 3.47Å; Q632-T634 PolarHBondContact O-N 3.44Å
633	R	27.8	Very low	33.7	Very low	226 Å²	226	148.6 Å²	148.6	85%	0.853	80%	0.803	S	S	*	*			trans	-65.1	94.3	161.2	-79.2	-178	169.4	-167.4	-2.6	109.8	E631	E631-R633 VanDerWaalsContact C-N 3.29Å; E631-R633 PolarHBondContact O-N 3.11Å
634	T	35.8	Very low	33.7	Very low	120 Å²	120	151.2 Å²	151.2	74%	0.736	81%	0.81	S	S	*	*			trans	-108.9	119	157.2	47.4	0	0	0	0	108.9	Q632	Q632-T634 PolarHBondContact O-N 3.44Å
635	N	30.3	Very low	33.4	Very low	160 Å²	160	154.1 Å²	154.1	86%	0.856	82%	0.818	S	S	*	*			trans	-62.4	137.9	168.3	-62.1	-47.3	0	0	0	109.1
636	L	35.4	Very low	33.4	Very low	175 Å²	175	156 Å²	156	92%	0.916	82%	0.821	S	S	*	*			trans	-159.3	127.2	139.4	-106.9	164	0	0	0	108.3
637	S	31.3	Very low	33.1	Very low	89 Å²	89	155.6 Å²	155.6	62%	0.622	83%	0.826	S	S	*	*			trans	-103.4	152.8	177	51.2	0	0	0	0	109.7
638	E	34.3	Very low	33.2	Very low	183 Å²	183	158.2 Å²	158.2	86%	0.855	83%	0.829	S	S	*	*			trans	69.4	140	172.1	-44.8	177.8	140.8	0	0	112.6
639	V	38.7	Very low	33.1	Very low	119 Å²	119	158 Å²	158	72%	0.721	83%	0.826	S	S	*	*			cis	-147.6	152.1	21	173.5	0	0	0	0	109.7
640	H	36	Very low	33.2	Very low	257 Å²	257	161.8 Å²	161.8	100%	1.19	83%	0.828	S	S	*	*			trans	69.6	0	168.1	-85.6	-52.8	0	0	0	119.6

Retrieved 640 of 640 residues in 1040.7 ms (Link to these results)

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