A0A068BFR6_MOUSE Loading...

Kinesin-like protein

Minus end-directed microtubule-dependent motor required for bipolar spindle formation. May contribute to movement of early endocytic vesicles. Regulates cilium formation and structure.

AlphaFold DB , UniProt , Accession A0A068BFR6, Species MOUSE (Mus musculus, Mouse), Gene Kifc1, Length 674 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	34.4	Very low	242 Å²	242	162.9 Å²	162.9	100%	1.192	86%	0.864	S	S	*	*				0	157.3	0	-62.8	-179.8	-174.7	0	0	107.5
2	D	36.7	Very low	34.2	Very low	159 Å²	159	161.7 Å²	161.7	85%	0.85	85%	0.849	S	S	*	*			trans	-67.2	138.1	-157.4	-54.3	-94.3	0	0	0	115.9
3	V	32.4	Very low	33.8	Very low	136 Å²	136	158.5 Å²	158.5	82%	0.824	84%	0.84	S	S	*	*			trans	-140.3	128.1	133	-178.5	0	0	0	0	109.8
4	Q	31.6	Very low	33.8	Very low	167 Å²	167	158.6 Å²	158.6	78%	0.78	83%	0.83	S	S	*	*			trans	-15.9	134	165.2	-60.6	161.5	-15.5	0	0	118.7
5	A	34.7	Very low	33.4	Very low	107 Å²	107	162.6 Å²	162.6	88%	0.884	83%	0.83	S	S	*	*			trans	-102.5	130.1	159.2	0	0	0	0	0	110.7
6	Q	32.3	Very low	33.2	Very low	178 Å²	178	162.8 Å²	162.8	83%	0.832	83%	0.833	S	S	*	*			trans	-94.4	142.6	-175.8	-63.9	179.9	-3.6	0	0	112.9
7	R	35.8	Very low	33.1	Very low	243 Å²	243	159.8 Å²	159.8	92%	0.917	82%	0.824	S	S	*	*			trans	-104.3	143.9	154.2	-77.1	-179.4	171.2	-177.4	-2.3	106.6
8	P	35.9	Very low	33	Very low	117 Å²	117	159.3 Å²	159.3	76%	0.76	82%	0.818	S	S	*	*				-152.3	-157.8	71.1	43.5	-23.6	0	0	0	112.5
9	P	41.5	Very low	32.7	Very low	113 Å²	113	159.3 Å²	159.3	73%	0.734	82%	0.818	S	S	*	*			cis	-118.8	175.4	-24.7	17.4	5.8	0	0	0	113.2
10	L	33.8	Very low	32.7	Very low	173 Å²	173	160.1 Å²	160.1	91%	0.906	82%	0.815	S	S	*	*			trans	-79.5	144.2	162.7	-74.7	159.4	0	0	0	110.7
11	L	30.1	Very low	32.5	Very low	157 Å²	157	157.2 Å²	157.2	82%	0.822	82%	0.816	S	S	*	*			trans	-122.8	100.6	165.8	-90.5	166.7	0	0	0	109.8	V13	L11-V13 PolarHBondContact O-N 3.39Å
12	E	32.1	Very low	32.2	Very low	148 Å²	148	150.2 Å²	150.2	69%	0.692	80%	0.796	S	S	*	*			trans	-68	123.5	161.2	-76.8	-159.1	129	0	0	109	K14	E12-K14 VanDerWaalsContact CD-NZ 3.3Å; E12-K14 IonicContact OE1-NZ 2.74Å; E12-K14 PolarHBondContact OE1-NZ 3.26Å; E12-K14 VanDerWaalsContact OE1-NZ 3.08Å; E12-K14 IonicContact OE2-NZ 3.96Å; E12-K14 PolarHBondContact OE2-NZ 3.27Å
13	V	29	Very low	31.7	Very low	121 Å²	121	150 Å²	150	73%	0.733	80%	0.795	S	S	*	*			trans	-118.3	88	164.6	-178	0	0	0	0	109.1	L11 R15	L11-V13 PolarHBondContact O-N 3.39Å; V13-R15 PolarHBondContact O-N 3.32Å
14	K	33.9	Very low	31.5	Very low	160 Å²	160	149.8 Å²	149.8	70%	0.696	79%	0.793	S	S	*	*			trans	-70.8	115.3	165	-72.7	168	-179.6	131.8	0	108.5	E12	E12-K14 VanDerWaalsContact CD-NZ 3.3Å; E12-K14 IonicContact OE1-NZ 2.74Å; E12-K14 PolarHBondContact OE1-NZ 3.26Å; E12-K14 VanDerWaalsContact OE1-NZ 3.08Å; E12-K14 IonicContact OE2-NZ 3.96Å; E12-K14 PolarHBondContact OE2-NZ 3.27Å
15	R	28.1	Very low	31.4	Very low	218 Å²	218	150.8 Å²	150.8	82%	0.823	80%	0.795	S	S	*	*			trans	-137.9	95.9	164.8	-112.6	-179.6	178.9	164.9	1.2	111.1	V13	V13-R15 PolarHBondContact O-N 3.32Å
16	N	29.8	Very low	31	Very low	166 Å²	166	151.2 Å²	151.2	89%	0.888	79%	0.791	S	S	*	*			trans	-66.5	132.2	157.6	-68.5	-7.1	0	0	0	108.1
17	V	30.7	Very low	30.7	Very low	111 Å²	111	148.4 Å²	148.4	67%	0.673	79%	0.791	S	S	*	*			trans	-133.2	103.5	162.2	178.9	0	0	0	0	106.8	L19	V17-L19 HydrophobicContact CG1-CD1 4.33Å; V17-L19 HydrophobicContact CG1-CG 4.13Å; V17-L19 PolarHBondContact O-N 2.68Å
18	E	31.9	Very low	30.3	Very low	152 Å²	152	142.8 Å²	142.8	71%	0.71	79%	0.789	S	S	*	*			trans	-69.9	124.1	165.2	-68.9	-161.8	139.9	0	0	108.7	K20	E18-K20 IonicContact OE1-NZ 2.72Å; E18-K20 IonicContact OE2-NZ 3.84Å; E18-K20 PolarHBondContact OE2-NZ 2.64Å
19	L	27.8	Very low	29.9	Very low	158 Å²	158	148 Å²	148	83%	0.827	79%	0.794	S	S	*	*			trans	-121.3	94.5	163.3	-84.5	169	0	0	0	109.7	V17 A21	V17-L19 HydrophobicContact CG1-CD1 4.33Å; V17-L19 HydrophobicContact CG1-CG 4.13Å; V17-L19 PolarHBondContact O-N 2.68Å; L19-A21 PolarHBondContact O-N 3.23Å
20	K	32.1	Very low	29.2	Very low	175 Å²	175	149 Å²	149	76%	0.761	80%	0.798	S	S	*	*			trans	-75	109.1	168.7	-71.7	165.4	178.9	135.4	0	108.5	E18	E18-K20 IonicContact OE1-NZ 2.72Å; E18-K20 IonicContact OE2-NZ 3.84Å; E18-K20 PolarHBondContact OE2-NZ 2.64Å
21	A	28.6	Very low	29.3	Very low	100 Å²	100	146 Å²	146	83%	0.826	79%	0.789	S	S	*	*			trans	-110.4	141.1	167.1	0	0	0	0	0	109.7	L19	L19-A21 PolarHBondContact O-N 3.23Å
22	A	26.4	Very low	29.2	Very low	95 Å²	95	147 Å²	147	79%	0.785	79%	0.794	S	S	*	*			trans	-82.6	142.7	-165.9	0	0	0	0	0	113.9	V24	A22-V24 PolarHBondContact O-N 3.23Å
23	L	26.7	Very low	29	Very low	156 Å²	156	145.6 Å²	145.6	82%	0.817	80%	0.8	S	S	*	*			trans	-80.9	91.5	179.6	-164	87.4	0	0	0	111.5	K25	L23-K25 PolarHBondContact O-N 3.27Å
24	V	28.1	Very low	29	Very low	131 Å²	131	144.9 Å²	144.9	79%	0.794	81%	0.807	S	S	*	*			trans	-81.9	110.6	173.5	-178.9	0	0	0	0	110.1	A22	A22-V24 PolarHBondContact O-N 3.23Å
25	K	29.4	Very low	28.8	Very low	187 Å²	187	143 Å²	143	81%	0.813	81%	0.814	S	S	*	*			trans	-84.3	122.5	168.6	-66.7	177.5	179.1	176.5	0	109.6	L23	L23-K25 PolarHBondContact O-N 3.27Å
26	S	26.4	Very low	28.9	Very low	116 Å²	116	144.2 Å²	144.2	81%	0.811	82%	0.819	S	S	*	*			trans	-113.7	124.3	164.1	50.5	0	0	0	0	109.8
27	S	27	Very low	28.9	Very low	119 Å²	119	144.7 Å²	144.7	83%	0.832	82%	0.821	S	S	*	*			trans	-96.8	115.4	179.9	55.4	0	0	0	0	110.7
28	S	26	Very low	28.9	Very low	125 Å²	125	148.4 Å²	148.4	87%	0.874	83%	0.828	S	S	*	*			trans	-78.4	125.7	172.8	46.6	0	0	0	0	111.6
29	R	29.5	Very low	28.8	Very low	227 Å²	227	153 Å²	153	86%	0.857	84%	0.839	S	S	*	*			trans	-148.1	160.9	167.8	-89	-170.4	163.3	-165.7	-2.7	108.7
30	V	25.8	Very low	28.9	Very low	134 Å²	134	148.8 Å²	148.8	81%	0.812	83%	0.833	S	S	*	*			trans	76.4	137	163.9	-160.4	0	0	0	0	115.1
31	P	35.3	Very low	29.4	Very low	110 Å²	110	146.2 Å²	146.2	71%	0.714	83%	0.834	S	S	*	*			cis	-124.7	177.9	-29.5	36.8	-21.8	0	0	0	113.2
32	L	28.8	Very low	29.5	Very low	177 Å²	177	149.5 Å²	149.5	93%	0.927	84%	0.838	S	S	*	*			trans	-91.3	139	155.7	-71.6	166.4	0	0	0	109.8
33	S	28.3	Very low	29.7	Very low	119 Å²	119	154 Å²	154	83%	0.832	84%	0.842	S	S	*	*			trans	-142.9	122.8	155.4	57.1	0	0	0	0	109.3
34	A	28.1	Very low	29.7	Very low	107 Å²	107	155 Å²	155	88%	0.884	85%	0.845	S	S	*	*			trans	-121.5	131.1	-176.9	0	0	0	0	0	110.5
35	S	30.4	Very low	29.8	Very low	120 Å²	120	156.3 Å²	156.3	84%	0.839	84%	0.842	S	S	*	*			trans	-145.5	115.3	166.1	55.7	0	0	0	0	110
36	R	30.2	Very low	29.7	Very low	243 Å²	243	154.9 Å²	154.9	92%	0.917	84%	0.844	S	S	*	*			trans	-65.3	152.9	167.7	-64.1	172	170.9	177.3	-3.6	109.7
37	L	29.9	Very low	29.8	Very low	177 Å²	177	153.5 Å²	153.5	93%	0.927	84%	0.84	S	S	*	*				-155.6	158.8	129.4	-109.3	167.7	0	0	0	110.5
38	K	31	Very low	29.9	Very low	188 Å²	188	156.2 Å²	156.2	82%	0.817	84%	0.844	S	S	*	*			trans	-108.1	144.2	176.9	-64.4	178.9	175.7	-176.2	0	109.5
39	R	29.1	Very low	30.1	Very low	250 Å²	250	158.6 Å²	158.6	94%	0.943	84%	0.841	S	S	*	*				-173.6	167.2	122.9	-101.1	166.8	-154.6	-144.3	5.9	111.4
40	G	29.9	Very low	30.7	Very low	68 Å²	68	152.3 Å²	152.3	70%	0.701	83%	0.83	S	S	*	*			trans	-80.5	-173.9	-174.8	0	0	0	0	0	114.3
41	P	42.5	Very low	30.9	Very low	121 Å²	121	151 Å²	151	79%	0.786	83%	0.833	S	S	*	*			trans	-88.3	161	-174.3	37.2	-35.6	0	0	0	112.7
42	D	30.3	Very low	30.7	Very low	170 Å²	170	155.2 Å²	155.2	91%	0.909	84%	0.84	S	S	*	*			trans	-139.9	146.7	149.6	-85.9	-53	0	0	0	108.2
43	Q	30.3	Very low	30.9	Very low	188 Å²	188	157.2 Å²	157.2	88%	0.879	84%	0.841	S	S	*	*			trans	-121.8	134.3	171.1	-69.6	179.5	-16.5	0	0	107.8
44	M	28.4	Very low	31	Very low	178 Å²	178	162.3 Å²	162.3	88%	0.877	84%	0.842	S	S	*	*			trans	-158.3	166.3	151.3	-104.9	-165	94.2	0	0	110.9
45	E	30.1	Very low	31.1	Very low	158 Å²	158	163.1 Å²	163.1	74%	0.738	84%	0.836	S	S	*	*			trans	-89.3	173.3	-153.1	-63	152.7	121.8	0	0	115.8
46	D	27.5	Very low	31.1	Very low	157 Å²	157	168.1 Å²	168.1	84%	0.84	84%	0.837	S	S	*	*			trans	49.8	123.4	150.8	-72.8	-2.5	0	0	0	122
47	A	28.2	Very low	31.1	Very low	88 Å²	88	162 Å²	162	73%	0.727	83%	0.827	S	S	*	*				-179.7	133.3	92.5	0	0	0	0	0	115.2
48	L	29	Very low	31.1	Very low	175 Å²	175	162.2 Å²	162.2	92%	0.916	83%	0.825	S	S	*	*			trans	55.1	125.9	139.2	-64.3	166.4	0	0	0	123.3
49	E	29.1	Very low	30.9	Very low	176 Å²	176	156.9 Å²	156.9	82%	0.822	82%	0.823	S	S	*	*			trans	-62.2	-178.8	156.7	-103.3	-160.5	-151	0	0	114.4
50	P	43.1	Very low	30.9	Very low	95 Å²	95	150 Å²	150	62%	0.617	82%	0.82	S	S	*	*			cis	-136.2	177.6	-34.2	35.9	-19.1	0	0	0	113.3
51	A	29.8	Very low	31	Very low	107 Å²	107	153.4 Å²	153.4	88%	0.884	83%	0.826	S	S	*	*			trans	-120.6	102.2	174.4	0	0	0	0	0	114.3
52	K	32	Very low	30.5	Very low	197 Å²	197	153.9 Å²	153.9	86%	0.857	83%	0.828	S	S	*	*			trans	-96.5	135.8	166.6	-69	174.3	-178.9	167.9	0	110.8
53	K	32.6	Very low	30.5	Very low	220 Å²	220	155.2 Å²	155.2	96%	0.957	83%	0.825	S	S	*	*			trans	-151.2	162.8	156.8	-113.2	164.2	-172.7	174.1	0	111.7
54	R	30.6	Very low	30.6	Very low	226 Å²	226	152.6 Å²	152.6	85%	0.853	82%	0.822	S	S	*	*			trans	-152.3	140.5	-147	-166.9	-177.5	-172.9	-168	3	111.6
55	T	30	Very low	30.6	Very low	124 Å²	124	152 Å²	152	76%	0.761	82%	0.822	S	S	*	*			trans	63.4	163.3	164.4	40.6	0	0	0	0	117.8
56	R	29	Very low	30.8	Very low	224 Å²	224	150.7 Å²	150.7	85%	0.845	83%	0.825	S	S	*	*			cis	-152.4	132.6	8.5	-127.4	175.8	169.2	-178.8	-3.8	108
57	V	30.3	Very low	31	Very low	116 Å²	116	149 Å²	149	70%	0.703	83%	0.825	S	S	*	*				78.6	146.4	91.2	177.6	0	0	0	0	117.2
58	M	30.2	Very low	31.3	Very low	181 Å²	181	156.3 Å²	156.3	89%	0.892	83%	0.834	S	S	*	*			trans	82.2	136.2	-176.3	-56.8	-53.6	-177.8	0	0	116.3
59	G	27.1	Very low	32.1	Very low	75 Å²	75	154 Å²	154	77%	0.773	83%	0.83	S	S	*	*			cis	153.1	129.1	-12.2	0	0	0	0	0	114.1
60	A	29.8	Very low	32.3	Very low	107 Å²	107	157.5 Å²	157.5	88%	0.884	84%	0.835	S	S	*	*			trans	-161.5	165.9	173.4	0	0	0	0	0	112.9
61	V	30.6	Very low	31.8	Very low	138 Å²	138	156.3 Å²	156.3	84%	0.836	84%	0.84	S	S	*	*			trans	-139	136.1	-171.8	172.5	0	0	0	0	112.2
62	T	31.8	Very low	32.6	Very low	132 Å²	132	156.9 Å²	156.9	81%	0.81	84%	0.835	S	S	*	*			trans	-169.3	119.2	148	21.9	0	0	0	0	108.1
63	K	31.3	Very low	32.6	Very low	197 Å²	197	154.9 Å²	154.9	86%	0.857	83%	0.833	S	S	*	*				65.6	129.6	88.6	-81	-161.2	171.7	-169.9	0	115.7
64	V	31.5	Very low	32.5	Very low	133 Å²	133	151.2 Å²	151.2	81%	0.806	82%	0.823	S	S	*	*			trans	-114.6	145.1	177.5	173.9	0	0	0	0	108.7	T66	V64-T66 HydrophobicContact CG1-CG2 4.35Å
65	D	29.5	Very low	32.5	Very low	166 Å²	166	145.3 Å²	145.3	89%	0.888	82%	0.816	S	S	*	*			trans	-136.9	139.9	170.9	-119.9	-43.6	0	0	0	109
66	T	34.1	Very low	32.6	Very low	131 Å²	131	145.1 Å²	145.1	80%	0.804	82%	0.815	S	S	*	*			trans	-139.3	130.9	178.3	51.5	0	0	0	0	111.5	V64	V64-T66 HydrophobicContact CG1-CG2 4.35Å
67	S	31.8	Very low	32.9	Very low	120 Å²	120	140.2 Å²	140.2	84%	0.839	81%	0.81	S	S	*	*			trans	-115	150.1	-169.4	55.3	0	0	0	0	113.6
68	R	34.6	Very low	33	Very low	243 Å²	243	139.8 Å²	139.8	92%	0.917	81%	0.811	S	S	*	*			trans	-96	150.8	173.4	-76.3	179.6	168	178.9	-4.2	111.8
69	P	44.7	Very low	33.3	Very low	126 Å²	126	139 Å²	139	82%	0.818	81%	0.806	S	S	*	*			trans	-108.3	-174.7	144.4	-10.4	30.5	0	0	0	114.3
70	R	34.4	Very low	33.7	Very low	250 Å²	250	141 Å²	141	94%	0.943	80%	0.803	S	S	*	*			trans	-104.1	166.8	-174.1	-67.5	169	164.5	164.8	-7.5	112.9
71	G	32.1	Very low	34	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	80%	0.802	S	S	*	*			trans	-75.4	-168.2	164.3	0	0	0	0	0	113.4
72	P	47.4	Very low	34.1	Very low	119 Å²	119	140.6 Å²	140.6	77%	0.773	79%	0.788	S	S	*	*				-155.6	173.9	61.3	43.7	-23.9	0	0	0	119.6
73	L	31.1	Very low	34.4	Very low	156 Å²	156	142.8 Å²	142.8	82%	0.817	79%	0.789	S	S	*	*			trans	62.7	143.3	141.8	-76.6	167.3	0	0	0	125.7
74	L	31.7	Very low	34.7	Very low	143 Å²	143	139.5 Å²	139.5	75%	0.749	79%	0.785	S	S	*	*			trans	85.4	106.7	145.3	-78.3	163.6	0	0	0	124.3
75	S	29.4	Very low	34.9	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	78%	0.781	S	S	*	*			trans	69.5	159.7	137.8	75.6	0	0	0	0	119.3
76	T	31.6	Very low	35.3	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	77%	0.773	S	S	*	*			cis	-160.5	155.2	21.5	10.3	0	0	0	0	112.9
77	V	35.2	Very low	35.5	Very low	121 Å²	121	134.8 Å²	134.8	73%	0.733	77%	0.77	S	S	*	*			trans	70.8	107.2	137.8	172.8	0	0	0	0	122.9
78	S	32.4	Very low	35.6	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	77%	0.767	S	S	*	*				69.8	166.8	129.1	-54.2	0	0	0	0	121.8
79	Q	37.7	Very low	35.3	Very low	165 Å²	165	129.1 Å²	129.1	77%	0.771	76%	0.755	S	S	*	*			cis	-159.3	136	15.1	-150.5	174.8	31.4	0	0	114.8
80	T	34.8	Very low	35.6	Very low	116 Å²	116	129 Å²	129	71%	0.712	76%	0.755	S	S	*	*			trans	47.2	161.7	149	58.4	0	0	0	0	122.2
81	Q	35.8	Very low	35.5	Very low	184 Å²	184	126 Å²	126	86%	0.86	75%	0.748	S	S	*	*			cis	-136.9	166.1	16.8	-61.2	170.5	-5.2	0	0	110
82	G	32.8	Very low	35.6	Very low	53 Å²	53	131.9 Å²	131.9	55%	0.546	75%	0.754	S	S	.	*			cis	133.6	114.9	-0.7	0	0	0	0	0	112.4
83	H	39.6	Very low	34.9	Very low	179 Å²	179	132.4 Å²	132.4	83%	0.829	76%	0.756	S	S	*	*			cis	-127.8	-85.7	-2.9	-64.6	-91.5	0	0	0	114.1
84	T	35.8	Very low	34.8	Very low	128 Å²	128	128.2 Å²	128.2	79%	0.785	75%	0.75	S	S	*	*			cis	-169.6	141.9	-5.5	-4.2	0	0	0	0	107.3
85	A	36.9	Very low	36	Very low	87 Å²	87	127.3 Å²	127.3	72%	0.719	75%	0.753	S	S	*	*			cis	-169.4	163.2	-27.4	0	0	0	0	0	111.1
86	A	37.1	Very low	36.2	Very low	88 Å²	88	134.5 Å²	134.5	73%	0.727	76%	0.764	S	S	*	*			trans	74.6	136.1	159.8	0	0	0	0	0	120.2
87	Q	38.9	Very low	36.1	Very low	156 Å²	156	132.2 Å²	132.2	73%	0.729	77%	0.765	S	S	*	*			cis	-160.4	-169.5	-0.7	-117.6	171.5	57.4	0	0	109.1
88	K	34.1	Very low	35.9	Very low	179 Å²	179	132.7 Å²	132.7	78%	0.778	77%	0.772	S	S	*	*			cis	-149.4	-55.8	15.8	-152.5	174.9	-168.2	78.1	0	117
89	G	28.8	Very low	35.9	Very low	65 Å²	65	133.1 Å²	133.1	67%	0.67	78%	0.775	S	S	*	*			trans	85.1	-164.8	-172.4	0	0	0	0	0	114.9
90	P	49.8	Very low	35.8	Very low	124 Å²	124	129.7 Å²	129.7	81%	0.805	77%	0.774	S	S	*	*			cis	-101.9	-157.9	-2.1	28.4	-8.3	0	0	0	112
91	K	32.9	Very low	35.8	Very low	186 Å²	186	131.4 Å²	131.4	81%	0.809	78%	0.784	S	S	*	*			cis	-142.1	178.9	17.7	-56.5	174.2	179.9	175.6	0	109.4
92	K	33.6	Very low	35.6	Very low	193 Å²	193	125.5 Å²	125.5	84%	0.839	77%	0.773	S	S	*	*			cis	75.4	130	22.5	-82.9	-170	178.7	-175.2	0	116
93	T	32.3	Very low	35.8	Very low	130 Å²	130	129.7 Å²	129.7	80%	0.798	79%	0.788	S	S	*	*			cis	-151	168.5	2.4	38.6	0	0	0	0	112.4
94	G	29.3	Very low	35.7	Very low	67 Å²	67	126.9 Å²	126.9	69%	0.691	78%	0.783	S	S	*	*			trans	-89.9	-155.7	162.4	0	0	0	0	0	113.3
95	P	56.6	Low	35.8	Very low	125 Å²	125	128 Å²	128	81%	0.812	78%	0.784	S	S	*	*			cis	-139.4	-167.2	5.6	44.5	-25	0	0	0	116.5
96	R	34.2	Very low	35.6	Very low	252 Å²	252	134.4 Å²	134.4	95%	0.951	79%	0.789	S	S	*	*			trans	5.6	137.4	162.7	-68.7	-178.6	171.1	-174	-3.1	122
97	G	28.6	Very low	35.4	Very low	73 Å²	73	134.1 Å²	134.1	75%	0.753	78%	0.782	S	S	*	*			trans	145.7	102.2	134.3	0	0	0	0	0	121.3
98	C	31.9	Very low	35.1	Very low	131 Å²	131	135.8 Å²	135.8	89%	0.885	79%	0.79	S	S	*	*			trans	33.5	143.3	147.1	-62.9	0	0	0	0	126.5
99	S	32.9	Very low	35.1	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	79%	0.792	S	S	*	*			trans	93.9	95.8	140.1	-63.6	0	0	0	0	124.4
100	A	34.8	Very low	35.8	Very low	93 Å²	93	139.1 Å²	139.1	77%	0.769	80%	0.798	S	S	*	*				85.3	149.1	109.7	0	0	0	0	0	125.4
101	V	34.7	Very low	35.1	Very low	152 Å²	152	137.7 Å²	137.7	92%	0.921	80%	0.798	S	S	*	*			trans	80.2	126.2	158.2	-164.5	0	0	0	0	121.5
102	G	32.7	Very low	36	Very low	60 Å²	60	135.1 Å²	135.1	62%	0.619	80%	0.8	S	S	*	*			trans	135.1	95.1	138.3	0	0	0	0	0	122.1
103	T	37	Very low	35.7	Very low	141 Å²	141	131.1 Å²	131.1	87%	0.865	80%	0.802	S	S	*	*				37.1	153.1	123.5	47.2	0	0	0	0	122.8
104	V	36.5	Very low	35.8	Very low	120 Å²	120	129.4 Å²	129.4	73%	0.727	80%	0.802	S	S	*	*			cis	-169.4	160.2	19.6	93.1	0	0	0	0	115.9
105	L	37.8	Very low	36.4	Very low	153 Å²	153	132.9 Å²	132.9	80%	0.801	81%	0.812	S	S	*	*			trans	64.6	163.8	159.6	-71.1	171.8	0	0	0	120.6
106	R	32.9	Very low	35.2	Very low	220 Å²	220	131.6 Å²	131.6	83%	0.83	81%	0.812	S	S	*	*			cis	-157	127.7	21.3	-146.3	-166.5	-176.1	167.7	0.6	116.6
107	S	32.8	Very low	35	Very low	82 Å²	82	128.9 Å²	128.9	57%	0.573	81%	0.81	S	S	*	*			trans	32.8	139.2	142.2	69.6	0	0	0	0	126.8
108	Q	32	Very low	35.3	Very low	191 Å²	191	135 Å²	135	89%	0.893	82%	0.816	S	S	*	*				173.9	174.4	105	-91.7	-167.6	50.1	0	0	115.7
109	K	35.6	Very low	36.1	Very low	190 Å²	190	135.3 Å²	135.3	83%	0.826	82%	0.816	S	S	*	*			trans	-156.9	154.2	-173.6	-155.8	-166.5	-176.2	-178.3	0	110.1
110	P	43.8	Very low	36.2	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	81%	0.813	S	S	*	*				-157.8	176.6	100.4	40.5	-20.9	0	0	0	116.3
111	A	34.5	Very low	36.4	Very low	95 Å²	95	135.8 Å²	135.8	79%	0.785	82%	0.819	S	S	*	*			trans	-173.5	133.2	164.7	0	0	0	0	0	114.4
112	P	50.8	Low	36.5	Very low	132 Å²	132	133.8 Å²	133.8	86%	0.857	81%	0.812	S	S	*	*			trans	-152.4	169.5	144.2	40.8	-24.9	0	0	0	116.7
113	A	28.8	Very low	36.7	Very low	108 Å²	108	137.3 Å²	137.3	89%	0.893	82%	0.822	S	S	*	*			trans	143.3	155.3	139	0	0	0	0	0	117.4
114	A	33.5	Very low	36.7	Very low	95 Å²	95	134.8 Å²	134.8	79%	0.785	82%	0.815	S	S	*	*			trans	-157.1	164.3	176.5	0	0	0	0	0	112
115	P	42.7	Very low	37.7	Very low	140 Å²	140	134.8 Å²	134.8	91%	0.909	82%	0.818	S	S	*	*			trans	-151.1	-167.1	136.8	37.2	-17.2	0	0	0	116.2
116	A	30.6	Very low	37.9	Very low	97 Å²	97	134 Å²	134	80%	0.802	82%	0.819	S	S	*	*			trans	-153	-178.5	-171.4	0	0	0	0	0	116
117	Q	29.6	Very low	38.7	Very low	196 Å²	196	130.4 Å²	130.4	92%	0.916	82%	0.821	S	S	*	*			trans	126.9	176.4	158.6	-63.7	-178.5	4.8	0	0	120.4
118	K	34.9	Very low	39.3	Very low	201 Å²	201	133.4 Å²	133.4	87%	0.874	84%	0.836	S	S	*	*			trans	-160.8	-168.8	-169.3	-48.7	-177.3	-175.6	179.3	0	112
119	P	49.8	Very low	40.1	Very low	137 Å²	137	127.2 Å²	127.2	89%	0.89	82%	0.823	S	S	*	*			cis	-139.3	-151	-12.6	45	-22.8	0	0	0	116.3
120	G	34.8	Very low	40.5	Very low	72 Å²	72	128.7 Å²	128.7	74%	0.742	83%	0.829	S	S	*	*			trans	-176.3	165.7	172.6	0	0	0	0	0	119
121	T	38.4	Very low	40.5	Very low	145 Å²	145	132.9 Å²	132.9	89%	0.89	83%	0.829	S	S	*	*			trans	-160.8	-175.1	-170.4	58	0	0	0	0	118.7
122	S	37.6	Very low	41.7	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	84%	0.835	S	S	*	*			trans	104.1	163.3	163.9	82	0	0	0	0	119.7
123	T	36	Very low	41.9	Very low	134 Å²	134	130.9 Å²	130.9	82%	0.822	83%	0.831	S	S	*	*			cis	-156.6	178.7	2.7	-37.8	0	0	0	0	114
124	A	37.5	Very low	42.9	Very low	88 Å²	88	133.9 Å²	133.9	73%	0.727	82%	0.824	S	S	*	*			trans	-155.3	-165.1	174.1	0	0	0	0	0	112.4
125	P	57.3	Low	43.3	Very low	120 Å²	120	141 Å²	141	78%	0.779	83%	0.831	S	S	*	*			cis	-140.8	-149	-6.8	45.7	-23.3	0	0	0	116.2
126	V	41.9	Very low	43.6	Very low	137 Å²	137	139.9 Å²	139.9	83%	0.83	82%	0.823	S	S	*	*			trans	137.1	140	151.6	169.1	0	0	0	0	119.4
127	V	49.4	Very low	44.7	Very low	143 Å²	143	138.9 Å²	138.9	87%	0.867	82%	0.815	S	S	*	*			trans	-160.6	146.2	174.5	-161.2	0	0	0	0	116.9
128	V	44.8	Very low	45.8	Very low	146 Å²	146	140.8 Å²	140.8	89%	0.885	81%	0.814	S	S	*	*			trans	174.9	163.3	159.9	130.2	0	0	0	0	114.1
129	G	50.5	Low	47	Very low	60 Å²	60	135.1 Å²	135.1	62%	0.619	79%	0.793	S	S	*	*			cis	137.1	113.1	-20.4	0	0	0	0	0	120.1
130	K	43.4	Very low	47.2	Very low	222 Å²	222	134.9 Å²	134.9	97%	0.965	78%	0.783	S	S	*	*			trans	-165.8	-175.7	166.8	-113	154.8	-166.7	179.1	0	123.6
131	R	43.4	Very low	48.2	Very low	212 Å²	212	139.6 Å²	139.6	80%	0.8	78%	0.784	S	S	*	*			trans	-147.3	-164.9	-146.1	-121.6	-176.9	-169.4	-168.7	5.4	120.1
132	A	60.7	Low	49.1	Very low	109 Å²	109	133.8 Å²	133.8	90%	0.901	75%	0.753	S	S	*	*			trans	-127.7	-164.8	-160.8	0	0	0	0	0	120
133	G	53.3	Low	50	Low	76 Å²	76	133.5 Å²	133.5	78%	0.784	74%	0.739	S	S	*	*			trans	-152.1	178.2	-173.2	0	0	0	0	0	119.4
134	K	50.7	Low	51	Low	170 Å²	170	133.6 Å²	133.6	74%	0.739	73%	0.734	S	S	*	*			trans	-139.4	-172.4	-153.1	-91.2	-172.4	176.2	-175.3	0	121.5	D146	K134-D146 IonicContact NZ-OD1 2.76Å; K134-D146 PolarHBondContact NZ-OD1 2.88Å; K134-D146 IonicContact NZ-OD2 3.49Å; K134-D146 PolarHBondContact NZ-OD2 3.02Å
135	R	41	Very low	52.1	Low	246 Å²	246	133.3 Å²	133.3	93%	0.928	73%	0.726	S	S	*	*			trans	-132.6	174.6	-165.2	-89.2	-172.2	-175.6	-164.6	2.6	115.1
136	P	50.2	Low	52.2	Low	115 Å²	115	130.7 Å²	130.7	75%	0.747	71%	0.705	S	S	*	*			trans	-95.4	-172.1	-163.3	39	-37.9	0	0	0	117.6
137	A	53	Low	53	Low	76 Å²	76	129.7 Å²	129.7	63%	0.628	69%	0.694	S	S	*	*	S	Bend	trans	-118.4	15.5	-131.7	0	0	0	0	0	120.1
138	W	54.1	Low	53.6	Low	237 Å²	237	128.2 Å²	128.2	90%	0.898	68%	0.681	S	S	*	*	S	Bend	trans	-91.5	-4	174	57.8	-96.5	0	0	0	114.4	L140	W138-L140 PolarHBondContact O-N 3.27Å
139	D	59.1	Low	54.4	Low	82 Å²	82	125.7 Å²	125.7	44%	0.439	66%	0.66	S	S	.	*			trans	-87	87.3	174.5	-177.6	10.1	0	0	0	111.8	K141 G142 Q143	D139-K141 PolarHBondContact O-N 3.05Å; D139-K141 WeakPolarHBondContact OD1-CA 3.24Å; D139-K141 VanDerWaalsContact OD1-CB 3.25Å; D139-K141 WeakPolarHBondContact OD1-CB 3.47Å; D139-K141 PolarHBondContact OD1-N 3.24Å; D139-G142 PolarHBondContact O-N 3.49Å; D139-G142 PolarHBondContact OD1-N 3.15Å; D139-G142 WeakPolarHBondContact OD2-CA 3.25Å; D139-G142 PolarHBondContact OD2-N 3.3Å; D139-Q143 PolarHBondContact O-N 3.41Å
140	L	54	Low	54.9	Low	131 Å²	131	127.4 Å²	127.4	69%	0.686	65%	0.652	S	S	*	*	H	α-helix	trans	-64.5	-15.8	172.6	-76.2	164.6	0	0	0	113.5	W138	W138-L140 PolarHBondContact O-N 3.27Å
141	K	56.5	Low	55.7	Low	172 Å²	172	120.9 Å²	120.9	75%	0.748	63%	0.627	S	S	*	*	H	α-helix	trans	-82.9	-38.2	176.5	-162.7	174	-177.4	177.1	0	110.8	D139 L144 C145	D139-K141 PolarHBondContact O-N 3.05Å; D139-K141 WeakPolarHBondContact OD1-CA 3.24Å; D139-K141 VanDerWaalsContact OD1-CB 3.25Å; D139-K141 WeakPolarHBondContact OD1-CB 3.47Å; D139-K141 PolarHBondContact OD1-N 3.24Å; K141-L144 PolarHBondContact O-N 3.19Å; K141-C145 PolarHBondContact O-N 3.46Å
142	G	56.7	Low	56.5	Low	23 Å²	23	117.1 Å²	117.1	24%	0.237	62%	0.617	C	S	.	*	H	α-helix	trans	-60.6	-42.5	173.2	0	0	0	0	0	113.5	D139 L144 C145 D146	D139-G142 PolarHBondContact O-N 3.49Å; D139-G142 PolarHBondContact OD1-N 3.15Å; D139-G142 WeakPolarHBondContact OD2-CA 3.25Å; D139-G142 PolarHBondContact OD2-N 3.3Å; G142-L144 VanDerWaalsContact C-N 3.3Å; G142-L144 PolarHBondContact O-N 3.27Å; G142-C145 PolarHBondContact O-N 3.47Å; G142-D146 PolarHBondContact O-N 3.45Å; G142-D146 VanDerWaalsContact O-N 3.15Å
143	Q	56.1	Low	56.6	Low	104 Å²	104	117.2 Å²	117.2	49%	0.486	59%	0.594	S	S	.	*	H	α-helix	trans	-60.8	-34.4	-179.8	-69.3	-177.4	-2.4	0	0	113.5	D139	D139-Q143 PolarHBondContact O-N 3.41Å
144	L	57.1	Low	57.1	Low	137 Å²	137	121.4 Å²	121.4	72%	0.717	59%	0.587	S	S	*	*	H	α-helix	trans	-74.4	-34.7	176.8	-90.9	164.5	0	0	0	113.1	K141 G142 N148	K141-L144 PolarHBondContact O-N 3.19Å; G142-L144 VanDerWaalsContact C-N 3.3Å; G142-L144 PolarHBondContact O-N 3.27Å; L144-N148 PolarHBondContact O-N 3.12Å
145	C	60	Low	57.9	Low	82 Å²	82	121.2 Å²	121.2	55%	0.554	58%	0.582	S	S	*	*	H	α-helix	trans	-66.1	-44.2	176.2	-69.5	0	0	0	0	111.9	K141 G142 L147 N148 E149	K141-C145 PolarHBondContact O-N 3.46Å; G142-C145 PolarHBondContact O-N 3.47Å; C145-L147 PolarHBondContact O-N 3.25Å; C145-N148 PolarHBondContact O-N 2.92Å; C145-E149 PolarHBondContact O-N 3.2Å
146	D	60.3	Low	59	Low	64 Å²	64	114.1 Å²	114.1	34%	0.342	56%	0.559	S	S	.	*	H	α-helix	trans	-56.5	-46.5	180	-94.3	-31.9	0	0	0	113	K134 G142 N148 E149 E150	K134-D146 IonicContact NZ-OD1 2.76Å; K134-D146 PolarHBondContact NZ-OD1 2.88Å; K134-D146 IonicContact NZ-OD2 3.49Å; K134-D146 PolarHBondContact NZ-OD2 3.02Å; G142-D146 PolarHBondContact O-N 3.45Å; G142-D146 VanDerWaalsContact O-N 3.15Å; D146-N148 VanDerWaalsContact C-N 3.32Å; D146-N148 PolarHBondContact O-N 2.92Å; D146-E149 PolarHBondContact O-N 3.46Å; D146-E150 PolarHBondContact O-N 2.67Å
147	L	59.4	Low	59.7	Low	117 Å²	117	115.3 Å²	115.3	61%	0.613	55%	0.553	S	S	*	*	H	α-helix	trans	-69.8	-32.3	-175.6	-137	160.2	0	0	0	111.6	C145 E150 L151	C145-L147 PolarHBondContact O-N 3.25Å; L147-E150 PolarHBondContact O-N 3.19Å; L147-L151 PolarHBondContact O-N 3.29Å
148	N	62.3	Low	60.2	Low	111 Å²	111	115.4 Å²	115.4	59%	0.594	55%	0.545	S	S	*	.	H	α-helix	trans	-69.8	-33.7	174.2	-169.7	44.5	0	0	0	112.4	L144 C145 D146 K152	L144-N148 PolarHBondContact O-N 3.12Å; C145-N148 PolarHBondContact O-N 2.92Å; D146-N148 VanDerWaalsContact C-N 3.32Å; D146-N148 PolarHBondContact O-N 2.92Å; N148-K152 PolarHBondContact O-N 3.03Å
149	E	60.9	Low	60.8	Low	93 Å²	93	110.3 Å²	110.3	44%	0.435	53%	0.531	S	S	.	.	H	α-helix	trans	-67.1	-39.8	173.4	-69.7	-158.7	151.7	0	0	112.9	C145 D146 K152 R153	C145-E149 PolarHBondContact O-N 3.2Å; D146-E149 PolarHBondContact O-N 3.46Å; E149-K152 PolarHBondContact O-N 3.49Å; E149-R153 WeakPolarHBondContact O-CG 3.38Å; E149-R153 PolarHBondContact O-N 3.3Å; E149-R153 IonicContact OE1-NH2 3.17Å; E149-R153 IonicContact OE2-CZ 2.68Å; E149-R153 IonicContact OE2-NH1 2.67Å; E149-R153 PolarHBondContact OE2-NH1 3.19Å; E149-R153 IonicContact OE2-NH2 2.64Å; E149-R153 PolarHBondContact OE2-NH2 3.32Å
150	E	60.4	Low	61.3	Low	96 Å²	96	110.1 Å²	110.1	45%	0.449	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-42.4	178.2	-64.4	-148.2	129.2	0	0	111.8	D146 L147 K152 R153 Y154	D146-E150 PolarHBondContact O-N 2.67Å; L147-E150 PolarHBondContact O-N 3.19Å; E150-K152 PolarHBondContact O-N 3.32Å; E150-R153 PolarHBondContact O-N 3.47Å; E150-Y154 VanDerWaalsContact O-CD2 3.24Å; E150-Y154 WeakPolarHBondContact O-CD2 3.45Å; E150-Y154 PolarHBondContact O-N 3.27Å
151	L	59.7	Low	61.7	Low	86 Å²	86	108.1 Å²	108.1	45%	0.45	52%	0.523	S	S	.	.	H	α-helix	trans	-58.7	-33.9	173.9	-107.9	168.9	0	0	0	113	L147 R155	L147-L151 PolarHBondContact O-N 3.29Å; L151-R155 WeakPolarHBondContact O-CG 3.34Å; L151-R155 PolarHBondContact O-N 3.15Å
152	K	61.7	Low	62.3	Low	133 Å²	133	105.8 Å²	105.8	58%	0.578	52%	0.515	S	S	*	.	H	α-helix	trans	-70.9	-48.1	175.8	-158.9	-177.8	178.7	-172	0	111.7	N148 E149 E150 Y154 R155 E156	N148-K152 PolarHBondContact O-N 3.03Å; E149-K152 PolarHBondContact O-N 3.49Å; E150-K152 PolarHBondContact O-N 3.32Å; K152-Y154 VanDerWaalsContact C-N 3.28Å; K152-Y154 PolarHBondContact O-N 3.12Å; K152-R155 PolarHBondContact O-N 3.47Å; K152-R155 VanDerWaalsContact O-N 3.15Å; K152-E156 VanDerWaalsContact CE-OE1 3.32Å; K152-E156 WeakPolarHBondContact CE-OE1 3.45Å; K152-E156 PolarHBondContact O-N 3.24Å
153	R	62.8	Low	63	Low	111 Å²	111	110.4 Å²	110.4	42%	0.419	53%	0.533	S	S	.	.	H	α-helix	trans	-58.9	-34.2	178.1	-71.7	168.2	178.5	128	10.6	113.4	E149 E150 K157	E149-R153 WeakPolarHBondContact O-CG 3.38Å; E149-R153 PolarHBondContact O-N 3.3Å; E149-R153 IonicContact OE1-NH2 3.17Å; E149-R153 IonicContact OE2-CZ 2.68Å; E149-R153 IonicContact OE2-NH1 2.67Å; E149-R153 PolarHBondContact OE2-NH1 3.19Å; E149-R153 IonicContact OE2-NH2 2.64Å; E149-R153 PolarHBondContact OE2-NH2 3.32Å; E150-R153 PolarHBondContact O-N 3.47Å; R153-K157 PolarHBondContact O-N 3.48Å
154	Y	64.1	Low	63.7	Low	164 Å²	164	111.5 Å²	111.5	64%	0.643	54%	0.539	S	S	*	.	H	α-helix	trans	-70.7	-42.2	175.5	-81.3	-66.9	0	0	0	112.6	E150 K152 E156 K157 T158	E150-Y154 VanDerWaalsContact O-CD2 3.24Å; E150-Y154 WeakPolarHBondContact O-CD2 3.45Å; E150-Y154 PolarHBondContact O-N 3.27Å; K152-Y154 VanDerWaalsContact C-N 3.28Å; K152-Y154 PolarHBondContact O-N 3.12Å; Y154-E156 PolarHBondContact O-N 3.2Å; Y154-K157 PolarHBondContact O-N 3.18Å; Y154-T158 PolarHBondContact O-N 3.29Å; Y154-T158 PolarHBondContact O-OG1 3.32Å
155	R	65.7	Low	64.1	Low	165 Å²	165	109.1 Å²	109.1	62%	0.623	53%	0.526	S	S	*	.	H	α-helix	trans	-61.8	-43.3	179.3	-73.3	171.5	174	154.3	-0.9	112.6	L151 K152 K157 T158 Q159	L151-R155 WeakPolarHBondContact O-CG 3.34Å; L151-R155 PolarHBondContact O-N 3.15Å; K152-R155 PolarHBondContact O-N 3.47Å; K152-R155 VanDerWaalsContact O-N 3.15Å; R155-K157 PolarHBondContact O-N 3.41Å; R155-T158 PolarHBondContact O-N 3.24Å; R155-Q159 PolarHBondContact O-N 3.21Å
156	E	65	Low	64.8	Low	98 Å²	98	113.4 Å²	113.4	46%	0.458	53%	0.531	S	S	.	.	H	α-helix	trans	-62.4	-30.4	177.9	-68.7	163.9	178.5	0	0	112.2	K152 Y154 T160	K152-E156 VanDerWaalsContact CE-OE1 3.32Å; K152-E156 WeakPolarHBondContact CE-OE1 3.45Å; K152-E156 PolarHBondContact O-N 3.24Å; Y154-E156 PolarHBondContact O-N 3.2Å; E156-T160 PolarHBondContact O-OG1 3.25Å
157	K	65.1	Low	65.4	Low	140 Å²	140	112 Å²	112	61%	0.609	53%	0.531	S	S	*	.	H	α-helix	trans	-80.3	-28.3	177.3	-164.1	175	-178.6	-174	0	113.9	R153 Y154 R155 T160	R153-K157 PolarHBondContact O-N 3.48Å; Y154-K157 PolarHBondContact O-N 3.18Å; R155-K157 PolarHBondContact O-N 3.41Å; K157-T160 WeakPolarHBondContact CA-OG1 3.45Å; K157-T160 PolarHBondContact O-OG1 3.32Å; K157-T160 VanDerWaalsContact O-OG1 3.12Å
158	T	62.4	Low	66	Low	78 Å²	78	111.8 Å²	111.8	48%	0.479	53%	0.53	S	S	.	.	H	α-helix	trans	-70.3	-47	175.1	-49.1	0	0	0	0	111	Y154 R155 T160 L161 E162	Y154-T158 PolarHBondContact O-N 3.29Å; Y154-T158 PolarHBondContact O-OG1 3.32Å; R155-T158 PolarHBondContact O-N 3.24Å; T158-T160 VanDerWaalsContact C-N 3.27Å; T158-T160 PolarHBondContact O-N 3.36Å; T158-L161 PolarHBondContact O-N 3.21Å; T158-E162 WeakPolarHBondContact O-CG 3.43Å; T158-E162 PolarHBondContact O-N 3.25Å; T158-E162 VanDerWaalsContact O-N 3.12Å
159	Q	66.9	Low	66.5	Low	129 Å²	129	115.2 Å²	115.2	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-60.6	-33.4	-178.7	-72.3	-172.5	-47.5	0	0	113.6	R155 L163	R155-Q159 PolarHBondContact O-N 3.21Å; Q159-L163 WeakPolarHBondContact O-CG 3.42Å; Q159-L163 PolarHBondContact O-N 3.16Å
160	T	70.6	Confident	67.1	Low	79 Å²	79	116.5 Å²	116.5	49%	0.485	54%	0.541	S	S	.	.	H	α-helix	trans	-69.7	-42.3	179.1	30	0	0	0	0	112.2	E156 K157 T158 L163 E164	E156-T160 PolarHBondContact O-OG1 3.25Å; K157-T160 WeakPolarHBondContact CA-OG1 3.45Å; K157-T160 PolarHBondContact O-OG1 3.32Å; K157-T160 VanDerWaalsContact O-OG1 3.12Å; T158-T160 VanDerWaalsContact C-N 3.27Å; T158-T160 PolarHBondContact O-N 3.36Å; T160-L163 PolarHBondContact O-N 2.94Å; T160-E164 PolarHBondContact O-N 3.24Å
161	L	63.1	Low	67.8	Low	88 Å²	88	117.5 Å²	117.5	46%	0.461	55%	0.546	S	S	.	.	H	α-helix	trans	-71.7	-27.9	176.9	-72.3	168.1	0	0	0	113.6	T158 N165	T158-L161 PolarHBondContact O-N 3.21Å; L161-N165 PolarHBondContact O-N 3.01Å; L161-N165 PolarHBondContact O-ND2 3.14Å
162	E	68.1	Low	68.3	Low	124 Å²	124	119 Å²	119	58%	0.579	55%	0.553	S	S	*	*	H	α-helix	trans	-68	-37.7	172.7	-73.6	176.4	158	0	0	112	T158 R166	T158-E162 WeakPolarHBondContact O-CG 3.43Å; T158-E162 PolarHBondContact O-N 3.25Å; T158-E162 VanDerWaalsContact O-N 3.12Å; E162-R166 PolarHBondContact O-N 3.42Å
163	L	72.1	Confident	69	Low	120 Å²	120	120.3 Å²	120.3	63%	0.628	56%	0.555	S	S	*	*	H	α-helix	trans	-66.9	-45.2	175.2	-77.2	164.5	0	0	0	112.2	Q159 T160 N165 R166 G167	Q159-L163 WeakPolarHBondContact O-CG 3.42Å; Q159-L163 PolarHBondContact O-N 3.16Å; T160-L163 PolarHBondContact O-N 2.94Å; L163-N165 PolarHBondContact O-N 3.45Å; L163-R166 WeakPolarHBondContact O-CB 3.48Å; L163-R166 PolarHBondContact O-N 3.32Å; L163-G167 PolarHBondContact O-N 3.42Å
164	E	70	Confident	69.7	Low	127 Å²	127	120.6 Å²	120.6	59%	0.593	56%	0.56	S	S	*	*	H	α-helix	trans	-62.6	-41.8	177.9	-69.9	-179	154.6	0	0	112.4	T160 R166 G167 L168	T160-E164 PolarHBondContact O-N 3.24Å; E164-R166 PolarHBondContact O-N 3.17Å; E164-G167 PolarHBondContact O-N 3.25Å; E164-L168 PolarHBondContact O-N 3.49Å
165	N	66.6	Low	70.3	Confident	86 Å²	86	117.1 Å²	117.1	46%	0.46	56%	0.556	S	S	.	*	H	α-helix	trans	-65.8	-25.3	176.1	-91.4	-89.7	0	0	0	113.5	L161 L163 R169	L161-N165 PolarHBondContact O-N 3.01Å; L161-N165 PolarHBondContact O-ND2 3.14Å; L163-N165 PolarHBondContact O-N 3.45Å; N165-R169 WeakPolarHBondContact O-CG 3.5Å
166	R	73.4	Confident	70.6	Confident	173 Å²	173	115.3 Å²	115.3	65%	0.653	56%	0.555	S	S	*	*	H	α-helix	trans	-72.7	-50.9	175.8	-165.5	173.5	-175	162.7	2.9	110.7	E162 L163 E164 L168 R169 E170	E162-R166 PolarHBondContact O-N 3.42Å; L163-R166 WeakPolarHBondContact O-CB 3.48Å; L163-R166 PolarHBondContact O-N 3.32Å; E164-R166 PolarHBondContact O-N 3.17Å; R166-L168 PolarHBondContact O-N 3.36Å; R166-R169 PolarHBondContact O-N 3.29Å; R166-R169 VanDerWaalsContact O-N 3.16Å; R166-E170 PolarHBondContact O-N 3.23Å; R166-E170 VanDerWaalsContact O-N 3.17Å
167	G	74.1	Confident	71.2	Confident	33 Å²	33	115.1 Å²	115.1	34%	0.34	55%	0.554	S	S	.	*	H	α-helix	trans	-59.7	-42	-178.3	0	0	0	0	0	114.1	L163 E164 R169 E170 Q171	L163-G167 PolarHBondContact O-N 3.42Å; E164-G167 PolarHBondContact O-N 3.25Å; G167-R169 VanDerWaalsContact C-N 3.29Å; G167-R169 PolarHBondContact O-N 3.38Å; G167-E170 WeakPolarHBondContact O-CB 3.32Å; G167-E170 PolarHBondContact O-N 3.11Å; G167-Q171 PolarHBondContact O-N 3.24Å; G167-Q171 VanDerWaalsContact O-N 3.11Å
168	L	70.4	Confident	71.8	Confident	114 Å²	114	113.5 Å²	113.5	60%	0.597	55%	0.549	S	S	*	.	H	α-helix	trans	-65.6	-29.7	178.5	-72.4	172	0	0	0	113.4	E164 R166 L172	E164-L168 PolarHBondContact O-N 3.49Å; R166-L168 PolarHBondContact O-N 3.36Å; L168-L172 PolarHBondContact O-N 3.38Å
169	R	73.8	Confident	72.4	Confident	183 Å²	183	112.9 Å²	112.9	69%	0.691	55%	0.551	S	S	*	*	H	α-helix	trans	-75.9	-34.4	175.3	-72.5	175.7	176.7	165	1.5	112.2	N165 R166 G167 R173	N165-R169 WeakPolarHBondContact O-CG 3.5Å; R166-R169 PolarHBondContact O-N 3.29Å; R166-R169 VanDerWaalsContact O-N 3.16Å; G167-R169 VanDerWaalsContact C-N 3.29Å; G167-R169 PolarHBondContact O-N 3.38Å; R169-R173 PolarHBondContact O-N 2.74Å
170	E	74.2	Confident	72.9	Confident	120 Å²	120	111 Å²	111	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-60.8	-51.4	173.5	-130.1	108.5	-129.7	0	0	110.2	R166 G167 L172 R173 E174	R166-E170 PolarHBondContact O-N 3.23Å; R166-E170 VanDerWaalsContact O-N 3.17Å; G167-E170 WeakPolarHBondContact O-CB 3.32Å; G167-E170 PolarHBondContact O-N 3.11Å; E170-L172 PolarHBondContact O-N 3.39Å; E170-R173 WeakPolarHBondContact O-CB 3.41Å; E170-R173 PolarHBondContact O-N 2.94Å; E170-E174 PolarHBondContact O-N 3.17Å; E170-E174 VanDerWaalsContact O-N 3.1Å
171	Q	74.9	Confident	73.4	Confident	117 Å²	117	110.3 Å²	110.3	55%	0.547	55%	0.545	S	S	.	.	H	α-helix	trans	-60.1	-42.6	178.6	-70.9	177.7	-12.2	0	0	113.3	G167 R173 E174 V175	G167-Q171 PolarHBondContact O-N 3.24Å; G167-Q171 VanDerWaalsContact O-N 3.11Å; Q171-R173 VanDerWaalsContact C-N 3.29Å; Q171-R173 PolarHBondContact O-N 3.44Å; Q171-E174 PolarHBondContact O-N 3.1Å; Q171-V175 PolarHBondContact O-N 3.18Å; Q171-V175 VanDerWaalsContact O-N 3.14Å
172	L	69.4	Low	74.1	Confident	117 Å²	117	111.4 Å²	111.4	61%	0.613	55%	0.55	S	S	*	*	H	α-helix	trans	-64.6	-35.9	178.6	-173.9	65.2	0	0	0	111.8	L168 E170 Q176	L168-L172 PolarHBondContact O-N 3.38Å; E170-L172 PolarHBondContact O-N 3.39Å; L172-Q176 WeakPolarHBondContact O-CB 3.39Å; L172-Q176 PolarHBondContact O-N 3.22Å
173	R	76.5	Confident	74.6	Confident	161 Å²	161	107 Å²	107	61%	0.608	54%	0.538	S	S	*	.	H	α-helix	trans	-64.8	-46.2	175.8	-157.2	-157.9	89.2	179.3	10.9	111	R169 E170 Q171 V175 Q176 E177	R169-R173 PolarHBondContact O-N 2.74Å; E170-R173 WeakPolarHBondContact O-CB 3.41Å; E170-R173 PolarHBondContact O-N 2.94Å; Q171-R173 VanDerWaalsContact C-N 3.29Å; Q171-R173 PolarHBondContact O-N 3.44Å; R173-V175 PolarHBondContact O-N 3.1Å; R173-Q176 WeakPolarHBondContact O-CB 3.42Å; R173-Q176 PolarHBondContact O-N 2.72Å; R173-Q176 VanDerWaalsContact O-N 3.17Å; R173-E177 IonicContact CZ-OE2 3.39Å; R173-E177 VanDerWaalsContact CZ-OE2 3.29Å; R173-E177 IonicContact NE-OE2 3.58Å; R173-E177 PolarHBondContact NE-OE2 2.74Å; R173-E177 IonicContact NH2-OE1 3.95Å; R173-E177 PolarHBondContact NH2-OE1 3.39Å; R173-E177 IonicContact NH2-OE2 3.75Å; R173-E177 PolarHBondContact NH2-OE2 3.12Å; R173-E177 WeakPolarHBondContact O-CB 3.48Å; R173-E177 PolarHBondContact O-N 3.36Å
174	E	77.6	Confident	75.1	Confident	116 Å²	116	105.5 Å²	105.5	54%	0.542	53%	0.534	S	S	.	.	H	α-helix	trans	-60.5	-42.4	-178.4	-169.3	170.7	-136	0	0	112.4	E170 Q171 E177 Q178	E170-E174 PolarHBondContact O-N 3.17Å; E170-E174 VanDerWaalsContact O-N 3.1Å; Q171-E174 PolarHBondContact O-N 3.1Å; E174-E177 PolarHBondContact O-N 2.7Å; E174-Q178 WeakPolarHBondContact O-CG 3.42Å; E174-Q178 PolarHBondContact O-N 2.88Å
175	V	75.8	Confident	75.6	Confident	91 Å²	91	104.2 Å²	104.2	55%	0.552	53%	0.528	S	S	*	.	H	α-helix	trans	-67.2	-38.6	174.6	174.7	0	0	0	0	112.1	Q171 R173 E177 A179	Q171-V175 PolarHBondContact O-N 3.18Å; Q171-V175 VanDerWaalsContact O-N 3.14Å; R173-V175 PolarHBondContact O-N 3.1Å; V175-E177 VanDerWaalsContact C-N 3.32Å; V175-E177 PolarHBondContact O-N 3.18Å; V175-A179 WeakPolarHBondContact O-CB 3.5Å; V175-A179 PolarHBondContact O-N 3.17Å
176	Q	72.8	Confident	76.3	Confident	128 Å²	128	107.8 Å²	107.8	60%	0.598	54%	0.535	S	S	*	.	H	α-helix	trans	-63.9	-40	176.5	-160.1	81.3	21.2	0	0	111.3	L172 R173 A179 T180	L172-Q176 WeakPolarHBondContact O-CB 3.39Å; L172-Q176 PolarHBondContact O-N 3.22Å; R173-Q176 WeakPolarHBondContact O-CB 3.42Å; R173-Q176 PolarHBondContact O-N 2.72Å; R173-Q176 VanDerWaalsContact O-N 3.17Å; Q176-A179 PolarHBondContact O-N 3Å; Q176-T180 PolarHBondContact O-N 3.44Å
177	E	76.7	Confident	76.7	Confident	94 Å²	94	104.6 Å²	104.6	44%	0.439	53%	0.531	S	S	.	.	H	α-helix	trans	-65.4	-47.6	178.9	-153.2	154.6	-169.9	0	0	110.5	R173 E174 V175 A179 T180 T181	R173-E177 IonicContact CZ-OE2 3.39Å; R173-E177 VanDerWaalsContact CZ-OE2 3.29Å; R173-E177 IonicContact NE-OE2 3.58Å; R173-E177 PolarHBondContact NE-OE2 2.74Å; R173-E177 IonicContact NH2-OE1 3.95Å; R173-E177 PolarHBondContact NH2-OE1 3.39Å; R173-E177 IonicContact NH2-OE2 3.75Å; R173-E177 PolarHBondContact NH2-OE2 3.12Å; R173-E177 WeakPolarHBondContact O-CB 3.48Å; R173-E177 PolarHBondContact O-N 3.36Å; E174-E177 PolarHBondContact O-N 2.7Å; V175-E177 VanDerWaalsContact C-N 3.32Å; V175-E177 PolarHBondContact O-N 3.18Å; E177-A179 VanDerWaalsContact C-N 3.34Å; E177-A179 PolarHBondContact O-N 3.3Å; E177-T180 PolarHBondContact O-N 3.13Å; E177-T180 VanDerWaalsContact O-N 3.1Å; E177-T180 PolarHBondContact O-OG1 3.43Å; E177-T181 PolarHBondContact O-N 3.04Å; E177-T181 VanDerWaalsContact O-N 3.11Å
178	Q	78.3	Confident	77.2	Confident	106 Å²	106	107 Å²	107	50%	0.495	54%	0.539	S	S	.	.	H	α-helix	trans	-59.8	-37.5	173.1	-71.1	172.3	16.2	0	0	113.4	E174 T180 T181 L182	E174-Q178 WeakPolarHBondContact O-CG 3.42Å; E174-Q178 PolarHBondContact O-N 2.88Å; Q178-T180 VanDerWaalsContact C-N 3.29Å; Q178-T180 PolarHBondContact O-N 3.3Å; Q178-T181 PolarHBondContact O-N 3.24Å; Q178-T181 PolarHBondContact O-OG1 3.03Å; Q178-T181 VanDerWaalsContact O-OG1 3.05Å; Q178-L182 WeakPolarHBondContact O-CG 3.44Å; Q178-L182 PolarHBondContact O-N 3.03Å
179	A	75.5	Confident	77.8	Confident	64 Å²	64	106.5 Å²	106.5	53%	0.529	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-32.8	176.1	0	0	0	0	0	112.2	V175 Q176 E177 G183	V175-A179 WeakPolarHBondContact O-CB 3.5Å; V175-A179 PolarHBondContact O-N 3.17Å; Q176-A179 PolarHBondContact O-N 3Å; E177-A179 VanDerWaalsContact C-N 3.34Å; E177-A179 PolarHBondContact O-N 3.3Å; A179-G183 PolarHBondContact O-N 2.96Å
180	T	77.8	Confident	78.2	Confident	91 Å²	91	102.5 Å²	102.5	56%	0.558	53%	0.526	S	S	*	.	H	α-helix	trans	-75.7	-38.5	176.3	57.1	0	0	0	0	113.2	Q176 E177 Q178 G183 T184	Q176-T180 PolarHBondContact O-N 3.44Å; E177-T180 PolarHBondContact O-N 3.13Å; E177-T180 VanDerWaalsContact O-N 3.1Å; E177-T180 PolarHBondContact O-OG1 3.43Å; Q178-T180 VanDerWaalsContact C-N 3.29Å; Q178-T180 PolarHBondContact O-N 3.3Å; T180-G183 PolarHBondContact O-N 3.27Å; T180-T184 PolarHBondContact O-N 3.19Å; T180-T184 PolarHBondContact O-OG1 3.48Å
181	T	79.8	Confident	78.7	Confident	64 Å²	64	98.9 Å²	98.9	39%	0.393	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-47.2	178.1	56.5	0	0	0	0	111.8	E177 Q178 G183 T184 E185	E177-T181 PolarHBondContact O-N 3.04Å; E177-T181 VanDerWaalsContact O-N 3.11Å; Q178-T181 PolarHBondContact O-N 3.24Å; Q178-T181 PolarHBondContact O-OG1 3.03Å; Q178-T181 VanDerWaalsContact O-OG1 3.05Å; T181-G183 PolarHBondContact O-N 3.26Å; T181-T184 WeakPolarHBondContact CA-OG1 3.4Å; T181-T184 PolarHBondContact O-N 2.73Å; T181-T184 PolarHBondContact O-OG1 2.88Å; T181-E185 WeakPolarHBondContact O-CG 3.42Å; T181-E185 PolarHBondContact O-N 3.05Å
182	L	77.9	Confident	79.3	Confident	110 Å²	110	98.8 Å²	98.8	58%	0.576	52%	0.52	S	S	*	.	H	α-helix	trans	-60.4	-32.9	174.8	-69.6	170.3	0	0	0	112.3	Q178 R186	Q178-L182 WeakPolarHBondContact O-CG 3.44Å; Q178-L182 PolarHBondContact O-N 3.03Å; L182-R186 WeakPolarHBondContact O-CB 3.32Å; L182-R186 PolarHBondContact O-N 3.11Å
183	G	79.6	Confident	80	Confident	32 Å²	32	97.5 Å²	97.5	33%	0.33	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-42.2	172.3	0	0	0	0	0	112.9	A179 T180 T181 N187	A179-G183 PolarHBondContact O-N 2.96Å; T180-G183 PolarHBondContact O-N 3.27Å; T181-G183 PolarHBondContact O-N 3.26Å; G183-N187 VanDerWaalsContact O-CG 3.28Å; G183-N187 PolarHBondContact O-N 3.34Å; G183-N187 PolarHBondContact O-ND2 3.42Å
184	T	81.4	Confident	80.4	Confident	88 Å²	88	92.6 Å²	92.6	54%	0.54	51%	0.508	S	S	.	.	H	α-helix	trans	-69.5	-42.7	174.9	46.6	0	0	0	0	112.8	T180 T181 R186 N187 T188	T180-T184 PolarHBondContact O-N 3.19Å; T180-T184 PolarHBondContact O-OG1 3.48Å; T181-T184 WeakPolarHBondContact CA-OG1 3.4Å; T181-T184 PolarHBondContact O-N 2.73Å; T181-T184 PolarHBondContact O-OG1 2.88Å; T184-R186 VanDerWaalsContact C-N 3.34Å; T184-R186 PolarHBondContact O-N 3.39Å; T184-N187 PolarHBondContact O-N 3.47Å; T184-N187 VanDerWaalsContact O-N 3.13Å; T184-T188 PolarHBondContact O-N 2.99Å; T184-T188 PolarHBondContact O-OG1 3.36Å
185	E	81.6	Confident	80.8	Confident	101 Å²	101	90 Å²	90	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-60.7	-41.5	177.9	-73.2	171.8	-169	0	0	112	T181 N187 T188 L189	T181-E185 WeakPolarHBondContact O-CG 3.42Å; T181-E185 PolarHBondContact O-N 3.05Å; E185-N187 PolarHBondContact O-N 2.96Å; E185-T188 WeakPolarHBondContact CA-OG1 3.45Å; E185-T188 PolarHBondContact O-N 3.41Å; E185-T188 PolarHBondContact O-OG1 3.48Å; E185-L189 WeakPolarHBondContact O-CB 3.38Å; E185-L189 VanDerWaalsContact O-CG 3.27Å; E185-L189 WeakPolarHBondContact O-CG 3.45Å; E185-L189 PolarHBondContact O-N 2.91Å
186	R	81.7	Confident	81.4	Confident	160 Å²	160	90 Å²	90	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-58.9	-47.1	173.1	178.7	-179	169.5	159.4	1.6	111.5	L182 T184 L189 E190	L182-R186 WeakPolarHBondContact O-CB 3.32Å; L182-R186 PolarHBondContact O-N 3.11Å; T184-R186 VanDerWaalsContact C-N 3.34Å; T184-R186 PolarHBondContact O-N 3.39Å; R186-L189 PolarHBondContact O-N 3.03Å; R186-E190 IonicContact CZ-OE1 2.8Å; R186-E190 IonicContact NE-OE1 3.48Å; R186-E190 PolarHBondContact NE-OE1 2.86Å; R186-E190 IonicContact NH2-OE1 3.21Å; R186-E190 PolarHBondContact NH2-OE1 3.19Å; R186-E190 WeakPolarHBondContact O-CG 3.27Å; R186-E190 PolarHBondContact O-N 3.03Å
187	N	81.8	Confident	82.1	Confident	106 Å²	106	91.6 Å²	91.6	57%	0.567	50%	0.502	S	S	*	.	H	α-helix	trans	-67.7	-35.8	-177	-68.8	-14.1	0	0	0	112.1	G183 T184 E185 G191	G183-N187 VanDerWaalsContact O-CG 3.28Å; G183-N187 PolarHBondContact O-N 3.34Å; G183-N187 PolarHBondContact O-ND2 3.42Å; T184-N187 PolarHBondContact O-N 3.47Å; T184-N187 VanDerWaalsContact O-N 3.13Å; E185-N187 PolarHBondContact O-N 2.96Å; N187-G191 PolarHBondContact O-N 3.05Å; N187-G191 VanDerWaalsContact O-N 3.12Å
188	T	84.1	Confident	82.6	Confident	83 Å²	83	89.6 Å²	89.6	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-44	172.2	47.4	0	0	0	0	111.4	T184 E185 E190 G191 E192	T184-T188 PolarHBondContact O-N 2.99Å; T184-T188 PolarHBondContact O-OG1 3.36Å; E185-T188 WeakPolarHBondContact CA-OG1 3.45Å; E185-T188 PolarHBondContact O-N 3.41Å; E185-T188 PolarHBondContact O-OG1 3.48Å; T188-E190 PolarHBondContact O-N 3.45Å; T188-G191 PolarHBondContact O-N 3.47Å; T188-E192 WeakPolarHBondContact O-CG 3.24Å; T188-E192 PolarHBondContact O-N 2.97Å
189	L	83.5	Confident	83.2	Confident	105 Å²	105	92.1 Å²	92.1	55%	0.55	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-38.4	177.2	-72.8	169.1	0	0	0	112.6	E185 R186 G191 E192 L193	E185-L189 WeakPolarHBondContact O-CB 3.38Å; E185-L189 VanDerWaalsContact O-CG 3.27Å; E185-L189 WeakPolarHBondContact O-CG 3.45Å; E185-L189 PolarHBondContact O-N 2.91Å; R186-L189 PolarHBondContact O-N 3.03Å; L189-G191 VanDerWaalsContact C-N 3.35Å; L189-E192 PolarHBondContact O-N 2.88Å; L189-L193 VanDerWaalsContact O-CB 3.24Å; L189-L193 WeakPolarHBondContact O-CB 3.37Å; L189-L193 PolarHBondContact O-N 3.04Å
190	E	81.8	Confident	83.7	Confident	99 Å²	99	91.9 Å²	91.9	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-38.5	173.7	-75.9	-176.1	-172	0	0	112	R186 T188 A194	R186-E190 IonicContact CZ-OE1 2.8Å; R186-E190 IonicContact NE-OE1 3.48Å; R186-E190 PolarHBondContact NE-OE1 2.86Å; R186-E190 IonicContact NH2-OE1 3.21Å; R186-E190 PolarHBondContact NH2-OE1 3.19Å; R186-E190 WeakPolarHBondContact O-CG 3.27Å; R186-E190 PolarHBondContact O-N 3.03Å; T188-E190 PolarHBondContact O-N 3.45Å; E190-A194 WeakPolarHBondContact O-CB 3.34Å; E190-A194 PolarHBondContact O-N 3.04Å
191	G	84.6	Confident	84.2	Confident	44 Å²	44	93.1 Å²	93.1	45%	0.454	50%	0.501	S	S	.	.	H	α-helix	trans	-65.5	-44.4	173.3	0	0	0	0	0	113.4	N187 T188 L189 A194 S195	N187-G191 PolarHBondContact O-N 3.05Å; N187-G191 VanDerWaalsContact O-N 3.12Å; T188-G191 PolarHBondContact O-N 3.47Å; L189-G191 VanDerWaalsContact C-N 3.35Å; G191-A194 PolarHBondContact O-N 3.23Å; G191-S195 PolarHBondContact O-N 3.31Å
192	E	86.2	Confident	84.7	Confident	114 Å²	114	94.2 Å²	94.2	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-60.3	-48.2	174.3	-75.3	178.1	-175.1	0	0	111.2	T188 L189 A194 S195 V196	T188-E192 WeakPolarHBondContact O-CG 3.24Å; T188-E192 PolarHBondContact O-N 2.97Å; L189-E192 PolarHBondContact O-N 2.88Å; E192-A194 VanDerWaalsContact C-N 3.32Å; E192-A194 PolarHBondContact O-N 3.43Å; E192-S195 WeakPolarHBondContact O-CA 3.4Å; E192-S195 WeakPolarHBondContact O-CB 3.38Å; E192-S195 PolarHBondContact O-N 3.36Å; E192-S195 PolarHBondContact O-OG 3.48Å; E192-V196 WeakPolarHBondContact O-CG2 3.26Å; E192-V196 PolarHBondContact O-N 3.02Å
193	L	84.3	Confident	85.1	Confident	91 Å²	91	92.4 Å²	92.4	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-36.1	-178.8	-151.6	164	0	0	0	111.4	L189 V196 R197	L189-L193 VanDerWaalsContact O-CB 3.24Å; L189-L193 WeakPolarHBondContact O-CB 3.37Å; L189-L193 PolarHBondContact O-N 3.04Å; L193-V196 PolarHBondContact O-N 3.02Å; L193-R197 HydrophobicContact CD2-CG 4.25Å; L193-R197 VanDerWaalsContact CD2-NE 3.26Å; L193-R197 WeakPolarHBondContact O-CG 3.44Å; L193-R197 PolarHBondContact O-N 3.49Å
194	A	86.1	Confident	85.6	Confident	58 Å²	58	95.9 Å²	95.9	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-42.7	169.4	0	0	0	0	0	112.4	E190 G191 E192 V196 R197 S198	E190-A194 WeakPolarHBondContact O-CB 3.34Å; E190-A194 PolarHBondContact O-N 3.04Å; G191-A194 PolarHBondContact O-N 3.23Å; E192-A194 VanDerWaalsContact C-N 3.32Å; E192-A194 PolarHBondContact O-N 3.43Å; A194-V196 VanDerWaalsContact C-N 3.35Å; A194-V196 PolarHBondContact O-N 2.88Å; A194-R197 PolarHBondContact O-N 3.12Å; A194-S198 PolarHBondContact O-N 2.89Å
195	S	86.4	Confident	86.1	Confident	61 Å²	61	97.6 Å²	97.6	43%	0.427	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-37.1	177.2	83.4	0	0	0	0	112.7	G191 E192 R199	G191-S195 PolarHBondContact O-N 3.31Å; E192-S195 WeakPolarHBondContact O-CA 3.4Å; E192-S195 WeakPolarHBondContact O-CB 3.38Å; E192-S195 PolarHBondContact O-N 3.36Å; E192-S195 PolarHBondContact O-OG 3.48Å; S195-R199 WeakPolarHBondContact O-CB 3.46Å; S195-R199 PolarHBondContact O-N 2.7Å
196	V	88.1	Confident	86.5	Confident	91 Å²	91	99.2 Å²	99.2	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-68.5	-40.7	176	170.6	0	0	0	0	111	E192 L193 A194 R199 A200	E192-V196 WeakPolarHBondContact O-CG2 3.26Å; E192-V196 PolarHBondContact O-N 3.02Å; L193-V196 PolarHBondContact O-N 3.02Å; A194-V196 VanDerWaalsContact C-N 3.35Å; A194-V196 PolarHBondContact O-N 2.88Å; V196-R199 PolarHBondContact O-N 2.76Å; V196-A200 WeakPolarHBondContact O-CB 3.39Å; V196-A200 PolarHBondContact O-N 3.36Å
197	R	87.8	Confident	86.9	Confident	161 Å²	161	97.2 Å²	97.2	61%	0.608	51%	0.505	S	S	*	.	H	α-helix	trans	-61.3	-49.6	173.8	-75.5	176.3	-176.6	-177.3	3.9	112	L193 A194 R199 A200 E201	L193-R197 HydrophobicContact CD2-CG 4.25Å; L193-R197 VanDerWaalsContact CD2-NE 3.26Å; L193-R197 WeakPolarHBondContact O-CG 3.44Å; L193-R197 PolarHBondContact O-N 3.49Å; A194-R197 PolarHBondContact O-N 3.12Å; R197-R199 VanDerWaalsContact C-N 3.26Å; R197-R199 PolarHBondContact O-N 2.99Å; R197-A200 PolarHBondContact O-N 2.94Å; R197-A200 VanDerWaalsContact O-N 3.12Å; R197-E201 WeakPolarHBondContact O-CG 3.49Å; R197-E201 PolarHBondContact O-N 2.73Å
198	S	87.2	Confident	87.3	Confident	52 Å²	52	97.3 Å²	97.3	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-62.3	-34.4	178.3	-171.5	0	0	0	0	112.4	A194 Q202	A194-S198 PolarHBondContact O-N 2.89Å; S198-Q202 VanDerWaalsContact O-CG 3.26Å; S198-Q202 WeakPolarHBondContact O-CG 3.4Å; S198-Q202 PolarHBondContact O-N 2.95Å; S198-Q202 PolarHBondContact OG-NE2 2.88Å
199	R	90.1	Very high	87.6	Confident	160 Å²	160	98 Å²	98	60%	0.604	51%	0.506	S	S	*	.	H	α-helix	trans	-66.4	-45.6	172.3	-171.2	173.5	-61	167.9	5.2	112	S195 V196 R197 E201 Q202 D203	S195-R199 WeakPolarHBondContact O-CB 3.46Å; S195-R199 PolarHBondContact O-N 2.7Å; V196-R199 PolarHBondContact O-N 2.76Å; R197-R199 VanDerWaalsContact C-N 3.26Å; R197-R199 PolarHBondContact O-N 2.99Å; R199-E201 VanDerWaalsContact C-N 3.32Å; R199-E201 PolarHBondContact O-N 3.38Å; R199-Q202 PolarHBondContact O-N 3.45Å; R199-D203 WeakPolarHBondContact CG-OD2 3.49Å; R199-D203 WeakPolarHBondContact O-CB 3.44Å; R199-D203 PolarHBondContact O-N 3.06Å
200	A	86.4	Confident	88	Confident	58 Å²	58	98.2 Å²	98.2	48%	0.479	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-38.3	176.6	0	0	0	0	0	112.4	V196 R197 D203 Q204	V196-A200 WeakPolarHBondContact O-CB 3.39Å; V196-A200 PolarHBondContact O-N 3.36Å; R197-A200 PolarHBondContact O-N 2.94Å; R197-A200 VanDerWaalsContact O-N 3.12Å; A200-D203 PolarHBondContact O-N 2.84Å; A200-Q204 VanDerWaalsContact O-CB 3.23Å; A200-Q204 WeakPolarHBondContact O-CB 3.23Å; A200-Q204 PolarHBondContact O-N 3.43Å
201	E	87.7	Confident	88.5	Confident	118 Å²	118	96.8 Å²	96.8	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-65.3	-41.8	173.9	-71.7	164.9	-174.6	0	0	112.1	R197 R199 Q205	R197-E201 WeakPolarHBondContact O-CG 3.49Å; R197-E201 PolarHBondContact O-N 2.73Å; R199-E201 VanDerWaalsContact C-N 3.32Å; R199-E201 PolarHBondContact O-N 3.38Å; E201-Q205 WeakPolarHBondContact O-CG 3.42Å; E201-Q205 PolarHBondContact O-N 3.42Å
202	Q	89.9	Confident	88.8	Confident	87 Å²	87	97.5 Å²	97.5	41%	0.407	51%	0.51	S	S	.	.	H	α-helix	trans	-65.1	-41.3	174	-72.5	170.8	35.1	0	0	112.1	S198 R199 Q205 R206	S198-Q202 VanDerWaalsContact O-CG 3.26Å; S198-Q202 WeakPolarHBondContact O-CG 3.4Å; S198-Q202 PolarHBondContact O-N 2.95Å; S198-Q202 PolarHBondContact OG-NE2 2.88Å; R199-Q202 PolarHBondContact O-N 3.45Å; Q202-Q205 PolarHBondContact O-N 2.68Å; Q202-R206 WeakPolarHBondContact O-CB 3.46Å; Q202-R206 WeakPolarHBondContact O-CD 3.49Å; Q202-R206 VanDerWaalsContact O-CG 3.22Å; Q202-R206 WeakPolarHBondContact O-CG 3.22Å; Q202-R206 PolarHBondContact O-N 3.22Å
203	D	86.9	Confident	89.1	Confident	72 Å²	72	99.9 Å²	99.9	39%	0.385	51%	0.514	S	S	.	.	H	α-helix	trans	-73.2	-32.5	179.7	-70.1	-32.4	0	0	0	112.1	R199 A200 R206 L207	R199-D203 WeakPolarHBondContact CG-OD2 3.49Å; R199-D203 WeakPolarHBondContact O-CB 3.44Å; R199-D203 PolarHBondContact O-N 3.06Å; A200-D203 PolarHBondContact O-N 2.84Å; D203-R206 PolarHBondContact O-N 3.2Å; D203-R206 WeakPolarHBondContact OD1-CD 3.49Å; D203-R206 IonicContact OD1-CZ 3.29Å; D203-R206 IonicContact OD1-NE 2.88Å; D203-R206 IonicContact OD1-NH1 2.72Å; D203-R206 PolarHBondContact OD1-NH1 3.03Å; D203-L207 WeakPolarHBondContact O-CB 3.47Å; D203-L207 PolarHBondContact O-N 2.87Å
204	Q	90.5	Very high	89.4	Confident	104 Å²	104	99.1 Å²	99.1	49%	0.486	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-51	168	179.8	70.5	29.7	0	0	111.2	A200 R206 L207 E208	A200-Q204 VanDerWaalsContact O-CB 3.23Å; A200-Q204 WeakPolarHBondContact O-CB 3.23Å; A200-Q204 PolarHBondContact O-N 3.43Å; Q204-R206 VanDerWaalsContact C-N 3.3Å; Q204-R206 PolarHBondContact O-N 3.42Å; Q204-L207 WeakPolarHBondContact O-CB 3.36Å; Q204-L207 PolarHBondContact O-N 2.86Å; Q204-E208 WeakPolarHBondContact CG-OE1 3.5Å; Q204-E208 PolarHBondContact NE2-OE1 3.07Å; Q204-E208 WeakPolarHBondContact O-CG 3.26Å; Q204-E208 PolarHBondContact O-N 2.96Å
205	Q	90.4	Very high	89.7	Confident	124 Å²	124	101.4 Å²	101.4	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-62.2	-36.6	177.5	-72.4	173.8	4.9	0	0	112.5	E201 Q202 T209	E201-Q205 WeakPolarHBondContact O-CG 3.42Å; E201-Q205 PolarHBondContact O-N 3.42Å; Q202-Q205 PolarHBondContact O-N 2.68Å; Q205-T209 WeakPolarHBondContact O-CB 3.38Å; Q205-T209 PolarHBondContact O-N 3.24Å; Q205-T209 PolarHBondContact O-OG1 3.38Å
206	R	90.6	Very high	89.9	Confident	135 Å²	135	104.4 Å²	104.4	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-44	171	-73.6	163.9	178.8	161.5	2.9	111.3	Q202 D203 Q204 T209 L210	Q202-R206 WeakPolarHBondContact O-CB 3.46Å; Q202-R206 WeakPolarHBondContact O-CD 3.49Å; Q202-R206 VanDerWaalsContact O-CG 3.22Å; Q202-R206 WeakPolarHBondContact O-CG 3.22Å; Q202-R206 PolarHBondContact O-N 3.22Å; D203-R206 PolarHBondContact O-N 3.2Å; D203-R206 WeakPolarHBondContact OD1-CD 3.49Å; D203-R206 IonicContact OD1-CZ 3.29Å; D203-R206 IonicContact OD1-NE 2.88Å; D203-R206 IonicContact OD1-NH1 2.72Å; D203-R206 PolarHBondContact OD1-NH1 3.03Å; Q204-R206 VanDerWaalsContact C-N 3.3Å; Q204-R206 PolarHBondContact O-N 3.42Å; R206-T209 PolarHBondContact O-N 3.32Å; R206-L210 VanDerWaalsContact O-CB 3.32Å; R206-L210 WeakPolarHBondContact O-CB 3.47Å; R206-L210 VanDerWaalsContact O-CG 3.22Å; R206-L210 WeakPolarHBondContact O-CG 3.41Å; R206-L210 PolarHBondContact O-N 2.82Å
207	L	90.4	Very high	90	Very high	118 Å²	118	104.7 Å²	104.7	62%	0.618	52%	0.522	S	S	*	.	H	α-helix	trans	-62	-43.8	179.2	-146.8	84.4	0	0	0	111.6	D203 Q204 L210 S211	D203-L207 WeakPolarHBondContact O-CB 3.47Å; D203-L207 PolarHBondContact O-N 2.87Å; Q204-L207 WeakPolarHBondContact O-CB 3.36Å; Q204-L207 PolarHBondContact O-N 2.86Å; L207-L210 PolarHBondContact O-N 2.84Å; L207-S211 VanDerWaalsContact O-CB 3.26Å; L207-S211 WeakPolarHBondContact O-CB 3.22Å; L207-S211 PolarHBondContact O-N 2.85Å
208	E	89.6	Confident	90.2	Very high	109 Å²	109	102.5 Å²	102.5	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-64	-45.1	176.3	-71.4	167.9	-169.7	0	0	111.5	Q204 L210 S211 A212	Q204-E208 WeakPolarHBondContact CG-OE1 3.5Å; Q204-E208 PolarHBondContact NE2-OE1 3.07Å; Q204-E208 WeakPolarHBondContact O-CG 3.26Å; Q204-E208 PolarHBondContact O-N 2.96Å; E208-L210 PolarHBondContact O-N 3.47Å; E208-S211 PolarHBondContact O-N 3.34Å; E208-A212 WeakPolarHBondContact O-CB 3.32Å; E208-A212 PolarHBondContact O-N 3.44Å
209	T	91.9	Very high	90.4	Very high	97 Å²	97	106.8 Å²	106.8	60%	0.595	53%	0.533	S	S	*	.	H	α-helix	trans	-63.1	-40.7	176.3	-55	0	0	0	0	111.9	Q205 R206 R213	Q205-T209 WeakPolarHBondContact O-CB 3.38Å; Q205-T209 PolarHBondContact O-N 3.24Å; Q205-T209 PolarHBondContact O-OG1 3.38Å; R206-T209 PolarHBondContact O-N 3.32Å; T209-R213 WeakPolarHBondContact O-CB 3.38Å; T209-R213 PolarHBondContact O-N 3.16Å
210	L	91.1	Very high	90.6	Very high	110 Å²	110	101.6 Å²	101.6	58%	0.576	52%	0.52	S	S	*	.	H	α-helix	trans	-69.5	-40.6	176.3	-73.2	168.4	0	0	0	111.4	R206 L207 E208 R213 V214	R206-L210 VanDerWaalsContact O-CB 3.32Å; R206-L210 WeakPolarHBondContact O-CB 3.47Å; R206-L210 VanDerWaalsContact O-CG 3.22Å; R206-L210 WeakPolarHBondContact O-CG 3.41Å; R206-L210 PolarHBondContact O-N 2.82Å; L207-L210 PolarHBondContact O-N 2.84Å; E208-L210 PolarHBondContact O-N 3.47Å; L210-R213 CarbonylContact O-C 3.57Å; L210-R213 PolarHBondContact O-N 3.41Å; L210-V214 WeakPolarHBondContact O-CG2 3.39Å; L210-V214 PolarHBondContact O-N 3.41Å
211	S	92	Very high	90.9	Very high	68 Å²	68	103.3 Å²	103.3	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-44.6	177.7	177.8	0	0	0	0	112	L207 E208 R213 V214 L215	L207-S211 VanDerWaalsContact O-CB 3.26Å; L207-S211 WeakPolarHBondContact O-CB 3.22Å; L207-S211 PolarHBondContact O-N 2.85Å; E208-S211 PolarHBondContact O-N 3.34Å; S211-R213 VanDerWaalsContact C-N 3.28Å; S211-R213 PolarHBondContact O-N 3.31Å; S211-V214 PolarHBondContact O-N 2.97Å; S211-L215 PolarHBondContact O-N 2.99Å
212	A	90.6	Very high	91	Very high	60 Å²	60	98.8 Å²	98.8	50%	0.496	51%	0.506	S	S	.	.	H	α-helix	trans	-59.5	-39.9	173.5	0	0	0	0	0	112	E208 L215 E216	E208-A212 WeakPolarHBondContact O-CB 3.32Å; E208-A212 PolarHBondContact O-N 3.44Å; A212-L215 PolarHBondContact O-N 3.11Å; A212-E216 PolarHBondContact O-N 3.1Å
213	R	92.9	Very high	91.2	Very high	164 Å²	164	97.7 Å²	97.7	62%	0.619	51%	0.505	S	S	*	.	H	α-helix	trans	-74.3	-27.2	178.5	-168.3	169.3	-179.7	165.1	-0.4	113.7	T209 L210 S211 L217	T209-R213 WeakPolarHBondContact O-CB 3.38Å; T209-R213 PolarHBondContact O-N 3.16Å; L210-R213 CarbonylContact O-C 3.57Å; L210-R213 PolarHBondContact O-N 3.41Å; S211-R213 VanDerWaalsContact C-N 3.28Å; S211-R213 PolarHBondContact O-N 3.31Å; R213-L217 HydrophobicContact CG-CD1 4.45Å; R213-L217 WeakPolarHBondContact O-CB 3.44Å; R213-L217 WeakPolarHBondContact O-CD1 3.4Å; R213-L217 WeakPolarHBondContact O-CG 3.2Å; R213-L217 PolarHBondContact O-N 3.27Å; R213-L217 VanDerWaalsContact O-N 3.11Å
214	V	91.5	Very high	91.4	Very high	74 Å²	74	102 Å²	102	45%	0.448	52%	0.516	S	S	.	.	H	α-helix	trans	-66.7	-48.1	169.3	166.4	0	0	0	0	109.8	L210 S211 E216 L217 E218	L210-V214 WeakPolarHBondContact O-CG2 3.39Å; L210-V214 PolarHBondContact O-N 3.41Å; S211-V214 PolarHBondContact O-N 2.97Å; V214-E216 PolarHBondContact O-N 2.84Å; V214-L217 CarbonylContact O-C 3.58Å; V214-L217 PolarHBondContact O-N 2.96Å; V214-L217 VanDerWaalsContact O-N 3.1Å; V214-E218 HydrophobicContact CG1-CG 4.28Å; V214-E218 WeakPolarHBondContact CG1-OE1 3.49Å; V214-E218 WeakPolarHBondContact O-CG 3.29Å; V214-E218 PolarHBondContact O-N 2.83Å
215	L	91.3	Very high	91.6	Very high	106 Å²	106	102.4 Å²	102.4	56%	0.555	52%	0.518	S	S	*	.	H	α-helix	trans	-58.7	-44	176.5	-74.4	162	0	0	0	112.5	S211 A212 L217 E218 E219	S211-L215 PolarHBondContact O-N 2.99Å; A212-L215 PolarHBondContact O-N 3.11Å; L215-L217 VanDerWaalsContact C-N 3.32Å; L215-L217 PolarHBondContact O-N 3.11Å; L215-E218 PolarHBondContact O-N 3.5Å; L215-E219 PolarHBondContact O-N 2.88Å
216	E	91.6	Very high	91.7	Very high	124 Å²	124	103.2 Å²	103.2	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-60.8	-39.8	174.7	-175.9	-176.8	-155	0	0	112	A212 V214 C220	A212-E216 PolarHBondContact O-N 3.1Å; V214-E216 PolarHBondContact O-N 2.84Å; E216-C220 VanDerWaalsContact O-CB 3.29Å; E216-C220 WeakPolarHBondContact O-CB 3.36Å; E216-C220 PolarHBondContact O-N 3.29Å; E216-C220 PolarHBondContact O-SG 2.75Å
217	L	90.1	Very high	91.8	Very high	98 Å²	98	101.4 Å²	101.4	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-71.5	-36.7	176.7	-74.5	170.1	0	0	0	112.5	R213 V214 L215 C220 L221	R213-L217 HydrophobicContact CG-CD1 4.45Å; R213-L217 WeakPolarHBondContact O-CB 3.44Å; R213-L217 WeakPolarHBondContact O-CD1 3.4Å; R213-L217 WeakPolarHBondContact O-CG 3.2Å; R213-L217 PolarHBondContact O-N 3.27Å; R213-L217 VanDerWaalsContact O-N 3.11Å; V214-L217 CarbonylContact O-C 3.58Å; V214-L217 PolarHBondContact O-N 2.96Å; V214-L217 VanDerWaalsContact O-N 3.1Å; L215-L217 VanDerWaalsContact C-N 3.32Å; L215-L217 PolarHBondContact O-N 3.11Å; L217-C220 CarbonylContact O-C 3.56Å; L217-C220 PolarHBondContact O-N 2.84Å; L217-L221 WeakPolarHBondContact O-CB 3.4Å; L217-L221 VanDerWaalsContact O-CG 3.26Å; L217-L221 WeakPolarHBondContact O-CG 3.4Å; L217-L221 PolarHBondContact O-N 3.14Å
218	E	91.6	Very high	92	Very high	115 Å²	115	100.4 Å²	100.4	54%	0.537	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-42.2	174.7	-73.8	172.5	166.6	0	0	111.3	V214 L215 L221 G222	V214-E218 HydrophobicContact CG1-CG 4.28Å; V214-E218 WeakPolarHBondContact CG1-OE1 3.49Å; V214-E218 WeakPolarHBondContact O-CG 3.29Å; V214-E218 PolarHBondContact O-N 2.83Å; L215-E218 PolarHBondContact O-N 3.5Å; E218-L221 PolarHBondContact O-N 3.46Å; E218-G222 PolarHBondContact O-N 3.06Å
219	E	91.6	Very high	92.1	Very high	142 Å²	142	101.6 Å²	101.6	66%	0.664	52%	0.516	S	S	*	.	H	α-helix	trans	-66.8	-40.2	172.6	-172.1	172	-169.4	0	0	111.9	L215 L221 G222 T223	L215-E219 PolarHBondContact O-N 2.88Å; E219-L221 VanDerWaalsContact C-N 3.26Å; E219-L221 PolarHBondContact O-N 3.37Å; E219-G222 PolarHBondContact O-N 3.31Å; E219-T223 WeakPolarHBondContact O-CB 3.38Å; E219-T223 WeakPolarHBondContact O-CG2 3.26Å; E219-T223 PolarHBondContact O-N 2.8Å; E219-T223 PolarHBondContact O-OG1 2.86Å
220	C	93.7	Very high	92.2	Very high	50 Å²	50	102.6 Å²	102.6	34%	0.338	51%	0.514	S	S	.	.	H	α-helix	trans	-66.3	-23.1	173.8	-75.4	0	0	0	0	114.2	E216 L217 T223 R224	E216-C220 VanDerWaalsContact O-CB 3.29Å; E216-C220 WeakPolarHBondContact O-CB 3.36Å; E216-C220 PolarHBondContact O-N 3.29Å; E216-C220 PolarHBondContact O-SG 2.75Å; L217-C220 CarbonylContact O-C 3.56Å; L217-C220 PolarHBondContact O-N 2.84Å; C220-T223 WeakPolarHBondContact CA-OG1 3.41Å; C220-T223 PolarHBondContact O-OG1 2.96Å; C220-R224 WeakPolarHBondContact O-CG 3.49Å
221	L	92.6	Very high	92.3	Very high	95 Å²	95	101.6 Å²	101.6	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-81.5	-53.5	171.7	-76.8	165.4	0	0	0	110.1	L217 E218 E219 T223 R224 E225	L217-L221 WeakPolarHBondContact O-CB 3.4Å; L217-L221 VanDerWaalsContact O-CG 3.26Å; L217-L221 WeakPolarHBondContact O-CG 3.4Å; L217-L221 PolarHBondContact O-N 3.14Å; E218-L221 PolarHBondContact O-N 3.46Å; E219-L221 VanDerWaalsContact C-N 3.26Å; E219-L221 PolarHBondContact O-N 3.37Å; L221-T223 PolarHBondContact O-N 2.95Å; L221-T223 VanDerWaalsContact O-N 3.11Å; L221-R224 CarbonylContact O-C 3.55Å; L221-R224 WeakPolarHBondContact O-CA 3.38Å; L221-R224 WeakPolarHBondContact O-CB 3.45Å; L221-R224 PolarHBondContact O-N 3.35Å; L221-E225 WeakPolarHBondContact O-CG 3.46Å; L221-E225 PolarHBondContact O-N 2.9Å
222	G	91.1	Very high	92.5	Very high	23 Å²	23	103.1 Å²	103.1	24%	0.237	51%	0.508	C	S	.	.	H	α-helix	trans	-63.7	-17.9	179.7	0	0	0	0	0	114.8	E218 E219 R226	E218-G222 PolarHBondContact O-N 3.06Å; E219-G222 PolarHBondContact O-N 3.31Å; G222-R226 PolarHBondContact O-NE 2.93Å; G222-R226 PolarHBondContact O-NH2 3.05Å
223	T	92.8	Very high	92.6	Very high	64 Å²	64	101.7 Å²	101.7	39%	0.393	50%	0.499	S	S	.	.	H	α-helix	trans	-80.4	-43.8	166.4	44.9	0	0	0	0	112.4	E219 C220 L221 L227	E219-T223 WeakPolarHBondContact O-CB 3.38Å; E219-T223 WeakPolarHBondContact O-CG2 3.26Å; E219-T223 PolarHBondContact O-N 2.8Å; E219-T223 PolarHBondContact O-OG1 2.86Å; C220-T223 WeakPolarHBondContact CA-OG1 3.41Å; C220-T223 PolarHBondContact O-OG1 2.96Å; L221-T223 PolarHBondContact O-N 2.95Å; L221-T223 VanDerWaalsContact O-N 3.11Å; T223-L227 PolarHBondContact O-N 3.31Å; T223-L227 VanDerWaalsContact O-N 3.14Å
224	R	92.2	Very high	92.7	Very high	163 Å²	163	99.1 Å²	99.1	62%	0.615	49%	0.494	S	S	*	.	H	α-helix	trans	-63.4	-39.4	174.4	-83.4	-178.5	165.4	87.2	-2.4	113	C220 L221 L227 L228	C220-R224 WeakPolarHBondContact O-CG 3.49Å; L221-R224 CarbonylContact O-C 3.55Å; L221-R224 WeakPolarHBondContact O-CA 3.38Å; L221-R224 WeakPolarHBondContact O-CB 3.45Å; L221-R224 PolarHBondContact O-N 3.35Å; R224-L227 PolarHBondContact O-N 3.02Å; R224-L228 WeakPolarHBondContact O-CB 3.48Å; R224-L228 VanDerWaalsContact O-CG 3.28Å; R224-L228 WeakPolarHBondContact O-CG 3.41Å; R224-L228 PolarHBondContact O-N 2.9Å
225	E	93.4	Very high	92.8	Very high	112 Å²	112	102.9 Å²	102.9	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-65.1	-41.5	179.5	-73.4	176.6	168.5	0	0	111.9	L221 L228 Q229	L221-E225 WeakPolarHBondContact O-CG 3.46Å; L221-E225 PolarHBondContact O-N 2.9Å; E225-L228 PolarHBondContact O-N 3.28Å; E225-Q229 WeakPolarHBondContact O-CG 3.09Å; E225-Q229 PolarHBondContact O-N 3.39Å
226	R	92.3	Very high	93	Very high	141 Å²	141	102.8 Å²	102.8	53%	0.532	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-48.5	171.8	-79.3	179.8	-75.2	161.8	-5.8	111.9	G222 L228 Q229 E230	G222-R226 PolarHBondContact O-NE 2.93Å; G222-R226 PolarHBondContact O-NH2 3.05Å; R226-L228 VanDerWaalsContact C-N 3.26Å; R226-L228 PolarHBondContact O-N 2.94Å; R226-Q229 WeakPolarHBondContact O-CB 3.24Å; R226-Q229 PolarHBondContact O-N 2.94Å; R226-E230 WeakPolarHBondContact O-CG 3.27Å; R226-E230 PolarHBondContact O-N 3.33Å
227	L	94.5	Very high	93.1	Very high	97 Å²	97	103 Å²	103	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-60	-37.5	176.9	-164.9	79.2	0	0	0	112	T223 R224 L231	T223-L227 PolarHBondContact O-N 3.31Å; T223-L227 VanDerWaalsContact O-N 3.14Å; R224-L227 PolarHBondContact O-N 3.02Å; L227-L231 HydrophobicContact CD2-CD1 4.4Å; L227-L231 HydrophobicContact CG-CD1 4.11Å; L227-L231 WeakPolarHBondContact O-CB 3.35Å; L227-L231 VanDerWaalsContact O-CG 3.24Å; L227-L231 WeakPolarHBondContact O-CG 3.28Å; L227-L231 PolarHBondContact O-N 3.34Å
228	L	93.1	Very high	93.3	Very high	97 Å²	97	103.4 Å²	103.4	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-68.1	-34.9	174.9	-76.2	169.2	0	0	0	112.5	R224 E225 R226 Q232	R224-L228 WeakPolarHBondContact O-CB 3.48Å; R224-L228 VanDerWaalsContact O-CG 3.28Å; R224-L228 WeakPolarHBondContact O-CG 3.41Å; R224-L228 PolarHBondContact O-N 2.9Å; E225-L228 PolarHBondContact O-N 3.28Å; R226-L228 VanDerWaalsContact C-N 3.26Å; R226-L228 PolarHBondContact O-N 2.94Å; L228-Q232 VanDerWaalsContact O-CB 3.27Å; L228-Q232 WeakPolarHBondContact O-CB 3.4Å; L228-Q232 WeakPolarHBondContact O-CG 3.38Å; L228-Q232 PolarHBondContact O-N 2.83Å; L228-Q232 PolarHBondContact O-NE2 3.3Å
229	Q	93	Very high	93.5	Very high	133 Å²	133	103.7 Å²	103.7	62%	0.621	51%	0.505	S	S	*	.	H	α-helix	trans	-69.6	-43.2	173.5	-72.8	174.5	6	0	0	111.7	E225 R226 Q232 G233	E225-Q229 WeakPolarHBondContact O-CG 3.09Å; E225-Q229 PolarHBondContact O-N 3.39Å; R226-Q229 WeakPolarHBondContact O-CB 3.24Å; R226-Q229 PolarHBondContact O-N 2.94Å; Q229-Q232 PolarHBondContact O-N 3.15Å; Q229-G233 PolarHBondContact O-N 3.03Å
230	E	94.1	Very high	93.7	Very high	118 Å²	118	103.3 Å²	103.3	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-58.8	-53.1	175.4	-71.3	166.6	175.4	0	0	110.9	R226 Q232 G233 E234	R226-E230 WeakPolarHBondContact O-CG 3.27Å; R226-E230 PolarHBondContact O-N 3.33Å; E230-Q232 VanDerWaalsContact C-N 3.29Å; E230-Q232 PolarHBondContact O-N 3.41Å; E230-G233 WeakPolarHBondContact O-CA 3.42Å; E230-G233 PolarHBondContact O-N 3.02Å; E230-E234 PolarHBondContact O-N 2.98Å
231	L	93.3	Very high	93.7	Very high	90 Å²	90	106.2 Å²	106.2	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-29.1	177.2	-69.2	169.7	0	0	0	113.3	L227 R235	L227-L231 HydrophobicContact CD2-CD1 4.4Å; L227-L231 HydrophobicContact CG-CD1 4.11Å; L227-L231 WeakPolarHBondContact O-CB 3.35Å; L227-L231 VanDerWaalsContact O-CG 3.24Å; L227-L231 WeakPolarHBondContact O-CG 3.28Å; L227-L231 PolarHBondContact O-N 3.34Å; L231-R235 VanDerWaalsContact O-CB 3.23Å; L231-R235 WeakPolarHBondContact O-CB 3.46Å; L231-R235 PolarHBondContact O-N 3.19Å
232	Q	94.6	Very high	93.8	Very high	99 Å²	99	111.2 Å²	111.2	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-70.5	-37.8	171.8	-79.4	169.7	41.7	0	0	111.9	L228 Q229 E230 L236	L228-Q232 VanDerWaalsContact O-CB 3.27Å; L228-Q232 WeakPolarHBondContact O-CB 3.4Å; L228-Q232 WeakPolarHBondContact O-CG 3.38Å; L228-Q232 PolarHBondContact O-N 2.83Å; L228-Q232 PolarHBondContact O-NE2 3.3Å; Q229-Q232 PolarHBondContact O-N 3.15Å; E230-Q232 VanDerWaalsContact C-N 3.29Å; E230-Q232 PolarHBondContact O-N 3.41Å; Q232-L236 WeakPolarHBondContact O-CG 3.33Å; Q232-L236 PolarHBondContact O-N 2.99Å
233	G	93.6	Very high	94	Very high	30 Å²	30	113.1 Å²	113.1	31%	0.309	53%	0.533	S	S	.	.	H	α-helix	trans	-63.6	-50.8	173.3	0	0	0	0	0	112.3	Q229 E230 R235 L236 Q237	Q229-G233 PolarHBondContact O-N 3.03Å; E230-G233 WeakPolarHBondContact O-CA 3.42Å; E230-G233 PolarHBondContact O-N 3.02Å; G233-R235 VanDerWaalsContact C-N 3.33Å; G233-R235 PolarHBondContact O-N 3.01Å; G233-L236 PolarHBondContact O-N 3Å; G233-L236 VanDerWaalsContact O-N 3.15Å; G233-Q237 PolarHBondContact O-N 3.08Å
234	E	94.3	Very high	94.1	Very high	110 Å²	110	112.9 Å²	112.9	51%	0.514	53%	0.532	S	S	.	.	H	α-helix	trans	-57.5	-44.4	174.9	-69.5	-175.5	163.9	0	0	111.7	E230 L236 Q237 L238	E230-E234 PolarHBondContact O-N 2.98Å; E234-L236 VanDerWaalsContact C-N 3.32Å; E234-L236 PolarHBondContact O-N 2.97Å; E234-Q237 PolarHBondContact O-N 3.23Å; E234-L238 WeakPolarHBondContact O-CB 3.32Å; E234-L238 WeakPolarHBondContact O-CG 3.23Å; E234-L238 PolarHBondContact O-N 3.43Å
235	R	94.9	Very high	94.2	Very high	153 Å²	153	110.3 Å²	110.3	58%	0.577	53%	0.529	S	S	*	.	H	α-helix	trans	-61.7	-38.5	177.1	-171.2	-168.2	69.8	178.5	-1.3	112.2	L231 G233 Q239	L231-R235 VanDerWaalsContact O-CB 3.23Å; L231-R235 WeakPolarHBondContact O-CB 3.46Å; L231-R235 PolarHBondContact O-N 3.19Å; G233-R235 VanDerWaalsContact C-N 3.33Å; G233-R235 PolarHBondContact O-N 3.01Å; R235-Q239 WeakPolarHBondContact O-CB 3.48Å; R235-Q239 PolarHBondContact O-N 3.01Å
236	L	94.8	Very high	94.4	Very high	105 Å²	105	107.6 Å²	107.6	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-67.2	-44.7	176.5	-77.3	165.6	0	0	0	111.4	Q232 G233 E234 Q239 E240	Q232-L236 WeakPolarHBondContact O-CG 3.33Å; Q232-L236 PolarHBondContact O-N 2.99Å; G233-L236 PolarHBondContact O-N 3Å; G233-L236 VanDerWaalsContact O-N 3.15Å; E234-L236 VanDerWaalsContact C-N 3.32Å; E234-L236 PolarHBondContact O-N 2.97Å; L236-Q239 PolarHBondContact O-N 2.95Å; L236-E240 PolarHBondContact O-N 3.18Å
237	Q	94.8	Very high	94.5	Very high	127 Å²	127	104.8 Å²	104.8	59%	0.593	52%	0.522	S	S	*	.	H	α-helix	trans	-59.8	-50.7	175.5	-71.3	175.6	-11.1	0	0	111.5	G233 E234 Q239 E240 E241	G233-Q237 PolarHBondContact O-N 3.08Å; E234-Q237 PolarHBondContact O-N 3.23Å; Q237-Q239 PolarHBondContact O-N 3.47Å; Q237-E240 PolarHBondContact O-N 2.93Å; Q237-E240 VanDerWaalsContact O-N 3.08Å; Q237-E241 WeakPolarHBondContact O-CG 3.19Å; Q237-E241 PolarHBondContact O-N 3.38Å
238	L	94.3	Very high	94.6	Very high	107 Å²	107	105.7 Å²	105.7	56%	0.56	52%	0.523	S	S	*	.	H	α-helix	trans	-62.3	-27.5	176.8	-69.8	168	0	0	0	112.9	E234 R242	E234-L238 WeakPolarHBondContact O-CB 3.32Å; E234-L238 WeakPolarHBondContact O-CG 3.23Å; E234-L238 PolarHBondContact O-N 3.43Å; L238-R242 WeakPolarHBondContact O-CB 3.17Å; L238-R242 PolarHBondContact O-N 3.09Å
239	Q	95	Very high	94.7	Very high	122 Å²	122	106.7 Å²	106.7	57%	0.57	53%	0.528	S	S	*	.	H	α-helix	trans	-76.3	-33.3	175.1	-175.2	170.7	-13.5	0	0	112.3	R235 L236 Q237 S243	R235-Q239 WeakPolarHBondContact O-CB 3.48Å; R235-Q239 PolarHBondContact O-N 3.01Å; L236-Q239 PolarHBondContact O-N 2.95Å; Q237-Q239 PolarHBondContact O-N 3.47Å; Q239-S243 PolarHBondContact O-N 3.06Å; Q239-S243 VanDerWaalsContact O-N 3.11Å
240	E	95.1	Very high	94.8	Very high	134 Å²	134	105.2 Å²	105.2	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-74.7	-42.9	172.4	-173	170.8	-164.5	0	0	112.1	L236 Q237 R242 S243 T244	L236-E240 PolarHBondContact O-N 3.18Å; Q237-E240 PolarHBondContact O-N 2.93Å; Q237-E240 VanDerWaalsContact O-N 3.08Å; E240-R242 VanDerWaalsContact C-N 3.32Å; E240-R242 PolarHBondContact O-N 2.94Å; E240-S243 PolarHBondContact O-N 3.45Å; E240-S243 PolarHBondContact O-OG 2.95Å; E240-T244 WeakPolarHBondContact O-CG2 3.33Å; E240-T244 PolarHBondContact O-N 3.43Å; E240-T244 PolarHBondContact O-OG1 3.34Å
241	E	94.8	Very high	94.9	Very high	111 Å²	111	102.4 Å²	102.4	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-58.4	-44.2	170.5	-72.3	-175.7	171	0	0	111.1	Q237 S243 T244 L245	Q237-E241 WeakPolarHBondContact O-CG 3.19Å; Q237-E241 PolarHBondContact O-N 3.38Å; E241-S243 VanDerWaalsContact C-N 3.35Å; E241-S243 PolarHBondContact O-N 2.9Å; E241-T244 WeakPolarHBondContact CA-OG1 3.45Å; E241-T244 PolarHBondContact O-N 3.11Å; E241-T244 PolarHBondContact O-OG1 3Å; E241-L245 WeakPolarHBondContact O-CB 3.21Å; E241-L245 VanDerWaalsContact O-CG 3.25Å; E241-L245 WeakPolarHBondContact O-CG 3.43Å; E241-L245 PolarHBondContact O-N 2.97Å
242	R	94.8	Very high	94.9	Very high	200 Å²	200	103.6 Å²	103.6	76%	0.755	51%	0.511	S	S	*	.	H	α-helix	trans	-62.6	-37.9	175.2	178.8	178.8	165.7	-163.7	-6.7	112.7	L238 E240 S246	L238-R242 WeakPolarHBondContact O-CB 3.17Å; L238-R242 PolarHBondContact O-N 3.09Å; E240-R242 VanDerWaalsContact C-N 3.32Å; E240-R242 PolarHBondContact O-N 2.94Å; R242-S246 WeakPolarHBondContact O-CB 3.48Å; R242-S246 PolarHBondContact O-N 2.84Å
243	S	94.3	Very high	95	Very high	62 Å²	62	104.2 Å²	104.2	43%	0.434	52%	0.515	S	S	.	.	H	α-helix	trans	-72.7	-39.3	-179.8	73.1	0	0	0	0	112.1	Q239 E240 E241 S246 T247	Q239-S243 PolarHBondContact O-N 3.06Å; Q239-S243 VanDerWaalsContact O-N 3.11Å; E240-S243 PolarHBondContact O-N 3.45Å; E240-S243 PolarHBondContact O-OG 2.95Å; E241-S243 VanDerWaalsContact C-N 3.35Å; E241-S243 PolarHBondContact O-N 2.9Å; S243-S246 PolarHBondContact O-N 2.69Å; S243-T247 PolarHBondContact O-N 2.71Å; S243-T247 PolarHBondContact O-OG1 3.1Å
244	T	95.2	Very high	95	Very high	60 Å²	60	109.3 Å²	109.3	37%	0.368	52%	0.524	S	S	.	.	H	α-helix	trans	-68.3	-36.5	174.3	53.5	0	0	0	0	112.3	E240 E241 T247 Q248	E240-T244 WeakPolarHBondContact O-CG2 3.33Å; E240-T244 PolarHBondContact O-N 3.43Å; E240-T244 PolarHBondContact O-OG1 3.34Å; E241-T244 WeakPolarHBondContact CA-OG1 3.45Å; E241-T244 PolarHBondContact O-N 3.11Å; E241-T244 PolarHBondContact O-OG1 3Å; T244-T247 WeakPolarHBondContact CA-OG1 3.5Å; T244-T247 PolarHBondContact O-OG1 3.04Å; T244-T247 VanDerWaalsContact O-OG1 3.09Å; T244-Q248 WeakPolarHBondContact O-CB 3.25Å; T244-Q248 WeakPolarHBondContact O-CG 3.42Å; T244-Q248 PolarHBondContact O-N 3.03Å
245	L	95.3	Very high	95.1	Very high	108 Å²	108	110.4 Å²	110.4	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-69.3	-37.1	171.6	-71.6	170.3	0	0	0	113	E241 Q248 L249	E241-L245 WeakPolarHBondContact O-CB 3.21Å; E241-L245 VanDerWaalsContact O-CG 3.25Å; E241-L245 WeakPolarHBondContact O-CG 3.43Å; E241-L245 PolarHBondContact O-N 2.97Å; L245-Q248 PolarHBondContact O-N 3.06Å; L245-L249 WeakPolarHBondContact O-CB 3.4Å; L245-L249 PolarHBondContact O-N 2.91Å
246	S	95.6	Very high	95.1	Very high	56 Å²	56	109.1 Å²	109.1	39%	0.392	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-52.4	174.7	-163.5	0	0	0	0	111	R242 S243 Q248 L249 E250	R242-S246 WeakPolarHBondContact O-CB 3.48Å; R242-S246 PolarHBondContact O-N 2.84Å; S243-S246 PolarHBondContact O-N 2.69Å; S246-Q248 VanDerWaalsContact C-N 3.31Å; S246-Q248 PolarHBondContact O-N 3.29Å; S246-L249 WeakPolarHBondContact O-CB 3.28Å; S246-L249 PolarHBondContact O-N 2.73Å; S246-E250 VanDerWaalsContact O-CG 3.32Å; S246-E250 WeakPolarHBondContact O-CG 3.24Å; S246-E250 PolarHBondContact O-N 2.75Å; S246-E250 PolarHBondContact OG-OE1 3.34Å
247	T	95.3	Very high	95.2	Very high	81 Å²	81	109.6 Å²	109.6	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-63.9	-33.6	179.4	48.5	0	0	0	0	113	S243 T244 E251	S243-T247 PolarHBondContact O-N 2.71Å; S243-T247 PolarHBondContact O-OG1 3.1Å; T244-T247 WeakPolarHBondContact CA-OG1 3.5Å; T244-T247 PolarHBondContact O-OG1 3.04Å; T244-T247 VanDerWaalsContact O-OG1 3.09Å; T247-E251 VanDerWaalsContact O-CB 3.24Å; T247-E251 WeakPolarHBondContact O-CB 3.32Å; T247-E251 PolarHBondContact O-N 2.79Å
248	Q	95.8	Very high	95.2	Very high	117 Å²	117	106.6 Å²	106.6	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-67.3	-37.3	170.7	-75.7	175.3	35.2	0	0	112.9	T244 L245 S246 Q252	T244-Q248 WeakPolarHBondContact O-CB 3.25Å; T244-Q248 WeakPolarHBondContact O-CG 3.42Å; T244-Q248 PolarHBondContact O-N 3.03Å; L245-Q248 PolarHBondContact O-N 3.06Å; S246-Q248 VanDerWaalsContact C-N 3.31Å; S246-Q248 PolarHBondContact O-N 3.29Å; Q248-Q252 VanDerWaalsContact O-CG 3.28Å; Q248-Q252 WeakPolarHBondContact O-CG 3.21Å; Q248-Q252 PolarHBondContact O-N 3.09Å
249	L	95.6	Very high	95.2	Very high	117 Å²	117	105.7 Å²	105.7	61%	0.613	52%	0.518	S	S	*	.	H	α-helix	trans	-67.3	-48.1	176.6	-175.9	65.1	0	0	0	110.8	L245 S246 E251 Q252 E253	L245-L249 WeakPolarHBondContact O-CB 3.4Å; L245-L249 PolarHBondContact O-N 2.91Å; S246-L249 WeakPolarHBondContact O-CB 3.28Å; S246-L249 PolarHBondContact O-N 2.73Å; L249-E251 VanDerWaalsContact C-N 3.27Å; L249-E251 PolarHBondContact O-N 3.36Å; L249-Q252 PolarHBondContact O-N 2.84Å; L249-Q252 VanDerWaalsContact O-N 3.1Å; L249-E253 WeakPolarHBondContact O-CB 3.43Å; L249-E253 PolarHBondContact O-N 2.73Å
250	E	95.3	Very high	95.3	Very high	103 Å²	103	105.2 Å²	105.2	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-57.7	-38.8	175.1	-67.5	158.1	-135.7	0	0	111.9	S246 R254	S246-E250 VanDerWaalsContact O-CG 3.32Å; S246-E250 WeakPolarHBondContact O-CG 3.24Å; S246-E250 PolarHBondContact O-N 2.75Å; S246-E250 PolarHBondContact OG-OE1 3.34Å; E250-R254 VanDerWaalsContact O-CB 3.27Å; E250-R254 WeakPolarHBondContact O-CB 3.38Å; E250-R254 PolarHBondContact O-N 3.26Å
251	E	95.7	Very high	95.2	Very high	59 Å²	59	101.9 Å²	101.9	28%	0.276	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-45.4	172.9	175.8	73.9	-150.9	0	0	112.4	T247 L249 R254 R255	T247-E251 VanDerWaalsContact O-CB 3.24Å; T247-E251 WeakPolarHBondContact O-CB 3.32Å; T247-E251 PolarHBondContact O-N 2.79Å; L249-E251 VanDerWaalsContact C-N 3.27Å; L249-E251 PolarHBondContact O-N 3.36Å; E251-R254 IonicContact OE1-NH1 2.71Å; E251-R254 PolarHBondContact OE1-NH1 2.75Å; E251-R254 IonicContact OE2-CZ 3.18Å; E251-R254 IonicContact OE2-NH1 3.87Å; E251-R254 PolarHBondContact OE2-NH1 3.31Å; E251-R254 IonicContact OE2-NH2 3.15Å; E251-R254 PolarHBondContact OE2-NH2 2.99Å; E251-R255 WeakPolarHBondContact O-CD 3.46Å; E251-R255 WeakPolarHBondContact O-CG 3.32Å; E251-R255 PolarHBondContact O-N 3.25Å; E251-R255 VanDerWaalsContact O-N 3.09Å; E251-R255 IonicContact OE1-CZ 3.36Å; E251-R255 IonicContact OE1-NE 2.7Å; E251-R255 PolarHBondContact OE1-NE 3.41Å; E251-R255 IonicContact OE1-NH2 3Å; E251-R255 PolarHBondContact OE1-NH2 3.47Å
252	Q	94.2	Very high	95.3	Very high	114 Å²	114	99.5 Å²	99.5	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-71.2	-37.9	179.2	-67.4	-71.2	12.8	0	0	112.4	Q248 L249 R255 F256	Q248-Q252 VanDerWaalsContact O-CG 3.28Å; Q248-Q252 WeakPolarHBondContact O-CG 3.21Å; Q248-Q252 PolarHBondContact O-N 3.09Å; L249-Q252 PolarHBondContact O-N 2.84Å; L249-Q252 VanDerWaalsContact O-N 3.1Å; Q252-R255 WeakPolarHBondContact O-CB 3.49Å; Q252-R255 PolarHBondContact O-N 3.06Å; Q252-F256 WeakPolarHBondContact O-CB 3.48Å; Q252-F256 PolarHBondContact O-N 2.97Å
253	E	95.6	Very high	95.3	Very high	113 Å²	113	94.8 Å²	94.8	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-67.8	-40.6	178.8	-166.8	157.7	-141.5	0	0	111.1	L249 R255 F256 Q257	L249-E253 WeakPolarHBondContact O-CB 3.43Å; L249-E253 PolarHBondContact O-N 2.73Å; E253-R255 PolarHBondContact O-N 3.17Å; E253-F256 PolarHBondContact O-N 3.05Å; E253-Q257 WeakPolarHBondContact O-CG 3.45Å; E253-Q257 PolarHBondContact O-N 3.48Å
254	R	94.9	Very high	95.4	Very high	136 Å²	136	94.4 Å²	94.4	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-41.8	170	-163.8	-153.6	-41.5	126.2	5.1	112.4	E250 E251 A258	E250-R254 VanDerWaalsContact O-CB 3.27Å; E250-R254 WeakPolarHBondContact O-CB 3.38Å; E250-R254 PolarHBondContact O-N 3.26Å; E251-R254 IonicContact OE1-NH1 2.71Å; E251-R254 PolarHBondContact OE1-NH1 2.75Å; E251-R254 IonicContact OE2-CZ 3.18Å; E251-R254 IonicContact OE2-NH1 3.87Å; E251-R254 PolarHBondContact OE2-NH1 3.31Å; E251-R254 IonicContact OE2-NH2 3.15Å; E251-R254 PolarHBondContact OE2-NH2 2.99Å; R254-A258 WeakPolarHBondContact O-CB 3.37Å; R254-A258 PolarHBondContact O-N 3.31Å; R254-A258 VanDerWaalsContact O-N 3.11Å
255	R	96.6	Very high	95.4	Very high	134 Å²	134	95 Å²	95	51%	0.506	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-43.1	175.9	-73.5	167.5	-175	-159.8	3.7	111.5	E251 Q252 E253 A258 T259	E251-R255 WeakPolarHBondContact O-CD 3.46Å; E251-R255 WeakPolarHBondContact O-CG 3.32Å; E251-R255 PolarHBondContact O-N 3.25Å; E251-R255 VanDerWaalsContact O-N 3.09Å; E251-R255 IonicContact OE1-CZ 3.36Å; E251-R255 IonicContact OE1-NE 2.7Å; E251-R255 PolarHBondContact OE1-NE 3.41Å; E251-R255 IonicContact OE1-NH2 3Å; E251-R255 PolarHBondContact OE1-NH2 3.47Å; Q252-R255 WeakPolarHBondContact O-CB 3.49Å; Q252-R255 PolarHBondContact O-N 3.06Å; E253-R255 PolarHBondContact O-N 3.17Å; R255-A258 PolarHBondContact O-N 2.83Å; R255-T259 PolarHBondContact O-N 3.48Å; R255-T259 PolarHBondContact O-OG1 2.91Å
256	F	95	Very high	95.4	Very high	126 Å²	126	92.7 Å²	92.7	55%	0.553	50%	0.497	S	S	*	.	H	α-helix	trans	-59.8	-51.5	177.6	-177	-91.8	0	0	0	111.1	Q252 E253 A258 T259 E260	Q252-F256 WeakPolarHBondContact O-CB 3.48Å; Q252-F256 PolarHBondContact O-N 2.97Å; E253-F256 PolarHBondContact O-N 3.05Å; F256-A258 VanDerWaalsContact C-N 3.29Å; F256-A258 PolarHBondContact O-N 3.11Å; F256-T259 WeakPolarHBondContact CA-OG1 3.23Å; F256-T259 CarbonylContact O-C 3.56Å; F256-T259 PolarHBondContact O-N 3.25Å; F256-T259 PolarHBondContact O-OG1 2.98Å; F256-E260 HydrophobicContact CE1-CB 4.46Å; F256-E260 WeakPolarHBondContact CE1-OE2 3.49Å; F256-E260 WeakPolarHBondContact O-CB 3.27Å; F256-E260 PolarHBondContact O-N 3.09Å
257	Q	95.6	Very high	95.4	Very high	115 Å²	115	95.5 Å²	95.5	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-57	-41	176.8	-70	170.1	11.3	0	0	112.3	E253 E260 A261	E253-Q257 WeakPolarHBondContact O-CG 3.45Å; E253-Q257 PolarHBondContact O-N 3.48Å; Q257-E260 PolarHBondContact O-N 2.91Å; Q257-A261 WeakPolarHBondContact O-CB 3.47Å; Q257-A261 PolarHBondContact O-N 3.08Å
258	A	95.6	Very high	95.4	Very high	63 Å²	63	97.5 Å²	97.5	52%	0.521	51%	0.507	S	S	.	.	H	α-helix	trans	-64.5	-40.3	175.1	0	0	0	0	0	112.6	R254 R255 F256 A262	R254-A258 WeakPolarHBondContact O-CB 3.37Å; R254-A258 PolarHBondContact O-N 3.31Å; R254-A258 VanDerWaalsContact O-N 3.11Å; R255-A258 PolarHBondContact O-N 2.83Å; F256-A258 VanDerWaalsContact C-N 3.29Å; F256-A258 PolarHBondContact O-N 3.11Å; A258-A262 WeakPolarHBondContact O-CB 3.48Å; A258-A262 PolarHBondContact O-N 3.31Å; A258-A262 VanDerWaalsContact O-N 3.09Å
259	T	94.1	Very high	95.4	Very high	88 Å²	88	97.6 Å²	97.6	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-70.8	-33.3	175.1	52.7	0	0	0	0	113.3	R255 F256 L263	R255-T259 PolarHBondContact O-N 3.48Å; R255-T259 PolarHBondContact O-OG1 2.91Å; F256-T259 WeakPolarHBondContact CA-OG1 3.23Å; F256-T259 CarbonylContact O-C 3.56Å; F256-T259 PolarHBondContact O-N 3.25Å; F256-T259 PolarHBondContact O-OG1 2.98Å; T259-L263 VanDerWaalsContact O-CB 3.23Å; T259-L263 WeakPolarHBondContact O-CB 3.43Å; T259-L263 PolarHBondContact O-N 2.94Å
260	E	96.1	Very high	95.5	Very high	113 Å²	113	94.8 Å²	94.8	53%	0.528	50%	0.495	S	S	.	.	H	α-helix	trans	-68.5	-44.9	176.7	-175.1	170.7	-148.2	0	0	111.2	F256 Q257 L263 S264	F256-E260 HydrophobicContact CE1-CB 4.46Å; F256-E260 WeakPolarHBondContact CE1-OE2 3.49Å; F256-E260 WeakPolarHBondContact O-CB 3.27Å; F256-E260 PolarHBondContact O-N 3.09Å; Q257-E260 PolarHBondContact O-N 2.91Å; E260-L263 PolarHBondContact O-N 3.45Å; E260-S264 PolarHBondContact O-N 3.39Å
261	A	95	Very high	95.5	Very high	64 Å²	64	93.5 Å²	93.5	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-43.9	173.8	0	0	0	0	0	112.4	Q257 L263 S264 S265	Q257-A261 WeakPolarHBondContact O-CB 3.47Å; Q257-A261 PolarHBondContact O-N 3.08Å; A261-L263 VanDerWaalsContact C-N 3.33Å; A261-L263 PolarHBondContact O-N 3.37Å; A261-S264 PolarHBondContact O-N 2.75Å; A261-S265 PolarHBondContact O-N 3.32Å; A261-S265 VanDerWaalsContact O-N 3.08Å
262	A	95.6	Very high	95.6	Very high	61 Å²	61	93.2 Å²	93.2	50%	0.504	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-38	175.3	0	0	0	0	0	112.3	A258 S266	A258-A262 WeakPolarHBondContact O-CB 3.48Å; A258-A262 PolarHBondContact O-N 3.31Å; A258-A262 VanDerWaalsContact O-N 3.09Å; A262-S266 WeakPolarHBondContact O-CB 3.5Å; A262-S266 PolarHBondContact O-N 3.37Å
263	L	95.8	Very high	95.6	Very high	100 Å²	100	91.9 Å²	91.9	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-66.9	-41.9	176	-179.2	61.3	0	0	0	111.9	T259 E260 A261 S266 Q267	T259-L263 VanDerWaalsContact O-CB 3.23Å; T259-L263 WeakPolarHBondContact O-CB 3.43Å; T259-L263 PolarHBondContact O-N 2.94Å; E260-L263 PolarHBondContact O-N 3.45Å; A261-L263 VanDerWaalsContact C-N 3.33Å; A261-L263 PolarHBondContact O-N 3.37Å; L263-S266 PolarHBondContact O-N 2.96Å; L263-Q267 HydrophobicContact CD1-CG 4.39Å; L263-Q267 WeakPolarHBondContact O-CB 3.29Å; L263-Q267 VanDerWaalsContact O-CG 3.29Å; L263-Q267 WeakPolarHBondContact O-CG 3.47Å; L263-Q267 PolarHBondContact O-N 3.02Å
264	S	95.9	Very high	95.7	Very high	54 Å²	54	94.2 Å²	94.2	38%	0.378	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-50	174.5	-166.7	0	0	0	0	111.2	E260 A261 S266 Q267 E268	E260-S264 PolarHBondContact O-N 3.39Å; A261-S264 PolarHBondContact O-N 2.75Å; S264-S266 VanDerWaalsContact C-N 3.31Å; S264-S266 PolarHBondContact O-N 3.33Å; S264-Q267 WeakPolarHBondContact O-CB 3.39Å; S264-Q267 PolarHBondContact O-N 3Å; S264-Q267 VanDerWaalsContact O-N 3.08Å; S264-E268 WeakPolarHBondContact O-CG 3.44Å; S264-E268 PolarHBondContact O-N 3.39Å; S264-E268 PolarHBondContact OG-OE1 3.45Å
265	S	96	Very high	95.7	Very high	74 Å²	74	93.4 Å²	93.4	52%	0.517	50%	0.5	S	S	.	.	H	α-helix	trans	-59.6	-40.1	179	-177.6	0	0	0	0	112.4	A261 E268 E269	A261-S265 PolarHBondContact O-N 3.32Å; A261-S265 VanDerWaalsContact O-N 3.08Å; S265-E268 PolarHBondContact O-N 3.08Å; S265-E269 PolarHBondContact O-N 2.9Å
266	S	93.6	Very high	95.7	Very high	59 Å²	59	93 Å²	93	41%	0.413	50%	0.502	S	S	.	.	H	α-helix	trans	-69.8	-34.7	175.3	-172.3	0	0	0	0	112.9	A262 L263 S264 E269 V270	A262-S266 WeakPolarHBondContact O-CB 3.5Å; A262-S266 PolarHBondContact O-N 3.37Å; L263-S266 PolarHBondContact O-N 2.96Å; S264-S266 VanDerWaalsContact C-N 3.31Å; S264-S266 PolarHBondContact O-N 3.33Å; S266-E269 PolarHBondContact O-N 3.08Å; S266-V270 WeakPolarHBondContact O-CB 3.29Å; S266-V270 VanDerWaalsContact O-CG2 3.29Å; S266-V270 WeakPolarHBondContact O-CG2 3.44Å; S266-V270 PolarHBondContact O-N 2.92Å
267	Q	95.9	Very high	95.8	Very high	114 Å²	114	90.8 Å²	90.8	53%	0.533	50%	0.499	S	S	.	.	H	α-helix	trans	-65.4	-42.2	173.3	-74.2	176.5	19.6	0	0	111.7	L263 S264 V270 V271	L263-Q267 HydrophobicContact CD1-CG 4.39Å; L263-Q267 WeakPolarHBondContact O-CB 3.29Å; L263-Q267 VanDerWaalsContact O-CG 3.29Å; L263-Q267 WeakPolarHBondContact O-CG 3.47Å; L263-Q267 PolarHBondContact O-N 3.02Å; S264-Q267 WeakPolarHBondContact O-CB 3.39Å; S264-Q267 PolarHBondContact O-N 3Å; S264-Q267 VanDerWaalsContact O-N 3.08Å; Q267-V270 PolarHBondContact O-N 3.37Å; Q267-V271 WeakPolarHBondContact O-CG2 3.48Å; Q267-V271 PolarHBondContact O-N 3.46Å
268	E	95.5	Very high	95.8	Very high	123 Å²	123	91.4 Å²	91.4	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-61.6	-43.8	174.5	-70.7	163.5	-137.6	0	0	111.7	S264 S265 V271 C272	S264-E268 WeakPolarHBondContact O-CG 3.44Å; S264-E268 PolarHBondContact O-N 3.39Å; S264-E268 PolarHBondContact OG-OE1 3.45Å; S265-E268 PolarHBondContact O-N 3.08Å; E268-V271 PolarHBondContact O-N 3.01Å; E268-C272 WeakPolarHBondContact O-CB 3.43Å; E268-C272 PolarHBondContact O-N 3.32Å
269	E	96.4	Very high	95.7	Very high	119 Å²	119	91.1 Å²	91.1	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-61	-46.2	173.9	-175.2	178.8	-155.4	0	0	111.8	S265 S266 V271 C272 L273	S265-E269 PolarHBondContact O-N 2.9Å; S266-E269 PolarHBondContact O-N 3.08Å; E269-V271 VanDerWaalsContact C-N 3.31Å; E269-V271 PolarHBondContact O-N 3.02Å; E269-C272 WeakPolarHBondContact O-CB 3.33Å; E269-C272 PolarHBondContact O-N 3.44Å; E269-L273 HydrophobicContact CG-CD1 3.89Å; E269-L273 HydrophobicContact CG-CG 4.29Å; E269-L273 WeakPolarHBondContact O-CB 3.48Å; E269-L273 WeakPolarHBondContact O-CG 3.47Å; E269-L273 PolarHBondContact O-N 3.18Å
270	V	96.3	Very high	95.8	Very high	59 Å²	59	92.7 Å²	92.7	36%	0.358	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-37	177.8	167.4	0	0	0	0	111.9	S266 Q267 R274	S266-V270 WeakPolarHBondContact O-CB 3.29Å; S266-V270 VanDerWaalsContact O-CG2 3.29Å; S266-V270 WeakPolarHBondContact O-CG2 3.44Å; S266-V270 PolarHBondContact O-N 2.92Å; Q267-V270 PolarHBondContact O-N 3.37Å; V270-R274 WeakPolarHBondContact O-CB 3.25Å; V270-R274 VanDerWaalsContact O-CG 3.25Å; V270-R274 WeakPolarHBondContact O-CG 3.45Å; V270-R274 PolarHBondContact O-N 2.85Å
271	V	96.8	Very high	95.7	Very high	75 Å²	75	91.7 Å²	91.7	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-67.2	-45.2	173.5	170.9	0	0	0	0	111	Q267 E268 E269 L273 R274 Q275	Q267-V271 WeakPolarHBondContact O-CG2 3.48Å; Q267-V271 PolarHBondContact O-N 3.46Å; E268-V271 PolarHBondContact O-N 3.01Å; E269-V271 VanDerWaalsContact C-N 3.31Å; E269-V271 PolarHBondContact O-N 3.02Å; V271-L273 VanDerWaalsContact C-N 3.35Å; V271-L273 PolarHBondContact O-N 2.94Å; V271-R274 PolarHBondContact O-N 3.36Å; V271-Q275 WeakPolarHBondContact O-CG 3.38Å; V271-Q275 PolarHBondContact O-N 3.08Å
272	C	96.4	Very high	95.7	Very high	54 Å²	54	92.4 Å²	92.4	37%	0.365	50%	0.5	S	S	.	.	H	α-helix	trans	-60.3	-42.4	176.8	-174.8	0	0	0	0	112.3	E268 E269 K276	E268-C272 WeakPolarHBondContact O-CB 3.43Å; E268-C272 PolarHBondContact O-N 3.32Å; E269-C272 WeakPolarHBondContact O-CB 3.33Å; E269-C272 PolarHBondContact O-N 3.44Å; C272-K276 WeakPolarHBondContact O-CG 3.26Å; C272-K276 PolarHBondContact O-N 2.83Å
273	L	96.1	Very high	95.7	Very high	86 Å²	86	93.5 Å²	93.5	45%	0.45	50%	0.497	S	S	.	.	H	α-helix	trans	-66.3	-43.7	177.2	-72.1	171.3	0	0	0	111.6	E269 V271 Q275 K276 T277	E269-L273 HydrophobicContact CG-CD1 3.89Å; E269-L273 HydrophobicContact CG-CG 4.29Å; E269-L273 WeakPolarHBondContact O-CB 3.48Å; E269-L273 WeakPolarHBondContact O-CG 3.47Å; E269-L273 PolarHBondContact O-N 3.18Å; V271-L273 VanDerWaalsContact C-N 3.35Å; V271-L273 PolarHBondContact O-N 2.94Å; L273-Q275 PolarHBondContact O-N 3.38Å; L273-K276 WeakPolarHBondContact O-CB 3.38Å; L273-K276 PolarHBondContact O-N 3.33Å; L273-T277 PolarHBondContact O-N 2.79Å; L273-T277 PolarHBondContact O-OG1 3.23Å; L273-T277 VanDerWaalsContact O-OG1 3.13Å
274	R	96.1	Very high	95.5	Very high	161 Å²	161	94.1 Å²	94.1	61%	0.608	50%	0.5	S	S	*	.	H	α-helix	trans	-59	-47.5	175.1	-75.2	172.3	-173.9	-168.5	3.6	112	V270 V271 K276 T277 E278	V270-R274 WeakPolarHBondContact O-CB 3.25Å; V270-R274 VanDerWaalsContact O-CG 3.25Å; V270-R274 WeakPolarHBondContact O-CG 3.45Å; V270-R274 PolarHBondContact O-N 2.85Å; V271-R274 PolarHBondContact O-N 3.36Å; R274-K276 VanDerWaalsContact C-N 3.3Å; R274-K276 PolarHBondContact O-N 3.02Å; R274-T277 PolarHBondContact O-N 3.23Å; R274-T277 VanDerWaalsContact O-N 3.11Å; R274-E278 WeakPolarHBondContact O-CG 3.34Å; R274-E278 PolarHBondContact O-N 3.14Å
275	Q	96.1	Very high	95.2	Very high	120 Å²	120	94.3 Å²	94.3	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-59.5	-39.3	176.4	-71.8	173.6	-7.2	0	0	112.2	V271 L273 A279	V271-Q275 WeakPolarHBondContact O-CG 3.38Å; V271-Q275 PolarHBondContact O-N 3.08Å; L273-Q275 PolarHBondContact O-N 3.38Å; Q275-A279 WeakPolarHBondContact O-CB 3.39Å; Q275-A279 PolarHBondContact O-N 2.82Å
276	K	96.3	Very high	95	Very high	125 Å²	125	97 Å²	97	54%	0.543	51%	0.51	S	S	.	.	H	α-helix	trans	-65.1	-42.3	173.1	-77.3	172.8	178.1	168.8	0	112.5	C272 L273 R274 Q280	C272-K276 WeakPolarHBondContact O-CG 3.26Å; C272-K276 PolarHBondContact O-N 2.83Å; L273-K276 WeakPolarHBondContact O-CB 3.38Å; L273-K276 PolarHBondContact O-N 3.33Å; R274-K276 VanDerWaalsContact C-N 3.3Å; R274-K276 PolarHBondContact O-N 3.02Å; K276-Q280 WeakPolarHBondContact O-CB 3.44Å; K276-Q280 VanDerWaalsContact O-CG 3.27Å; K276-Q280 WeakPolarHBondContact O-CG 3.49Å; K276-Q280 PolarHBondContact O-N 3.17Å
277	T	95.9	Very high	94.9	Very high	80 Å²	80	98.6 Å²	98.6	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-65.2	-43.5	176.7	-57.7	0	0	0	0	111.5	L273 R274 Q280 V281	L273-T277 PolarHBondContact O-N 2.79Å; L273-T277 PolarHBondContact O-OG1 3.23Å; L273-T277 VanDerWaalsContact O-OG1 3.13Å; R274-T277 PolarHBondContact O-N 3.23Å; R274-T277 VanDerWaalsContact O-N 3.11Å; T277-Q280 PolarHBondContact O-N 3.1Å; T277-V281 WeakPolarHBondContact O-CG2 3.35Å; T277-V281 PolarHBondContact O-N 3.11Å
278	E	95.5	Very high	94.6	Very high	127 Å²	127	94.7 Å²	94.7	59%	0.593	50%	0.501	S	S	*	.	H	α-helix	trans	-59.8	-48	175.7	-72.9	165.9	-166.1	0	0	111.2	R274 Q280 V281 T282	R274-E278 WeakPolarHBondContact O-CG 3.34Å; R274-E278 PolarHBondContact O-N 3.14Å; E278-Q280 VanDerWaalsContact C-N 3.33Å; E278-Q280 PolarHBondContact O-N 3.31Å; E278-V281 PolarHBondContact O-N 2.89Å; E278-T282 PolarHBondContact O-N 3.05Å; E278-T282 PolarHBondContact O-OG1 3.37Å
279	A	95.1	Very high	94.3	Very high	57 Å²	57	93.3 Å²	93.3	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-65	-31.8	176.4	0	0	0	0	0	113.7	Q275 T282 L283	Q275-A279 WeakPolarHBondContact O-CB 3.39Å; Q275-A279 PolarHBondContact O-N 2.82Å; A279-T282 WeakPolarHBondContact CA-OG1 3.26Å; A279-T282 PolarHBondContact O-OG1 3.13Å; A279-L283 VanDerWaalsContact O-CB 3.3Å; A279-L283 WeakPolarHBondContact O-CB 3.49Å; A279-L283 PolarHBondContact O-N 2.72Å; A279-L283 VanDerWaalsContact O-N 3.11Å
280	Q	94.9	Very high	94.1	Very high	121 Å²	121	96.7 Å²	96.7	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-69.8	-39.5	172.1	-78.5	174.9	-14.2	0	0	111.8	K276 T277 E278 L283 L284	K276-Q280 WeakPolarHBondContact O-CB 3.44Å; K276-Q280 VanDerWaalsContact O-CG 3.27Å; K276-Q280 WeakPolarHBondContact O-CG 3.49Å; K276-Q280 PolarHBondContact O-N 3.17Å; T277-Q280 PolarHBondContact O-N 3.1Å; E278-Q280 VanDerWaalsContact C-N 3.33Å; E278-Q280 PolarHBondContact O-N 3.31Å; Q280-L283 PolarHBondContact O-N 3.11Å; Q280-L284 WeakPolarHBondContact O-CB 3.11Å; Q280-L284 VanDerWaalsContact O-CG 3.25Å; Q280-L284 WeakPolarHBondContact O-CG 3.42Å; Q280-L284 PolarHBondContact O-N 3.14Å
281	V	95.2	Very high	93.7	Very high	92 Å²	92	98.5 Å²	98.5	56%	0.558	51%	0.512	S	S	*	.	H	α-helix	trans	-65.4	-42.3	177	168.7	0	0	0	0	111.3	T277 E278 L284 A285	T277-V281 WeakPolarHBondContact O-CG2 3.35Å; T277-V281 PolarHBondContact O-N 3.11Å; E278-V281 PolarHBondContact O-N 2.89Å; V281-L284 PolarHBondContact O-N 3.21Å; V281-A285 PolarHBondContact O-N 3.49Å; V281-A285 VanDerWaalsContact O-N 3.08Å
282	T	95.2	Very high	93.4	Very high	80 Å²	80	97.9 Å²	97.9	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-44	174.9	54.4	0	0	0	0	111.8	E278 A279 L284 A285 E286	E278-T282 PolarHBondContact O-N 3.05Å; E278-T282 PolarHBondContact O-OG1 3.37Å; A279-T282 WeakPolarHBondContact CA-OG1 3.26Å; A279-T282 PolarHBondContact O-OG1 3.13Å; T282-L284 VanDerWaalsContact C-N 3.34Å; T282-L284 PolarHBondContact O-N 3.02Å; T282-A285 WeakPolarHBondContact O-CB 3.26Å; T282-A285 PolarHBondContact O-N 3.08Å; T282-E286 WeakPolarHBondContact O-CG 3.39Å; T282-E286 PolarHBondContact O-N 3Å
283	L	95.3	Very high	93.1	Very high	83 Å²	83	97.1 Å²	97.1	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-38.9	177.3	179.9	62.4	0	0	0	112.5	A279 Q280 E286 Q287	A279-L283 VanDerWaalsContact O-CB 3.3Å; A279-L283 WeakPolarHBondContact O-CB 3.49Å; A279-L283 PolarHBondContact O-N 2.72Å; A279-L283 VanDerWaalsContact O-N 3.11Å; Q280-L283 PolarHBondContact O-N 3.11Å; L283-E286 PolarHBondContact O-N 2.75Å; L283-Q287 HydrophobicContact CD1-CG 4.43Å; L283-Q287 WeakPolarHBondContact O-CB 3.34Å; L283-Q287 VanDerWaalsContact O-CG 3.24Å; L283-Q287 WeakPolarHBondContact O-CG 3.26Å; L283-Q287 PolarHBondContact O-N 2.86Å
284	L	91.3	Very high	92.9	Very high	113 Å²	113	97.6 Å²	97.6	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-67.3	-35.6	175.7	-74.7	169.2	0	0	0	112.2	Q280 V281 T282 G288	Q280-L284 WeakPolarHBondContact O-CB 3.11Å; Q280-L284 VanDerWaalsContact O-CG 3.25Å; Q280-L284 WeakPolarHBondContact O-CG 3.42Å; Q280-L284 PolarHBondContact O-N 3.14Å; V281-L284 PolarHBondContact O-N 3.21Å; T282-L284 VanDerWaalsContact C-N 3.34Å; T282-L284 PolarHBondContact O-N 3.02Å; L284-G288 PolarHBondContact O-N 3.44Å
285	A	89.6	Confident	92.6	Very high	59 Å²	59	90.5 Å²	90.5	49%	0.488	48%	0.48	S	S	.	.	H	α-helix	trans	-65.6	-48.2	173.6	0	0	0	0	0	111.6	V281 T282 Q287 G288 D289	V281-A285 PolarHBondContact O-N 3.49Å; V281-A285 VanDerWaalsContact O-N 3.08Å; T282-A285 WeakPolarHBondContact O-CB 3.26Å; T282-A285 PolarHBondContact O-N 3.08Å; A285-Q287 VanDerWaalsContact C-N 3.32Å; A285-Q287 PolarHBondContact O-N 3.18Å; A285-G288 PolarHBondContact O-N 3.26Å; A285-G288 VanDerWaalsContact O-N 3.12Å; A285-D289 PolarHBondContact O-N 2.91Å
286	E	92.3	Very high	92.3	Very high	130 Å²	130	87.6 Å²	87.6	61%	0.607	47%	0.467	S	S	*	.	H	α-helix	trans	-58.3	-42	175.4	-71.1	174.6	-176.7	0	0	112.3	T282 L283 R290	T282-E286 WeakPolarHBondContact O-CG 3.39Å; T282-E286 PolarHBondContact O-N 3Å; L283-E286 PolarHBondContact O-N 2.75Å; E286-R290 WeakPolarHBondContact O-CB 3.37Å; E286-R290 PolarHBondContact O-N 2.92Å
287	Q	90.5	Very high	92.2	Very high	93 Å²	93	85.7 Å²	85.7	44%	0.435	46%	0.46	S	S	.	.	H	α-helix	trans	-65.4	-40.9	174.7	-73.5	176.9	13.7	0	0	112	L283 A285 R290 L291	L283-Q287 HydrophobicContact CD1-CG 4.43Å; L283-Q287 WeakPolarHBondContact O-CB 3.34Å; L283-Q287 VanDerWaalsContact O-CG 3.24Å; L283-Q287 WeakPolarHBondContact O-CG 3.26Å; L283-Q287 PolarHBondContact O-N 2.86Å; A285-Q287 VanDerWaalsContact C-N 3.32Å; A285-Q287 PolarHBondContact O-N 3.18Å; Q287-R290 PolarHBondContact O-N 3.41Å; Q287-L291 WeakPolarHBondContact O-CB 3.44Å; Q287-L291 VanDerWaalsContact O-CG 3.29Å; Q287-L291 WeakPolarHBondContact O-CG 3.37Å; Q287-L291 PolarHBondContact O-N 3.44Å
288	G	88.9	Confident	92.1	Very high	32 Å²	32	85.6 Å²	85.6	33%	0.33	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-38.8	176.7	0	0	0	0	0	113.7	L284 A285 Y292 R554	L284-G288 PolarHBondContact O-N 3.44Å; A285-G288 PolarHBondContact O-N 3.26Å; A285-G288 VanDerWaalsContact O-N 3.12Å; G288-Y292 WeakPolarHBondContact O-CB 3.5Å; G288-Y292 PolarHBondContact O-N 3.3Å; G288-Y292 VanDerWaalsContact O-N 3.1Å; G288-R554 PolarHBondContact O-NH2 2.91Å
289	D	89.3	Confident	91.9	Very high	93 Å²	93	80.4 Å²	80.4	50%	0.497	43%	0.426	S	S	.	.	H	α-helix	trans	-72	-37.6	173.3	-83	-26.3	0	0	0	112.7	A285 Y292 G293 R554	A285-D289 PolarHBondContact O-N 2.91Å; D289-Y292 PolarHBondContact O-N 3.18Å; D289-G293 PolarHBondContact O-N 2.92Å; D289-R554 IonicContact OD1-CZ 2.71Å; D289-R554 IonicContact OD1-NH1 2.79Å; D289-R554 PolarHBondContact OD1-NH1 2.81Å; D289-R554 IonicContact OD1-NH2 3.15Å; D289-R554 PolarHBondContact OD1-NH2 3.39Å
290	R	92.6	Very high	91.8	Very high	191 Å²	191	83.1 Å²	83.1	72%	0.721	42%	0.424	S	S	*	.	H	α-helix	trans	-63.5	-43.2	173.4	-174.7	176.2	179	-179.9	-0.6	112.2	E286 Q287 G293 L294	E286-R290 WeakPolarHBondContact O-CB 3.37Å; E286-R290 PolarHBondContact O-N 2.92Å; Q287-R290 PolarHBondContact O-N 3.41Å; R290-G293 PolarHBondContact O-N 3.06Å; R290-L294 HydrophobicContact CG-CD1 4.27Å; R290-L294 WeakPolarHBondContact O-CG 3.34Å; R290-L294 PolarHBondContact O-N 2.81Å
291	L	89.2	Confident	91.8	Very high	97 Å²	97	81.6 Å²	81.6	51%	0.508	42%	0.419	S	S	.	.	H	α-helix	trans	-62.7	-44.8	176.3	-74.8	169.9	0	0	0	111.4	Q287 G293 L294 E295	Q287-L291 WeakPolarHBondContact O-CB 3.44Å; Q287-L291 VanDerWaalsContact O-CG 3.29Å; Q287-L291 WeakPolarHBondContact O-CG 3.37Å; Q287-L291 PolarHBondContact O-N 3.44Å; L291-G293 PolarHBondContact O-N 3.03Å; L291-L294 PolarHBondContact O-N 3.12Å; L291-E295 PolarHBondContact O-N 3.3Å
292	Y	89.2	Confident	91.7	Very high	62 Å²	62	77.7 Å²	77.7	24%	0.243	39%	0.394	C	S	.	.	H	α-helix	trans	-60.7	-42.7	174.2	169.4	-103.2	0	0	0	112.6	G288 D289 L294 E295 M296 R554 L556	G288-Y292 WeakPolarHBondContact O-CB 3.5Å; G288-Y292 PolarHBondContact O-N 3.3Å; G288-Y292 VanDerWaalsContact O-N 3.1Å; D289-Y292 PolarHBondContact O-N 3.18Å; Y292-L294 VanDerWaalsContact C-N 3.34Å; Y292-L294 PolarHBondContact O-N 3.09Å; Y292-E295 PolarHBondContact O-N 3.07Å; Y292-M296 HydrophobicContact CD2-CG 4.03Å; Y292-M296 HydrophobicContact CE1-CG 4.04Å; Y292-M296 HydrophobicContact CE2-CG 3.47Å; Y292-M296 VanDerWaalsContact CE2-CG 3.47Å; Y292-M296 HydrophobicContact CE2-SD 3.85Å; Y292-M296 VanDerWaalsContact CZ-CG 3.47Å; Y292-M296 WeakPolarHBondContact O-CG 3.39Å; Y292-M296 PolarHBondContact O-N 3.5Å; Y292-R554 VanDerWaalsContact CG-CZ 3.45Å; Y292-L556 HydrophobicContact CE2-CD1 3.5Å; Y292-L556 WeakPolarHBondContact OH-CD1 3.47Å
293	G	90.4	Very high	91.6	Very high	38 Å²	38	74.4 Å²	74.4	39%	0.392	37%	0.374	S	S	.	.	H	α-helix	trans	-58.7	-44.2	174.9	0	0	0	0	0	112.5	D289 R290 L291 M296 E297	D289-G293 PolarHBondContact O-N 2.92Å; R290-G293 PolarHBondContact O-N 3.06Å; L291-G293 PolarHBondContact O-N 3.03Å; G293-M296 PolarHBondContact O-N 3.21Å; G293-E297 WeakPolarHBondContact O-CB 3.4Å; G293-E297 PolarHBondContact O-N 3.47Å
294	L	92.4	Very high	91.4	Very high	96 Å²	96	74.4 Å²	74.4	50%	0.503	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-38.8	176.7	-70.2	168.9	0	0	0	112.8	R290 L291 Y292 E297 R298	R290-L294 HydrophobicContact CG-CD1 4.27Å; R290-L294 WeakPolarHBondContact O-CG 3.34Å; R290-L294 PolarHBondContact O-N 2.81Å; L291-L294 PolarHBondContact O-N 3.12Å; Y292-L294 VanDerWaalsContact C-N 3.34Å; Y292-L294 PolarHBondContact O-N 3.09Å; L294-E297 PolarHBondContact O-N 2.98Å; L294-R298 WeakPolarHBondContact O-CB 3.43Å; L294-R298 PolarHBondContact O-N 2.98Å
295	E	89.9	Confident	91.4	Very high	11 Å²	11	72.7 Å²	72.7	5%	0.051	36%	0.363	C	S	.	.	H	α-helix	trans	-66.8	-40.7	175	167.5	59.1	-176.8	0	0	111.9	L291 Y292 E297 R298 R299 M449	L291-E295 PolarHBondContact O-N 3.3Å; Y292-E295 PolarHBondContact O-N 3.07Å; E295-E297 VanDerWaalsContact C-N 3.32Å; E295-E297 PolarHBondContact O-N 2.78Å; E295-R298 WeakPolarHBondContact O-CB 3.32Å; E295-R298 PolarHBondContact O-N 2.73Å; E295-R298 IonicContact OE1-CZ 3.19Å; E295-R298 IonicContact OE1-NE 3.76Å; E295-R298 IonicContact OE1-NH2 3.21Å; E295-R298 PolarHBondContact OE1-NH2 2.96Å; E295-R298 IonicContact OE2-CZ 2.75Å; E295-R298 IonicContact OE2-NE 2.78Å; E295-R298 PolarHBondContact OE2-NE 3.48Å; E295-R298 IonicContact OE2-NH2 2.7Å; E295-R298 PolarHBondContact OE2-NH2 2.96Å; E295-R299 WeakPolarHBondContact O-CG 3.48Å; E295-R299 PolarHBondContact O-N 2.74Å; E295-R299 IonicContact OE1-CZ 3.29Å; E295-R299 IonicContact OE1-NE 3.25Å; E295-R299 PolarHBondContact OE1-NE 2.97Å; E295-R299 IonicContact OE1-NH2 2.73Å; E295-R299 PolarHBondContact OE1-NH2 2.81Å; E295-M449 HydrophobicContact CG-CE 3.73Å; E295-M449 VanDerWaalsContact OE1-CE 3.29Å; E295-M449 WeakPolarHBondContact OE1-CE 3.45Å
296	M	90.1	Very high	91.4	Very high	59 Å²	59	70 Å²	70	29%	0.291	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-33.9	175.5	-69.2	-56.4	-62.4	0	0	112.2	Y292 G293 R300	Y292-M296 HydrophobicContact CD2-CG 4.03Å; Y292-M296 HydrophobicContact CE1-CG 4.04Å; Y292-M296 HydrophobicContact CE2-CG 3.47Å; Y292-M296 VanDerWaalsContact CE2-CG 3.47Å; Y292-M296 HydrophobicContact CE2-SD 3.85Å; Y292-M296 VanDerWaalsContact CZ-CG 3.47Å; Y292-M296 WeakPolarHBondContact O-CG 3.39Å; Y292-M296 PolarHBondContact O-N 3.5Å; G293-M296 PolarHBondContact O-N 3.21Å; M296-R300 WeakPolarHBondContact O-CB 3.27Å; M296-R300 PolarHBondContact O-N 2.83Å; M296-R300 VanDerWaalsContact O-N 3.14Å
297	E	93.6	Very high	91.2	Very high	86 Å²	86	65.6 Å²	65.6	40%	0.402	32%	0.319	S	S	.	.	H	α-helix	trans	-68	-42.1	169.2	179.3	136.5	-103.5	0	0	112	G293 L294 E295 R299 R300 L301	G293-E297 WeakPolarHBondContact O-CB 3.4Å; G293-E297 PolarHBondContact O-N 3.47Å; L294-E297 PolarHBondContact O-N 2.98Å; E295-E297 VanDerWaalsContact C-N 3.32Å; E295-E297 PolarHBondContact O-N 2.78Å; E297-R299 PolarHBondContact O-N 2.96Å; E297-R300 WeakPolarHBondContact O-CB 3.35Å; E297-R300 PolarHBondContact O-N 2.83Å; E297-R300 VanDerWaalsContact O-N 3.15Å; E297-R300 IonicContact OE1-CZ 3.89Å; E297-R300 IonicContact OE1-NE 2.69Å; E297-R300 IonicContact OE1-NH2 3.19Å; E297-R300 PolarHBondContact OE1-NH2 2.81Å; E297-L301 HydrophobicContact CG-CD1 3.68Å; E297-L301 HydrophobicContact CG-CG 4.09Å; E297-L301 WeakPolarHBondContact O-CB 3.42Å; E297-L301 WeakPolarHBondContact O-CG 3.37Å; E297-L301 PolarHBondContact O-N 2.62Å
298	R	93.7	Very high	91.1	Very high	78 Å²	78	68.8 Å²	68.8	29%	0.294	34%	0.339	S	S	.	.	H	α-helix	trans	-56.5	-50.2	173.7	-172.2	-155.7	58.9	73.3	-2.2	110.7	L294 E295 R300 L301 H302 D401	L294-R298 WeakPolarHBondContact O-CB 3.43Å; L294-R298 PolarHBondContact O-N 2.98Å; E295-R298 WeakPolarHBondContact O-CB 3.32Å; E295-R298 PolarHBondContact O-N 2.73Å; E295-R298 IonicContact OE1-CZ 3.19Å; E295-R298 IonicContact OE1-NE 3.76Å; E295-R298 IonicContact OE1-NH2 3.21Å; E295-R298 PolarHBondContact OE1-NH2 2.96Å; E295-R298 IonicContact OE2-CZ 2.75Å; E295-R298 IonicContact OE2-NE 2.78Å; E295-R298 PolarHBondContact OE2-NE 3.48Å; E295-R298 IonicContact OE2-NH2 2.7Å; E295-R298 PolarHBondContact OE2-NH2 2.96Å; R298-R300 VanDerWaalsContact C-N 3.29Å; R298-R300 PolarHBondContact O-N 3.22Å; R298-L301 PolarHBondContact O-N 2.91Å; R298-H302 WeakPolarHBondContact O-CB 3.39Å; R298-H302 PolarHBondContact O-N 2.94Å; R298-D401 IonicContact CZ-OD1 3.17Å; R298-D401 IonicContact CZ-OD2 2.73Å; R298-D401 IonicContact NH1-OD1 3.05Å; R298-D401 PolarHBondContact NH1-OD1 2.9Å; R298-D401 IonicContact NH1-OD2 2.8Å; R298-D401 PolarHBondContact NH1-OD2 2.63Å; R298-D401 IonicContact NH2-OD1 3.65Å; R298-D401 PolarHBondContact NH2-OD1 3.42Å; R298-D401 IonicContact NH2-OD2 2.82Å; R298-D401 PolarHBondContact NH2-OD2 2.95Å
299	R	91.9	Very high	91	Very high	17 Å²	17	72.6 Å²	72.6	6%	0.064	35%	0.346	C	S	.	.	H	α-helix	trans	-57.8	-39.6	176.6	-69.6	-176.4	-168.9	-146.6	-3.8	112.5	E295 E297 N303 D401 Y456 C558	E295-R299 WeakPolarHBondContact O-CG 3.48Å; E295-R299 PolarHBondContact O-N 2.74Å; E295-R299 IonicContact OE1-CZ 3.29Å; E295-R299 IonicContact OE1-NE 3.25Å; E295-R299 PolarHBondContact OE1-NE 2.97Å; E295-R299 IonicContact OE1-NH2 2.73Å; E295-R299 PolarHBondContact OE1-NH2 2.81Å; E297-R299 PolarHBondContact O-N 2.96Å; R299-N303 WeakPolarHBondContact O-CB 3.38Å; R299-N303 PolarHBondContact O-N 2.82Å; R299-N303 VanDerWaalsContact O-N 3.08Å; R299-D401 HydrophobicContact CG-CB 4.29Å; R299-Y456 PolarHBondContact NH2-OH 3.17Å; R299-Y456 VanDerWaalsContact NH2-OH 3.09Å; R299-C558 PolarHBondContact NH1-SG 3.29Å; R299-C558 VanDerWaalsContact NH1-SG 3.41Å
300	R	92.1	Very high	90.9	Very high	115 Å²	115	69.2 Å²	69.2	43%	0.434	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-54.3	176.7	-178.9	-174.9	71.4	83.9	-14.5	111.4	M296 E297 R298 N303 Q304	M296-R300 WeakPolarHBondContact O-CB 3.27Å; M296-R300 PolarHBondContact O-N 2.83Å; M296-R300 VanDerWaalsContact O-N 3.14Å; E297-R300 WeakPolarHBondContact O-CB 3.35Å; E297-R300 PolarHBondContact O-N 2.83Å; E297-R300 VanDerWaalsContact O-N 3.15Å; E297-R300 IonicContact OE1-CZ 3.89Å; E297-R300 IonicContact OE1-NE 2.69Å; E297-R300 IonicContact OE1-NH2 3.19Å; E297-R300 PolarHBondContact OE1-NH2 2.81Å; R298-R300 VanDerWaalsContact C-N 3.29Å; R298-R300 PolarHBondContact O-N 3.22Å; R300-N303 PolarHBondContact O-N 2.77Å; R300-Q304 WeakPolarHBondContact O-CG 3.43Å; R300-Q304 PolarHBondContact O-N 2.87Å
301	L	94.8	Very high	90.6	Very high	88 Å²	88	60.4 Å²	60.4	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-38.7	-178	-69	175.2	0	0	0	111.8	E297 R298 Q304 L305	E297-L301 HydrophobicContact CG-CD1 3.68Å; E297-L301 HydrophobicContact CG-CG 4.09Å; E297-L301 WeakPolarHBondContact O-CB 3.42Å; E297-L301 WeakPolarHBondContact O-CG 3.37Å; E297-L301 PolarHBondContact O-N 2.62Å; R298-L301 PolarHBondContact O-N 2.91Å; L301-Q304 PolarHBondContact O-N 3.07Å; L301-L305 WeakPolarHBondContact O-CB 3.5Å; L301-L305 PolarHBondContact O-N 3.19Å
302	H	93.6	Very high	90.6	Very high	10 Å²	10	56.4 Å²	56.4	5%	0.046	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-49.9	173.4	-175.9	84.1	0	0	0	111.1	R298 Q304 L305 Q306 M394 Q397 S398 D401	R298-H302 WeakPolarHBondContact O-CB 3.39Å; R298-H302 PolarHBondContact O-N 2.94Å; H302-Q304 PolarHBondContact O-N 3.44Å; H302-L305 PolarHBondContact O-N 2.83Å; H302-Q306 VanDerWaalsContact O-CG 3.3Å; H302-Q306 WeakPolarHBondContact O-CG 3.32Å; H302-Q306 PolarHBondContact O-N 3.32Å; H302-M394 WeakPolarHBondContact CE1-CA 3.25Å; H302-M394 WeakPolarHBondContact CE1-CB 3.24Å; H302-M394 WeakPolarHBondContact CE1-CE 3.4Å; H302-M394 PolarHBondContact CE1-O 3.44Å; H302-M394 PolarHBondContact CE1-SD 3.11Å; H302-M394 VanDerWaalsContact ND1-CE 3.27Å; H302-M394 WeakPolarHBondContact ND1-CE 3.4Å; H302-M394 PolarHBondContact NE2-O 2.86Å; H302-Q397 VanDerWaalsContact CE1-CB 3.49Å; H302-Q397 WeakPolarHBondContact CE1-CB 3.47Å; H302-S398 WeakPolarHBondContact NE2-CA 3.46Å; H302-S398 WeakPolarHBondContact NE2-CB 3.23Å; H302-S398 PolarHBondContact NE2-N 3.35Å; H302-S398 PolarHBondContact NE2-OG 3.5Å; H302-D401 IonicContact CD2-OD2 3.62Å; H302-D401 PolarHBondContact CD2-OD2 2.88Å; H302-D401 VanDerWaalsContact CD2-OD2 3.25Å; H302-D401 IonicContact CG-OD2 3.99Å
303	N	91.9	Very high	90.8	Very high	11 Å²	11	54.2 Å²	54.2	6%	0.059	27%	0.271	C	S	.	.	H	α-helix	trans	-60.6	-44.9	176	-174.7	68.6	0	0	0	112.2	R299 R300 L305 Q306 E307 Y403 K634	R299-N303 WeakPolarHBondContact O-CB 3.38Å; R299-N303 PolarHBondContact O-N 2.82Å; R299-N303 VanDerWaalsContact O-N 3.08Å; R300-N303 PolarHBondContact O-N 2.77Å; N303-L305 VanDerWaalsContact C-N 3.32Å; N303-L305 PolarHBondContact O-N 2.81Å; N303-Q306 PolarHBondContact O-N 3.41Å; N303-Q306 VanDerWaalsContact O-N 3.15Å; N303-E307 PolarHBondContact ND2-OE1 2.92Å; N303-E307 WeakPolarHBondContact O-CG 3.46Å; N303-E307 PolarHBondContact O-N 3.47Å; N303-Y403 HydrophobicContact CB-CE1 4.41Å; N303-Y403 HydrophobicContact CB-CE2 3.94Å; N303-Y403 WeakPolarHBondContact CB-OH 3.49Å; N303-Y403 WeakPolarHBondContact OD1-CE1 3.41Å; N303-K634 WeakPolarHBondContact OD1-CE 3.43Å; N303-K634 PolarHBondContact OD1-NZ 3.04Å
304	Q	91.1	Very high	91	Very high	83 Å²	83	52.4 Å²	52.4	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-61.9	-39	178.2	-72.1	179.7	-54.3	0	0	112.2	R300 L301 H302 E307 L308	R300-Q304 WeakPolarHBondContact O-CG 3.43Å; R300-Q304 PolarHBondContact O-N 2.87Å; L301-Q304 PolarHBondContact O-N 3.07Å; H302-Q304 PolarHBondContact O-N 3.44Å; Q304-E307 PolarHBondContact O-N 3.18Å; Q304-L308 WeakPolarHBondContact O-CB 3.3Å; Q304-L308 VanDerWaalsContact O-CG 3.24Å; Q304-L308 WeakPolarHBondContact O-CG 3.26Å; Q304-L308 PolarHBondContact O-N 2.89Å
305	L	91.8	Very high	91.2	Very high	77 Å²	77	48.3 Å²	48.3	40%	0.403	23%	0.231	S	C	.	.	H	α-helix	trans	-63.5	-41.3	173.5	-175.2	156.2	0	0	0	111.6	L301 H302 N303 L308 K309	L301-L305 WeakPolarHBondContact O-CB 3.5Å; L301-L305 PolarHBondContact O-N 3.19Å; H302-L305 PolarHBondContact O-N 2.83Å; N303-L305 VanDerWaalsContact C-N 3.32Å; N303-L305 PolarHBondContact O-N 2.81Å; L305-L308 PolarHBondContact O-N 2.86Å; L305-K309 HydrophobicContact CD2-CD 4.15Å; L305-K309 HydrophobicContact CD2-CG 4.4Å; L305-K309 WeakPolarHBondContact O-CB 3.48Å; L305-K309 PolarHBondContact O-N 3.41Å
306	Q	90.9	Very high	91.5	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-67.1	-38.2	176	-64	-66.1	-17.5	0	0	112.3	H302 N303 K309 G310 R313 M394 K634	H302-Q306 VanDerWaalsContact O-CG 3.3Å; H302-Q306 WeakPolarHBondContact O-CG 3.32Å; H302-Q306 PolarHBondContact O-N 3.32Å; N303-Q306 PolarHBondContact O-N 3.41Å; N303-Q306 VanDerWaalsContact O-N 3.15Å; Q306-K309 CarbonylContact O-C 3.57Å; Q306-K309 PolarHBondContact O-N 3.49Å; Q306-G310 CarbonylContact O-C 3.52Å; Q306-G310 PolarHBondContact O-N 3.33Å; Q306-G310 VanDerWaalsContact O-O 3.08Å; Q306-R313 PolarHBondContact O-NH2 2.86Å; Q306-R313 VanDerWaalsContact OE1-CZ 3.27Å; Q306-M394 PolarHBondContact NE2-O 3Å; Q306-K634 HydrophobicContact CB-CD 3.97Å; Q306-K634 VanDerWaalsContact CB-CE 3.43Å; Q306-K634 HydrophobicContact CG-CD 4.28Å
307	E	87.3	Confident	91.9	Very high	38 Å²	38	45.6 Å²	45.6	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-39.6	175.3	-73	177.5	174	0	0	112.1	N303 Q304 K309 G310 A669	N303-E307 PolarHBondContact ND2-OE1 2.92Å; N303-E307 WeakPolarHBondContact O-CG 3.46Å; N303-E307 PolarHBondContact O-N 3.47Å; Q304-E307 PolarHBondContact O-N 3.18Å; E307-K309 VanDerWaalsContact C-N 3.33Å; E307-G310 WeakPolarHBondContact O-CA 3.47Å; E307-G310 PolarHBondContact O-N 2.95Å; E307-A669 WeakPolarHBondContact OE1-CA 3.41Å; E307-A669 WeakPolarHBondContact OE1-CB 3.44Å; E307-A669 PolarHBondContact OE1-N 2.92Å; E307-A669 VanDerWaalsContact OE1-O 3.12Å
308	L	88.4	Confident	92	Very high	160 Å²	160	41.6 Å²	41.6	84%	0.838	20%	0.198	S	C	*	.	H	α-helix	trans	-67.1	-31.9	174.1	-72.1	169.1	0	0	0	112.6	Q304 L305 G310	Q304-L308 WeakPolarHBondContact O-CB 3.3Å; Q304-L308 VanDerWaalsContact O-CG 3.24Å; Q304-L308 WeakPolarHBondContact O-CG 3.26Å; Q304-L308 PolarHBondContact O-N 2.89Å; L305-L308 PolarHBondContact O-N 2.86Å; L308-G310 PolarHBondContact O-N 3.49Å
309	K	87.5	Confident	92.1	Very high	112 Å²	112	39.1 Å²	39.1	49%	0.487	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	4.1	166.7	-76.1	-164.4	171.5	-162.5	0	113.4	L305 Q306 E307 R313	L305-K309 HydrophobicContact CD2-CD 4.15Å; L305-K309 HydrophobicContact CD2-CG 4.4Å; L305-K309 WeakPolarHBondContact O-CB 3.48Å; L305-K309 PolarHBondContact O-N 3.41Å; Q306-K309 CarbonylContact O-C 3.57Å; Q306-K309 PolarHBondContact O-N 3.49Å; E307-K309 VanDerWaalsContact C-N 3.33Å; K309-R313 VanDerWaalsContact O-CD 3.29Å; K309-R313 WeakPolarHBondContact O-CD 3.48Å; K309-R313 WeakPolarHBondContact O-CG 3.42Å; K309-R313 PolarHBondContact O-NE 3.11Å
310	G	86.4	Confident	92.1	Very high	23 Å²	23	41.6 Å²	41.6	24%	0.237	21%	0.207	C	C	.	.			trans	81.7	140.8	-175.9	0	0	0	0	0	113.9	Q306 E307 L308 R313	Q306-G310 CarbonylContact O-C 3.52Å; Q306-G310 PolarHBondContact O-N 3.33Å; Q306-G310 VanDerWaalsContact O-O 3.08Å; E307-G310 WeakPolarHBondContact O-CA 3.47Å; E307-G310 PolarHBondContact O-N 2.95Å; L308-G310 PolarHBondContact O-N 3.49Å; G310-R313 PolarHBondContact O-NE 3.02Å; G310-R313 PolarHBondContact O-NH2 3.12Å
311	N	86.4	Confident	92.1	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.027	20%	0.202	C	C	.	.	S	Bend	trans	-83	-20.5	176.9	-76.9	-32.3	0	0	0	113.5	M635 G667	N311-M635 PolarHBondContact O-N 2.81Å; N311-G667 PolarHBondContact ND2-O 3.42Å
312	I	89.1	Confident	91.9	Very high	14 Å²	14	39.1 Å²	39.1	7%	0.072	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.1	159.2	-65.5	177.8	0	0	0	106.7	I604 M635 V661 C664 I666	I312-I604 HydrophobicContact CD1-CG2 3.89Å; I312-M635 CarbonylContact C-O 3.45Å; I312-M635 WeakPolarHBondContact CA-O 3.32Å; I312-M635 HydrophobicContact CD1-SD 4.49Å; I312-M635 HydrophobicContact CG1-CB 4.19Å; I312-M635 HydrophobicContact CG1-CE 4.45Å; I312-M635 HydrophobicContact CG1-SD 4.29Å; I312-V661 HydrophobicContact CG2-CG1 3.77Å; I312-C664 HydrophobicContact CD1-CB 3.92Å; I312-C664 WeakPolarHBondContact CD1-O 3.31Å; I312-I666 HydrophobicContact CD1-CD1 3.54Å; I312-I666 HydrophobicContact CD1-CG1 3.71Å; I312-I666 HydrophobicContact CG1-CD1 3.84Å; I312-I666 HydrophobicContact CG1-CG1 4.13Å
313	R	92.7	Very high	91.5	Very high	15 Å²	15	48.4 Å²	48.4	6%	0.057	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.7	167.9	-74.7	172.4	-129.3	151.6	5.7	111.7	Q306 K309 G310 D376 M635 L636 M637	Q306-R313 PolarHBondContact O-NH2 2.86Å; Q306-R313 VanDerWaalsContact OE1-CZ 3.27Å; K309-R313 VanDerWaalsContact O-CD 3.29Å; K309-R313 WeakPolarHBondContact O-CD 3.48Å; K309-R313 WeakPolarHBondContact O-CG 3.42Å; K309-R313 PolarHBondContact O-NE 3.11Å; G310-R313 PolarHBondContact O-NE 3.02Å; G310-R313 PolarHBondContact O-NH2 3.12Å; R313-D376 WeakPolarHBondContact CA-OD2 3.39Å; R313-D376 VanDerWaalsContact CB-OD2 3.25Å; R313-D376 WeakPolarHBondContact CB-OD2 3.4Å; R313-D376 WeakPolarHBondContact CG-OD2 3.5Å; R313-M635 PolarHBondContact N-O 2.93Å; R313-L636 HydrophobicContact CB-CD1 3.74Å; R313-L636 WeakPolarHBondContact O-CA 3.12Å; R313-M637 PolarHBondContact O-N 3.44Å
314	V	94.6	Very high	91.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	118.6	176.1	-175.8	0	0	0	0	109.7	F375 D376 M637 V639 A658 V661 N662	V314-F375 HydrophobicContact CB-CD1 4.04Å; V314-F375 HydrophobicContact CG1-CD1 3.51Å; V314-F375 HydrophobicContact CG1-CE1 3.79Å; V314-F375 WeakPolarHBondContact O-CB 3.48Å; V314-D376 PolarHBondContact N-OD2 3.29Å; V314-D376 PolarHBondContact O-N 3.33Å; V314-D376 VanDerWaalsContact O-N 3.16Å; V314-M637 CarbonylContact C-O 3.48Å; V314-M637 WeakPolarHBondContact CA-O 3.3Å; V314-M637 HydrophobicContact CG1-CE 4.14Å; V314-M637 HydrophobicContact CG2-CE 4.16Å; V314-V639 HydrophobicContact CG1-CG1 4.32Å; V314-A658 HydrophobicContact CG1-CB 3.87Å; V314-V661 HydrophobicContact CG2-CB 3.97Å; V314-V661 HydrophobicContact CG2-CG1 3.63Å; V314-N662 HydrophobicContact CB-CB 4.05Å; V314-N662 HydrophobicContact CG2-CB 3.88Å
315	F	97	Very high	91	Very high	11 Å²	11	50.9 Å²	50.9	5%	0.048	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.5	175.1	-73.5	2.8	0	0	0	109.2	D376 R377 F379 E391 I392 L636 M637 F638 V639	F315-D376 HydrophobicContact CD1-CB 3.94Å; F315-D376 HydrophobicContact CE1-CB 3.74Å; F315-R377 CarbonylContact C-O 3.59Å; F315-R377 WeakPolarHBondContact CA-O 3.25Å; F315-R377 HydrophobicContact CD1-CB 3.54Å; F315-R377 HydrophobicContact CD2-CB 4.37Å; F315-R377 HydrophobicContact CE1-CB 3.66Å; F315-R377 HydrophobicContact CE2-CB 4.44Å; F315-R377 HydrophobicContact CG-CB 3.92Å; F315-R377 HydrophobicContact CZ-CB 4.11Å; F315-F379 HydrophobicContact CB-CE2 4.1Å; F315-F379 AromaticContact CD2-CE2 3.65Å; F315-F379 HydrophobicContact CD2-CE2 3.65Å; F315-F379 HydrophobicContact CD2-CZ 4.17Å; F315-F379 HydrophobicContact CE2-CE2 4.3Å; F315-F379 HydrophobicContact CE2-CZ 4.4Å; F315-F379 HydrophobicContact CG-CE2 4.08Å; F315-E391 HydrophobicContact CE2-CB 3.97Å; F315-E391 HydrophobicContact CZ-CB 4.4Å; F315-I392 HydrophobicContact CD2-CG2 4.19Å; F315-I392 HydrophobicContact CE2-CG2 3.66Å; F315-L636 HydrophobicContact CB-CD1 4.18Å; F315-L636 HydrophobicContact CD1-CD1 3.73Å; F315-L636 HydrophobicContact CD2-CD1 3.89Å; F315-L636 HydrophobicContact CD2-CD2 4.02Å; F315-L636 HydrophobicContact CE1-CD1 4.08Å; F315-L636 HydrophobicContact CE2-CD1 4.25Å; F315-L636 HydrophobicContact CE2-CD2 4.09Å; F315-L636 HydrophobicContact CG-CD1 3.65Å; F315-L636 HydrophobicContact CZ-CD1 4.34Å; F315-M637 PolarHBondContact N-O 3.29Å; F315-F638 HydrophobicContact CB-CD1 3.82Å; F315-F638 HydrophobicContact CB-CE1 3.82Å; F315-F638 HydrophobicContact CB-CG 4.47Å; F315-F638 HydrophobicContact CB-CZ 4.47Å; F315-F638 AromaticContact CD2-CE1 3.72Å; F315-F638 HydrophobicContact CD2-CE1 3.72Å; F315-F638 HydrophobicContact CD2-CE2 4.49Å; F315-F638 AromaticContact CD2-CZ 3.72Å; F315-F638 HydrophobicContact CD2-CZ 3.72Å; F315-F638 HydrophobicContact CG-CE1 4.3Å; F315-F638 CarbonylContact O-C 3.55Å; F315-F638 VanDerWaalsContact O-CA 3.25Å; F315-F638 WeakPolarHBondContact O-CA 3.34Å; F315-V639 PolarHBondContact O-N 3.12Å
316	C	97.6	Very high	90.7	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.1	172.9	-178.3	0	0	0	0	110.4	F375 R377 V378 F379 V639	C316-F375 HydrophobicContact CB-CD2 3.6Å; C316-F375 HydrophobicContact CB-CE2 3.91Å; C316-F375 HydrophobicContact CB-CG 4.13Å; C316-R377 PolarHBondContact N-O 2.73Å; C316-V378 HydrophobicContact CB-CG1 4.27Å; C316-V378 HydrophobicContact CB-CG2 4.13Å; C316-V378 CarbonylContact O-C 3.44Å; C316-V378 WeakPolarHBondContact O-CA 3.47Å; C316-F379 PolarHBondContact O-N 3.21Å; C316-V639 HydrophobicContact CB-CG1 3.74Å
317	R	97.6	Very high	90.4	Very high	13 Å²	13	57.8 Å²	57.8	5%	0.049	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	113.6	176.1	-173.5	177.4	-168.1	-171.4	11.7	111	F379 S383 Q385 T420 F638 V639 N640 I641	R317-F379 HydrophobicContact CB-CB 4.28Å; R317-F379 HydrophobicContact CG-CB 4.05Å; R317-S383 PolarHBondContact NH2-O 2.7Å; R317-Q385 VanDerWaalsContact CZ-OE1 3.25Å; R317-T420 PolarHBondContact NH1-OG1 3.47Å; R317-F638 HydrophobicContact CB-CD1 4.47Å; R317-V639 PolarHBondContact N-O 2.9Å; R317-N640 WeakPolarHBondContact O-CA 3.48Å; R317-I641 PolarHBondContact O-N 2.88Å
318	V	96.4	Very high	90.2	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	129.4	171.3	-169.7	0	0	0	0	108.1	L333 F335 L349 F379 P381 I641 P643	V318-L333 HydrophobicContact CG1-CD1 4.19Å; V318-F335 HydrophobicContact CB-CE1 4.49Å; V318-F335 HydrophobicContact CB-CZ 4.22Å; V318-F335 HydrophobicContact CG2-CE1 3.79Å; V318-F335 HydrophobicContact CG2-CZ 3.82Å; V318-L349 HydrophobicContact CG2-CD2 4.38Å; V318-F379 PolarHBondContact N-O 2.99Å; V318-P381 HydrophobicContact CB-CG 4.22Å; V318-P381 HydrophobicContact CG1-CG 3.93Å; V318-P381 WeakPolarHBondContact O-CA 3.33Å; V318-I641 HydrophobicContact CG2-CB 4.26Å; V318-I641 HydrophobicContact CG2-CG2 4.37Å; V318-P643 HydrophobicContact CG1-CB 4.13Å
319	R	94.7	Very high	90	Very high	25 Å²	25	53 Å²	53	9%	0.094	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-78.8	160.8	177.9	66.8	160.4	176.6	85.1	-11.9	112.3	E325 G414 I641 P643	R319-E325 IonicContact CZ-OE1 3.49Å; R319-E325 IonicContact CZ-OE2 3.54Å; R319-E325 IonicContact NH1-OE1 2.7Å; R319-E325 PolarHBondContact NH1-OE1 3.36Å; R319-E325 IonicContact NH1-OE2 3.36Å; R319-E325 PolarHBondContact NH1-OE2 2.99Å; R319-E325 IonicContact NH2-OE1 3.43Å; R319-E325 PolarHBondContact NH2-OE1 3.34Å; R319-E325 IonicContact NH2-OE2 3.84Å; R319-E325 PolarHBondContact NH2-OE2 3.41Å; R319-G414 PolarHBondContact NE-O 2.94Å; R319-I641 PolarHBondContact N-O 3.39Å; R319-P643 HydrophobicContact CG-CG 4.37Å
320	P	93.1	Very high	89.6	Confident	69 Å²	69	54.4 Å²	54.4	45%	0.448	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-51.1	149.5	161.4	-24.6	32.3	0	0	0	112.7	P381	P320-P381 WeakPolarHBondContact CG-O 3.47Å
321	V	91.6	Very high	89.4	Confident	55 Å²	55	55 Å²	55	33%	0.333	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-67.1	134.1	158.9	-178	0	0	0	0	107.3	E325 P643 L644	V321-E325 HydrophobicContact CG1-CB 3.81Å; V321-P643 HydrophobicContact CB-CG 4.45Å; V321-P643 HydrophobicContact CG2-CB 3.92Å; V321-P643 HydrophobicContact CG2-CG 3.73Å; V321-L644 HydrophobicContact CG1-CD2 4.32Å
322	L	89.4	Confident	89.4	Confident	97 Å²	97	55.1 Å²	55.1	51%	0.508	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-92.7	161	-178.1	-58.1	173.2	0	0	0	111.3	G324 E325	L322-G324 PolarHBondContact O-N 2.96Å; L322-E325 HydrophobicContact CB-CG 4.05Å; L322-E325 PolarHBondContact N-OE2 3.11Å; L322-E325 WeakPolarHBondContact O-CB 3.37Å; L322-E325 PolarHBondContact O-N 2.7Å; L322-E325 VanDerWaalsContact O-N 3.08Å
323	E	86.3	Confident	89.4	Confident	204 Å²	204	55.9 Å²	55.9	95%	0.953	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	126.9	175.2	-63.9	-174.1	164.5	0	0	111
324	G	83.8	Confident	89.4	Confident	90 Å²	90	57.8 Å²	57.8	93%	0.928	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	-3.1	-176.6	0	0	0	0	0	115.4	L322	L322-G324 PolarHBondContact O-N 2.96Å
325	E	89.1	Confident	89.3	Confident	56 Å²	56	60.6 Å²	60.6	26%	0.262	37%	0.373	S	S	.	.	S	Bend	trans	-88.1	147.6	172.4	-61.4	-177.2	152.5	0	0	112.3	R319 V321 L322 T327 L644	R319-E325 IonicContact CZ-OE1 3.49Å; R319-E325 IonicContact CZ-OE2 3.54Å; R319-E325 IonicContact NH1-OE1 2.7Å; R319-E325 PolarHBondContact NH1-OE1 3.36Å; R319-E325 IonicContact NH1-OE2 3.36Å; R319-E325 PolarHBondContact NH1-OE2 2.99Å; R319-E325 IonicContact NH2-OE1 3.43Å; R319-E325 PolarHBondContact NH2-OE1 3.34Å; R319-E325 IonicContact NH2-OE2 3.84Å; R319-E325 PolarHBondContact NH2-OE2 3.41Å; V321-E325 HydrophobicContact CG1-CB 3.81Å; L322-E325 HydrophobicContact CB-CG 4.05Å; L322-E325 PolarHBondContact N-OE2 3.11Å; L322-E325 WeakPolarHBondContact O-CB 3.37Å; L322-E325 PolarHBondContact O-N 2.7Å; L322-E325 VanDerWaalsContact O-N 3.08Å; E325-T327 PolarHBondContact O-N 2.91Å; E325-L644 HydrophobicContact CB-CD1 4.24Å; E325-L644 HydrophobicContact CB-CD2 3.91Å; E325-L644 HydrophobicContact CG-CD1 4.16Å
326	S	85.8	Confident	88.9	Confident	102 Å²	102	62 Å²	62	71%	0.713	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-66	127.2	174.8	-60.7	0	0	0	0	111.4	L644	S326-L644 WeakPolarHBondContact O-CD2 3.36Å
327	T	84.4	Confident	88.3	Confident	122 Å²	122	66 Å²	66	75%	0.748	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-63.4	127	171.4	51.6	0	0	0	0	110.4	E325	E325-T327 PolarHBondContact O-N 2.91Å
328	P	83.1	Confident	87.7	Confident	40 Å²	40	65.7 Å²	65.7	26%	0.26	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-66.7	157.5	177.4	29.7	-36.7	0	0	0	111.9	F332 P643 E645	P328-F332 HydrophobicContact CB-CB 4.13Å; P328-F332 HydrophobicContact CB-CD1 3.65Å; P328-F332 HydrophobicContact CB-CE1 4.5Å; P328-F332 HydrophobicContact CB-CG 4.18Å; P328-P643 WeakPolarHBondContact CB-O 3.35Å; P328-P643 WeakPolarHBondContact CG-O 3.35Å; P328-E645 HydrophobicContact CB-CG 4.11Å
329	S	83.1	Confident	86.8	Confident	59 Å²	59	71.1 Å²	71.1	41%	0.413	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-66.6	148.7	-179.5	63.7	0	0	0	0	112.6	G331 F332 E645	S329-G331 PolarHBondContact O-N 3.02Å; S329-G331 VanDerWaalsContact O-N 3.09Å; S329-F332 WeakPolarHBondContact O-CB 3.41Å; S329-F332 PolarHBondContact O-N 3.48Å; S329-E645 WeakPolarHBondContact CA-OE1 3.41Å; S329-E645 WeakPolarHBondContact CB-OE1 3.44Å; S329-E645 PolarHBondContact N-OE1 3.38Å; S329-E645 PolarHBondContact OG-OE1 2.97Å
330	P	79.9	Confident	86.2	Confident	141 Å²	141	73.9 Å²	73.9	92%	0.916	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	115.5	175.1	-24.7	34.9	0	0	0	111.4
331	G	81.1	Confident	85.7	Confident	35 Å²	35	71.5 Å²	71.5	36%	0.361	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	2	-176.9	0	0	0	0	0	115.6	S329 L333 S352	S329-G331 PolarHBondContact O-N 3.02Å; S329-G331 VanDerWaalsContact O-N 3.09Å; G331-L333 VanDerWaalsContact C-N 3.33Å; G331-S352 WeakPolarHBondContact O-CB 3.49Å; G331-S352 PolarHBondContact O-OG 3.11Å
332	F	86.8	Confident	85.1	Confident	8 Å²	8	75 Å²	75	4%	0.035	49%	0.485	C	S	.	.	S	Bend	trans	-57.6	-47.1	167.7	173.8	-116.7	0	0	0	111.6	P328 S329 L351 S352 P643 E645 V648	P328-F332 HydrophobicContact CB-CB 4.13Å; P328-F332 HydrophobicContact CB-CD1 3.65Å; P328-F332 HydrophobicContact CB-CE1 4.5Å; P328-F332 HydrophobicContact CB-CG 4.18Å; S329-F332 WeakPolarHBondContact O-CB 3.41Å; S329-F332 PolarHBondContact O-N 3.48Å; F332-L351 HydrophobicContact CD2-CD2 4.36Å; F332-L351 HydrophobicContact CE2-CD2 3.62Å; F332-L351 HydrophobicContact CZ-CD2 3.81Å; F332-L351 HydrophobicContact CZ-CG 4.47Å; F332-L351 WeakPolarHBondContact O-CA 3.49Å; F332-S352 WeakPolarHBondContact CD2-O 3.27Å; F332-S352 WeakPolarHBondContact CE2-O 3.49Å; F332-S352 PolarHBondContact O-N 3.31Å; F332-P643 WeakPolarHBondContact CE1-O 3.1Å; F332-E645 HydrophobicContact CB-CG 4.49Å; F332-E645 HydrophobicContact CD1-CG 4.01Å; F332-E645 HydrophobicContact CD2-CG 3.8Å; F332-E645 HydrophobicContact CE1-CG 4.19Å; F332-E645 HydrophobicContact CE2-CB 4.26Å; F332-E645 HydrophobicContact CE2-CG 4Å; F332-E645 HydrophobicContact CG-CG 3.83Å; F332-E645 HydrophobicContact CZ-CB 4.39Å; F332-E645 HydrophobicContact CZ-CG 4.19Å; F332-V648 HydrophobicContact CE2-CB 4.1Å; F332-V648 HydrophobicContact CE2-CG2 4.03Å; F332-V648 HydrophobicContact CZ-CB 4.16Å; F332-V648 HydrophobicContact CZ-CG2 4.39Å
333	L	90.4	Very high	84.7	Confident	29 Å²	29	76.1 Å²	76.1	15%	0.152	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.5	173.4	-73.7	157.9	0	0	0	108.9	V318 G331 F335 L349 L351 P643	V318-L333 HydrophobicContact CG1-CD1 4.19Å; G331-L333 VanDerWaalsContact C-N 3.33Å; L333-F335 HydrophobicContact CB-CE2 4.25Å; L333-F335 HydrophobicContact CB-CZ 4.48Å; L333-L349 HydrophobicContact CD2-CD1 3.91Å; L333-L349 HydrophobicContact CD2-CD2 4.48Å; L333-L351 HydrophobicContact CD2-CB 4.38Å; L333-L351 HydrophobicContact CD2-CD1 3.83Å; L333-L351 HydrophobicContact CD2-CG 3.71Å; L333-P643 HydrophobicContact CD1-CB 4.25Å
334	V	91.5	Very high	84.5	Confident	56 Å²	56	68.6 Å²	68.6	34%	0.339	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.6	175.6	177.5	0	0	0	0	108.7	P336 S350	V334-P336 WeakPolarHBondContact O-CD 3.31Å; V334-S350 PolarHBondContact N-O 3.41Å; V334-S350 PolarHBondContact O-N 2.95Å
335	F	92.4	Very high	84.6	Confident	59 Å²	59	66.8 Å²	66.8	26%	0.259	44%	0.439	S	S	.	.			trans	-110.9	100.4	178.7	-56.6	-91.5	0	0	0	107.8	V318 L333 L349 V378 P380 P381	V318-F335 HydrophobicContact CB-CE1 4.49Å; V318-F335 HydrophobicContact CB-CZ 4.22Å; V318-F335 HydrophobicContact CG2-CE1 3.79Å; V318-F335 HydrophobicContact CG2-CZ 3.82Å; L333-F335 HydrophobicContact CB-CE2 4.25Å; L333-F335 HydrophobicContact CB-CZ 4.48Å; F335-L349 HydrophobicContact CD1-CD1 3.82Å; F335-L349 HydrophobicContact CE1-CD1 3.53Å; F335-L349 HydrophobicContact CZ-CD1 4.01Å; F335-V378 HydrophobicContact CD1-CG1 3.78Å; F335-V378 HydrophobicContact CE1-CG1 3.92Å; F335-P380 HydrophobicContact CD1-CB 4.12Å; F335-P380 HydrophobicContact CD1-CG 3.9Å; F335-P380 HydrophobicContact CD2-CB 4.33Å; F335-P380 HydrophobicContact CE1-CB 4.03Å; F335-P380 HydrophobicContact CE1-CG 4.24Å; F335-P380 HydrophobicContact CE2-CB 4.28Å; F335-P380 HydrophobicContact CG-CB 4.28Å; F335-P380 HydrophobicContact CG-CG 4.11Å; F335-P380 HydrophobicContact CZ-CB 4.14Å; F335-P381 HydrophobicContact CZ-CG 4.48Å
336	P	88.9	Confident	84.7	Confident	41 Å²	41	65.3 Å²	65.3	27%	0.266	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-59.1	144.6	171.3	-22.4	34.2	0	0	0	110.7	V334 P346	V334-P336 WeakPolarHBondContact O-CD 3.31Å; P336-P346 VanDerWaalsContact O-CB 3.26Å; P336-P346 WeakPolarHBondContact O-CB 3.42Å
337	P	85.9	Confident	84.9	Confident	84 Å²	84	62.3 Å²	62.3	55%	0.545	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-61.1	159.7	173.2	28.3	-35.4	0	0	0	111.3
338	G	83.3	Confident	85.3	Confident	5 Å²	5	57.1 Å²	57.1	5%	0.052	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-62	160.9	178.1	0	0	0	0	0	113.4	A340 G341 D344 P345	G338-A340 PolarHBondContact O-N 3.22Å; G338-A340 VanDerWaalsContact O-N 3.11Å; G338-G341 PolarHBondContact O-N 3.15Å; G338-D344 WeakPolarHBondContact CA-O 3.3Å; G338-D344 WeakPolarHBondContact CA-OD2 3.42Å; G338-D344 PolarHBondContact N-O 2.84Å; G338-D344 VanDerWaalsContact N-O 3.08Å; G338-P345 VanDerWaalsContact CA-O 3.32Å; G338-P345 WeakPolarHBondContact CA-O 3.39Å
339	P	78.5	Confident	85.8	Confident	116 Å²	116	55.2 Å²	55.2	75%	0.753	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-25.1	-177.1	21.9	-34.2	0	0	0	115.3	D344	P339-D344 WeakPolarHBondContact CD-OD2 3.39Å; P339-D344 WeakPolarHBondContact CG-OD2 3.38Å
340	A	82.4	Confident	86.2	Confident	83 Å²	83	52.6 Å²	52.6	69%	0.686	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	1.6	174.7	0	0	0	0	0	114.5	G338 D344	G338-A340 PolarHBondContact O-N 3.22Å; G338-A340 VanDerWaalsContact O-N 3.11Å; A340-D344 HydrophobicContact CB-CB 3.9Å; A340-D344 PolarHBondContact N-OD2 2.91Å
341	G	82.8	Confident	86.8	Confident	19 Å²	19	45.9 Å²	45.9	20%	0.196	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	121.3	-166.6	171.2	0	0	0	0	0	115.2	G338 S343 D344	G338-G341 PolarHBondContact O-N 3.15Å; G341-S343 PolarHBondContact O-N 3.23Å; G341-S343 VanDerWaalsContact O-N 3.14Å; G341-D344 VanDerWaalsContact O-CB 3.32Å; G341-D344 WeakPolarHBondContact O-CB 3.47Å; G341-D344 PolarHBondContact O-N 2.79Å
342	P	78.7	Confident	87.1	Confident	130 Å²	130	45.5 Å²	45.5	84%	0.844	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.3	-172.6	-23.7	35	0	0	0	115.8
343	S	80.1	Confident	86.9	Confident	120 Å²	120	48.8 Å²	48.8	84%	0.839	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-8.8	174.7	53.1	0	0	0	0	113.6	G341	G341-S343 PolarHBondContact O-N 3.23Å; G341-S343 VanDerWaalsContact O-N 3.14Å
344	D	83.1	Confident	86	Confident	46 Å²	46	50.8 Å²	50.8	25%	0.246	33%	0.328	C	S	.	.	S	Bend	trans	-92.5	131	-178.1	-169.3	40.1	0	0	0	109.3	G338 P339 A340 G341	G338-D344 WeakPolarHBondContact CA-O 3.3Å; G338-D344 WeakPolarHBondContact CA-OD2 3.42Å; G338-D344 PolarHBondContact N-O 2.84Å; G338-D344 VanDerWaalsContact N-O 3.08Å; P339-D344 WeakPolarHBondContact CD-OD2 3.39Å; P339-D344 WeakPolarHBondContact CG-OD2 3.38Å; A340-D344 HydrophobicContact CB-CB 3.9Å; A340-D344 PolarHBondContact N-OD2 2.91Å; G341-D344 VanDerWaalsContact O-CB 3.32Å; G341-D344 WeakPolarHBondContact O-CB 3.47Å; G341-D344 PolarHBondContact O-N 2.79Å
345	P	86.1	Confident	84.7	Confident	52 Å²	52	50.3 Å²	50.3	34%	0.338	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-53.1	138.2	-177.8	16.2	-31.9	0	0	0	113.3	G338 T347 R377	G338-P345 VanDerWaalsContact CA-O 3.32Å; G338-P345 WeakPolarHBondContact CA-O 3.39Å; P345-T347 PolarHBondContact O-N 2.99Å; P345-R377 VanDerWaalsContact CB-CZ 3.44Å; P345-R377 VanDerWaalsContact CB-NE 3.28Å
346	P	89.6	Confident	83.1	Confident	25 Å²	25	55.2 Å²	55.2	16%	0.162	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-65.5	131.4	-178.6	25.9	-32.9	0	0	0	111.2	P336 V378 P380	P336-P346 VanDerWaalsContact O-CB 3.26Å; P336-P346 WeakPolarHBondContact O-CB 3.42Å; P346-V378 WeakPolarHBondContact O-CA 3.36Å; P346-V378 WeakPolarHBondContact O-CB 3.36Å; P346-V378 PolarHBondContact O-N 3.41Å; P346-P380 HydrophobicContact CG-CG 4.05Å
347	T	91.4	Very high	81.7	Confident	39 Å²	39	62.5 Å²	62.5	24%	0.239	38%	0.375	C	S	.	.			trans	-108.5	-15.6	173.8	53.1	0	0	0	0	112.3	P345 S374 F375 V378	P345-T347 PolarHBondContact O-N 2.99Å; T347-S374 WeakPolarHBondContact O-CA 3.44Å; T347-F375 WeakPolarHBondContact CB-O 3.36Å; T347-F375 PolarHBondContact O-N 2.87Å; T347-V378 VanDerWaalsContact C-CG2 3.48Å; T347-V378 WeakPolarHBondContact O-CG2 3.49Å
348	G	91.8	Very high	80.3	Confident	12 Å²	12	67.7 Å²	67.7	12%	0.124	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	150.1	177.6	0	0	0	0	0	113.6	F373	G348-F373 WeakPolarHBondContact CA-O 3.02Å
349	L	93.7	Very high	79	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.005	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	126.7	164.2	179.6	62.9	0	0	0	109.8	V318 L333 F335 F373 V378 L655	V318-L349 HydrophobicContact CG2-CD2 4.38Å; L333-L349 HydrophobicContact CD2-CD1 3.91Å; L333-L349 HydrophobicContact CD2-CD2 4.48Å; F335-L349 HydrophobicContact CD1-CD1 3.82Å; F335-L349 HydrophobicContact CE1-CD1 3.53Å; F335-L349 HydrophobicContact CZ-CD1 4.01Å; L349-F373 PolarHBondContact N-O 3.12Å; L349-F373 PolarHBondContact O-N 2.82Å; L349-V378 HydrophobicContact CB-CG1 4.39Å; L349-L655 HydrophobicContact CD2-CD1 3.96Å; L349-L655 HydrophobicContact CD2-CD2 3.88Å
350	S	92.3	Very high	78.1	Confident	3 Å²	3	71 Å²	71	2%	0.021	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.7	175.6	-63.1	0	0	0	0	109.7	V334 R370 D372	V334-S350 PolarHBondContact N-O 3.41Å; V334-S350 PolarHBondContact O-N 2.95Å; S350-R370 PolarHBondContact OG-NE 3.04Å; S350-R370 PolarHBondContact OG-NH2 3.02Å; S350-D372 WeakPolarHBondContact CB-OD1 3.43Å; S350-D372 PolarHBondContact OG-OD1 3.05Å
351	L	91.3	Very high	77	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.8	-175	-153.7	164.1	0	0	0	109.8	F332 L333 H371 V648 L652 L655	F332-L351 HydrophobicContact CD2-CD2 4.36Å; F332-L351 HydrophobicContact CE2-CD2 3.62Å; F332-L351 HydrophobicContact CZ-CD2 3.81Å; F332-L351 HydrophobicContact CZ-CG 4.47Å; F332-L351 WeakPolarHBondContact O-CA 3.49Å; L333-L351 HydrophobicContact CD2-CB 4.38Å; L333-L351 HydrophobicContact CD2-CD1 3.83Å; L333-L351 HydrophobicContact CD2-CG 3.71Å; L351-H371 PolarHBondContact N-O 2.85Å; L351-H371 PolarHBondContact O-N 2.88Å; L351-V648 HydrophobicContact CD2-CG2 3.69Å; L351-L652 HydrophobicContact CB-CD2 4.46Å; L351-L652 HydrophobicContact CD1-CD2 4.48Å; L351-L652 HydrophobicContact CD2-CD2 4.41Å; L351-L655 HydrophobicContact CD1-CD1 3.65Å
352	S	88.4	Confident	76.1	Confident	26 Å²	26	78.7 Å²	78.7	18%	0.182	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	133.6	-175	-56.9	0	0	0	0	111.2	G331 F332	G331-S352 WeakPolarHBondContact O-CB 3.49Å; G331-S352 PolarHBondContact O-OG 3.11Å; F332-S352 WeakPolarHBondContact CD2-O 3.27Å; F332-S352 WeakPolarHBondContact CE2-O 3.49Å; F332-S352 PolarHBondContact O-N 3.31Å
353	R	82.1	Confident	75.2	Confident	78 Å²	78	74.8 Å²	74.8	29%	0.294	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	112.4	173.7	176.1	174.9	169.8	136.7	1.9	110.7	D355 T368 V369 V648 S649	R353-D355 IonicContact CZ-OD1 3.71Å; R353-D355 IonicContact NE-OD1 3.36Å; R353-D355 PolarHBondContact NE-OD1 2.92Å; R353-D355 IonicContact NH2-OD1 2.83Å; R353-D355 PolarHBondContact NH2-OD1 3.23Å; R353-T368 CarbonylContact O-C 3.58Å; R353-T368 WeakPolarHBondContact O-CA 3.32Å; R353-V369 PolarHBondContact N-O 2.87Å; R353-V369 PolarHBondContact O-N 2.99Å; R353-V648 HydrophobicContact CB-CG2 4.18Å; R353-V648 HydrophobicContact CG-CG2 4.39Å; R353-S649 PolarHBondContact NH1-OG 2.99Å; R353-S649 VanDerWaalsContact NH1-OG 3.11Å
354	S	71.6	Confident	74.4	Confident	71 Å²	71	71.2 Å²	71.2	50%	0.497	39%	0.392	S	S	.	.			trans	-66.1	144	154.4	35.6	0	0	0	0	109.3
355	D	64.7	Low	73.4	Confident	45 Å²	45	74.2 Å²	74.2	24%	0.241	41%	0.414	C	S	.	.			trans	-123.6	114.5	172.1	-154.1	55.5	0	0	0	107.6	R353 R357 A366	R353-D355 IonicContact CZ-OD1 3.71Å; R353-D355 IonicContact NE-OD1 3.36Å; R353-D355 PolarHBondContact NE-OD1 2.92Å; R353-D355 IonicContact NH2-OD1 2.83Å; R353-D355 PolarHBondContact NH2-OD1 3.23Å; D355-R357 PolarHBondContact O-N 3.5Å; D355-R357 VanDerWaalsContact OD2-CD 3.23Å; D355-R357 WeakPolarHBondContact OD2-CD 3.39Å; D355-R357 WeakPolarHBondContact OD2-CG 3.14Å; D355-R357 IonicContact OD2-NE 3.3Å; D355-A366 HydrophobicContact CB-CB 4.36Å
356	D	58.9	Low	72.5	Confident	162 Å²	162	73.1 Å²	73.1	87%	0.866	41%	0.409	S	S	*	.			trans	-65.5	-2.6	-173.4	-62.5	-47.8	0	0	0	113.9	R358	D356-R358 PolarHBondContact O-N 3.19Å
357	R	58.7	Low	71.6	Confident	195 Å²	195	77.3 Å²	77.3	74%	0.736	44%	0.436	S	S	*	.			trans	-68	94	173	-60.4	-172.6	-179.7	-166.1	-3.8	109.7	D355 S359	D355-R357 PolarHBondContact O-N 3.5Å; D355-R357 VanDerWaalsContact OD2-CD 3.23Å; D355-R357 WeakPolarHBondContact OD2-CD 3.39Å; D355-R357 WeakPolarHBondContact OD2-CG 3.14Å; D355-R357 IonicContact OD2-NE 3.3Å; R357-S359 PolarHBondContact O-N 3.02Å
358	R	57.2	Low	70.9	Confident	193 Å²	193	79.9 Å²	79.9	73%	0.728	45%	0.452	S	S	*	.			trans	-49.7	137.5	166.5	-70.1	-177.6	-179.3	175.3	0	110.2	D356 T360 G363 A364	D356-R358 PolarHBondContact O-N 3.19Å; R358-T360 PolarHBondContact O-N 3.38Å; R358-G363 WeakPolarHBondContact CD-O 3.04Å; R358-A364 WeakPolarHBondContact CA-O 3.29Å
359	S	55.6	Low	70.6	Confident	41 Å²	41	82.7 Å²	82.7	29%	0.287	47%	0.467	S	S	.	.			trans	-54.8	121.3	172.8	166.3	0	0	0	0	110.2	R357 L361 T362 G363 A364	R357-S359 PolarHBondContact O-N 3.02Å; S359-L361 PolarHBondContact O-N 2.82Å; S359-L361 VanDerWaalsContact O-N 3.1Å; S359-L361 PolarHBondContact OG-N 2.9Å; S359-T362 WeakPolarHBondContact CB-OG1 3.29Å; S359-T362 PolarHBondContact O-N 3.36Å; S359-T362 PolarHBondContact OG-N 3.22Å; S359-T362 PolarHBondContact OG-OG1 3.31Å; S359-G363 PolarHBondContact O-N 2.86Å; S359-A364 PolarHBondContact N-O 2.99Å
360	T	59	Low	70.3	Confident	148 Å²	148	89 Å²	89	91%	0.908	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-14.4	179.8	49.8	0	0	0	0	113.6	R358	R358-T360 PolarHBondContact O-N 3.38Å
361	L	60.5	Low	70.3	Confident	161 Å²	161	91 Å²	91	84%	0.843	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-20.4	-179.2	-72.2	164.2	0	0	0	113.8	S359	S359-L361 PolarHBondContact O-N 2.82Å; S359-L361 VanDerWaalsContact O-N 3.1Å; S359-L361 PolarHBondContact OG-N 2.9Å
362	T	62.7	Low	70.4	Confident	104 Å²	104	95.7 Å²	95.7	64%	0.638	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.7	-7.3	-170.6	58.4	0	0	0	0	115.4	S359 A364	S359-T362 WeakPolarHBondContact CB-OG1 3.29Å; S359-T362 PolarHBondContact O-N 3.36Å; S359-T362 PolarHBondContact OG-N 3.22Å; S359-T362 PolarHBondContact OG-OG1 3.31Å; T362-A364 PolarHBondContact O-N 2.85Å
363	G	60.8	Low	70.7	Confident	48 Å²	48	95.6 Å²	95.6	50%	0.495	52%	0.521	S	S	.	.			trans	69.1	-14.7	179.8	0	0	0	0	0	115.7	R358 S359	R358-G363 WeakPolarHBondContact CD-O 3.04Å; S359-G363 PolarHBondContact O-N 2.86Å
364	A	63.3	Low	71.2	Confident	45 Å²	45	95.2 Å²	95.2	37%	0.372	53%	0.53	S	S	.	.	S	Bend	trans	-60.7	152.8	173.2	0	0	0	0	0	111.9	R358 S359 T362	R358-A364 WeakPolarHBondContact CA-O 3.29Å; S359-A364 PolarHBondContact N-O 2.99Å; T362-A364 PolarHBondContact O-N 2.85Å
365	P	62.8	Low	72.2	Confident	109 Å²	109	92 Å²	92	71%	0.708	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-58.5	147.9	167.9	27.5	-35.1	0	0	0	110.5
366	A	65.4	Low	73.6	Confident	28 Å²	28	93.1 Å²	93.1	23%	0.231	51%	0.513	C	S	.	.	P	Polyproline II helix	trans	-63.8	147	173.5	0	0	0	0	0	110.7	D355 T368	D355-A366 HydrophobicContact CB-CB 4.36Å; A366-T368 PolarHBondContact O-N 3.37Å
367	P	70.9	Confident	75.2	Confident	114 Å²	114	86.2 Å²	86.2	74%	0.74	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-63.4	132.2	175.9	27.1	-34.3	0	0	0	110.4	V369	P367-V369 PolarHBondContact O-N 3.42Å
368	T	76.4	Confident	77	Confident	93 Å²	93	77 Å²	77	57%	0.571	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-56.3	118.9	178.3	-49.7	0	0	0	0	110.7	R353 A366 R370	R353-T368 CarbonylContact O-C 3.58Å; R353-T368 WeakPolarHBondContact O-CA 3.32Å; A366-T368 PolarHBondContact O-N 3.37Å; T368-R370 PolarHBondContact O-N 3.28Å
369	V	85.4	Confident	78.9	Confident	71 Å²	71	67.8 Å²	67.8	43%	0.43	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	114.9	180	-177.3	0	0	0	0	108.9	R353 P367 H371	R353-V369 PolarHBondContact N-O 2.87Å; R353-V369 PolarHBondContact O-N 2.99Å; P367-V369 PolarHBondContact O-N 3.42Å; V369-H371 VanDerWaalsContact CG1-CE1 3.47Å; V369-H371 WeakPolarHBondContact CG1-CE1 3.43Å
370	R	88.1	Confident	80.8	Confident	132 Å²	132	67.5 Å²	67.5	50%	0.498	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	135.8	171.6	-177.9	173.9	173.3	155.4	0.6	110.2	S350 T368 D372	S350-R370 PolarHBondContact OG-NE 3.04Å; S350-R370 PolarHBondContact OG-NH2 3.02Å; T368-R370 PolarHBondContact O-N 3.28Å; R370-D372 IonicContact CZ-OD1 3.55Å; R370-D372 IonicContact NE-OD1 2.79Å; R370-D372 PolarHBondContact NE-OD1 3.09Å; R370-D372 IonicContact NE-OD2 3.53Å; R370-D372 IonicContact NH2-OD1 3.47Å; R370-D372 PolarHBondContact NH2-OD1 3.4Å
371	H	91.8	Very high	82.4	Confident	47 Å²	47	62.6 Å²	62.6	22%	0.218	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	114.9	172.9	-67.8	-49.7	0	0	0	109.7	L351 V369 F373 L652	L351-H371 PolarHBondContact N-O 2.85Å; L351-H371 PolarHBondContact O-N 2.88Å; V369-H371 VanDerWaalsContact CG1-CE1 3.47Å; V369-H371 WeakPolarHBondContact CG1-CE1 3.43Å; H371-F373 HydrophobicContact CB-CE2 3.74Å; H371-F373 HydrophobicContact CB-CZ 4.19Å; H371-L652 HydrophobicContact CB-CD2 3.77Å; H371-L652 VanDerWaalsContact CD2-CD2 3.43Å; H371-L652 WeakPolarHBondContact CD2-CD2 3.34Å
372	D	93.1	Very high	83.9	Confident	98 Å²	98	58.3 Å²	58.3	52%	0.524	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.9	-179.4	-60	-56.4	0	0	0	110.9	S350 R370	S350-D372 WeakPolarHBondContact CB-OD1 3.43Å; S350-D372 PolarHBondContact OG-OD1 3.05Å; R370-D372 IonicContact CZ-OD1 3.55Å; R370-D372 IonicContact NE-OD1 2.79Å; R370-D372 PolarHBondContact NE-OD1 3.09Å; R370-D372 IonicContact NE-OD2 3.53Å; R370-D372 IonicContact NH2-OD1 3.47Å; R370-D372 PolarHBondContact NH2-OD1 3.4Å
373	F	94.6	Very high	85.4	Confident	25 Å²	25	54.2 Å²	54.2	11%	0.11	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.8	179.3	-59	-87.9	0	0	0	110.1	G348 L349 H371 F375 L652 L655 R656	G348-F373 WeakPolarHBondContact CA-O 3.02Å; L349-F373 PolarHBondContact N-O 3.12Å; L349-F373 PolarHBondContact O-N 2.82Å; H371-F373 HydrophobicContact CB-CE2 3.74Å; H371-F373 HydrophobicContact CB-CZ 4.19Å; F373-F375 HydrophobicContact CB-CD2 4.39Å; F373-F375 HydrophobicContact CB-CE2 3.55Å; F373-F375 HydrophobicContact CB-CZ 3.92Å; F373-F375 HydrophobicContact CG-CE2 4.44Å; F373-F375 HydrophobicContact CG-CZ 4.5Å; F373-L652 HydrophobicContact CE2-CD2 3.83Å; F373-L652 HydrophobicContact CZ-CD2 3.94Å; F373-L655 HydrophobicContact CD1-CB 3.85Å; F373-L655 HydrophobicContact CD2-CB 4.05Å; F373-L655 HydrophobicContact CD2-CD1 3.87Å; F373-L655 HydrophobicContact CD2-CG 4.4Å; F373-L655 HydrophobicContact CE1-CB 3.61Å; F373-L655 HydrophobicContact CE2-CB 3.82Å; F373-L655 HydrophobicContact CE2-CD1 3.74Å; F373-L655 HydrophobicContact CE2-CG 4.37Å; F373-L655 HydrophobicContact CG-CB 4.05Å; F373-L655 HydrophobicContact CZ-CB 3.59Å; F373-L655 HydrophobicContact CZ-CD1 4.33Å; F373-R656 HydrophobicContact CE1-CG 4.02Å; F373-R656 HydrophobicContact CZ-CG 4.26Å
374	S	93	Very high	87	Confident	69 Å²	69	58.3 Å²	58.3	48%	0.483	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.1	177.6	-176.1	0	0	0	0	110.7	T347 N662	T347-S374 WeakPolarHBondContact O-CA 3.44Å; S374-N662 PolarHBondContact O-ND2 3.1Å
375	F	94	Very high	88.5	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.018	33%	0.331	C	S	.	.			trans	-144.1	160.7	-168.8	-63.5	-64.7	0	0	0	109.9	V314 C316 T347 F373 R377 V378 V639 L655 A658 N662	V314-F375 HydrophobicContact CB-CD1 4.04Å; V314-F375 HydrophobicContact CG1-CD1 3.51Å; V314-F375 HydrophobicContact CG1-CE1 3.79Å; V314-F375 WeakPolarHBondContact O-CB 3.48Å; C316-F375 HydrophobicContact CB-CD2 3.6Å; C316-F375 HydrophobicContact CB-CE2 3.91Å; C316-F375 HydrophobicContact CB-CG 4.13Å; T347-F375 WeakPolarHBondContact CB-O 3.36Å; T347-F375 PolarHBondContact O-N 2.87Å; F373-F375 HydrophobicContact CB-CD2 4.39Å; F373-F375 HydrophobicContact CB-CE2 3.55Å; F373-F375 HydrophobicContact CB-CZ 3.92Å; F373-F375 HydrophobicContact CG-CE2 4.44Å; F373-F375 HydrophobicContact CG-CZ 4.5Å; F375-R377 PolarHBondContact O-N 2.8Å; F375-V378 HydrophobicContact CB-CG2 4.21Å; F375-V378 HydrophobicContact CD2-CG2 4.06Å; F375-V639 HydrophobicContact CE1-CG1 4.48Å; F375-V639 HydrophobicContact CZ-CG1 4.4Å; F375-L655 HydrophobicContact CE2-CD2 3.66Å; F375-L655 HydrophobicContact CZ-CD2 3.73Å; F375-A658 HydrophobicContact CE1-CB 3.64Å; F375-A658 HydrophobicContact CZ-CB 4.02Å; F375-N662 WeakPolarHBondContact CA-ND2 3.36Å; F375-N662 HydrophobicContact CD1-CB 4.37Å
376	D	92.7	Very high	90	Very high	68 Å²	68	56.5 Å²	56.5	36%	0.364	32%	0.322	S	S	.	.	S	Bend	trans	-59.2	-31.3	176.8	-58.6	-73.4	0	0	0	112.3	R313 V314 F315 N662	R313-D376 WeakPolarHBondContact CA-OD2 3.39Å; R313-D376 VanDerWaalsContact CB-OD2 3.25Å; R313-D376 WeakPolarHBondContact CB-OD2 3.4Å; R313-D376 WeakPolarHBondContact CG-OD2 3.5Å; V314-D376 PolarHBondContact N-OD2 3.29Å; V314-D376 PolarHBondContact O-N 3.33Å; V314-D376 VanDerWaalsContact O-N 3.16Å; F315-D376 HydrophobicContact CD1-CB 3.94Å; F315-D376 HydrophobicContact CE1-CB 3.74Å; D376-N662 PolarHBondContact OD2-OD1 2.9Å
377	R	93.9	Very high	91.4	Very high	18 Å²	18	57.9 Å²	57.9	7%	0.068	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	141.2	175.5	-170.5	57.7	154.7	82.4	9.5	110.7	F315 C316 P345 F375 F379 E387 E391	F315-R377 CarbonylContact C-O 3.59Å; F315-R377 WeakPolarHBondContact CA-O 3.25Å; F315-R377 HydrophobicContact CD1-CB 3.54Å; F315-R377 HydrophobicContact CD2-CB 4.37Å; F315-R377 HydrophobicContact CE1-CB 3.66Å; F315-R377 HydrophobicContact CE2-CB 4.44Å; F315-R377 HydrophobicContact CG-CB 3.92Å; F315-R377 HydrophobicContact CZ-CB 4.11Å; C316-R377 PolarHBondContact N-O 2.73Å; P345-R377 VanDerWaalsContact CB-CZ 3.44Å; P345-R377 VanDerWaalsContact CB-NE 3.28Å; F375-R377 PolarHBondContact O-N 2.8Å; R377-F379 HydrophobicContact CB-CE2 4.22Å; R377-F379 HydrophobicContact CB-CZ 4.48Å; R377-F379 HydrophobicContact CG-CD1 4.49Å; R377-F379 HydrophobicContact CG-CD2 4.16Å; R377-F379 HydrophobicContact CG-CE1 3.98Å; R377-F379 HydrophobicContact CG-CE2 3.59Å; R377-F379 HydrophobicContact CG-CZ 3.51Å; R377-E387 IonicContact CZ-OE1 3.31Å; R377-E387 IonicContact NH1-OE1 2.8Å; R377-E387 PolarHBondContact NH1-OE1 2.84Å; R377-E387 IonicContact NH2-OE1 3.01Å; R377-E387 PolarHBondContact NH2-OE1 3.17Å; R377-E391 IonicContact CZ-OE1 2.73Å; R377-E391 VanDerWaalsContact CZ-OE1 3.31Å; R377-E391 IonicContact NE-OE1 3.4Å; R377-E391 PolarHBondContact NE-OE1 3.36Å; R377-E391 IonicContact NH2-OE1 2.68Å; R377-E391 PolarHBondContact NH2-OE1 3.11Å
378	V	96.3	Very high	92.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.5	167.3	-174.9	0	0	0	0	108.7	C316 F335 P346 T347 L349 F375	C316-V378 HydrophobicContact CB-CG1 4.27Å; C316-V378 HydrophobicContact CB-CG2 4.13Å; C316-V378 CarbonylContact O-C 3.44Å; C316-V378 WeakPolarHBondContact O-CA 3.47Å; F335-V378 HydrophobicContact CD1-CG1 3.78Å; F335-V378 HydrophobicContact CE1-CG1 3.92Å; P346-V378 WeakPolarHBondContact O-CA 3.36Å; P346-V378 WeakPolarHBondContact O-CB 3.36Å; P346-V378 PolarHBondContact O-N 3.41Å; T347-V378 VanDerWaalsContact C-CG2 3.48Å; T347-V378 WeakPolarHBondContact O-CG2 3.49Å; L349-V378 HydrophobicContact CB-CG1 4.39Å; F375-V378 HydrophobicContact CB-CG2 4.21Å; F375-V378 HydrophobicContact CD2-CG2 4.06Å
379	F	96.5	Very high	93.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109.2	175.3	-64.1	-78.8	0	0	0	108.5	F315 C316 R317 V318 R377 E387 V388 E391 F638	F315-F379 HydrophobicContact CB-CE2 4.1Å; F315-F379 AromaticContact CD2-CE2 3.65Å; F315-F379 HydrophobicContact CD2-CE2 3.65Å; F315-F379 HydrophobicContact CD2-CZ 4.17Å; F315-F379 HydrophobicContact CE2-CE2 4.3Å; F315-F379 HydrophobicContact CE2-CZ 4.4Å; F315-F379 HydrophobicContact CG-CE2 4.08Å; C316-F379 PolarHBondContact O-N 3.21Å; R317-F379 HydrophobicContact CB-CB 4.28Å; R317-F379 HydrophobicContact CG-CB 4.05Å; V318-F379 PolarHBondContact N-O 2.99Å; R377-F379 HydrophobicContact CB-CE2 4.22Å; R377-F379 HydrophobicContact CB-CZ 4.48Å; R377-F379 HydrophobicContact CG-CD1 4.49Å; R377-F379 HydrophobicContact CG-CD2 4.16Å; R377-F379 HydrophobicContact CG-CE1 3.98Å; R377-F379 HydrophobicContact CG-CE2 3.59Å; R377-F379 HydrophobicContact CG-CZ 3.51Å; F379-E387 HydrophobicContact CE1-CG 4.33Å; F379-V388 HydrophobicContact CB-CG2 4.37Å; F379-V388 HydrophobicContact CD1-CG2 3.53Å; F379-V388 HydrophobicContact CD2-CG2 4.2Å; F379-V388 HydrophobicContact CE1-CB 4.32Å; F379-V388 HydrophobicContact CE1-CG2 3.7Å; F379-V388 HydrophobicContact CE2-CG2 4.34Å; F379-V388 HydrophobicContact CG-CG2 3.78Å; F379-V388 HydrophobicContact CZ-CB 4.41Å; F379-V388 HydrophobicContact CZ-CG2 4.1Å; F379-E391 HydrophobicContact CE1-CG 4.16Å; F379-E391 HydrophobicContact CZ-CB 4.15Å; F379-E391 HydrophobicContact CZ-CG 3.95Å; F379-F638 HydrophobicContact CD2-CE1 4.37Å; F379-F638 AromaticContact CE2-CE1 3.95Å; F379-F638 HydrophobicContact CE2-CE1 3.95Å
380	P	94.6	Very high	94.1	Very high	35 Å²	35	51.8 Å²	51.8	23%	0.227	27%	0.274	C	S	.	.			trans	-65.3	170	173.4	-20.2	33.4	0	0	0	112.4	F335 P346 G382 S383	F335-P380 HydrophobicContact CD1-CB 4.12Å; F335-P380 HydrophobicContact CD1-CG 3.9Å; F335-P380 HydrophobicContact CD2-CB 4.33Å; F335-P380 HydrophobicContact CE1-CB 4.03Å; F335-P380 HydrophobicContact CE1-CG 4.24Å; F335-P380 HydrophobicContact CE2-CB 4.28Å; F335-P380 HydrophobicContact CG-CB 4.28Å; F335-P380 HydrophobicContact CG-CG 4.11Å; F335-P380 HydrophobicContact CZ-CB 4.14Å; P346-P380 HydrophobicContact CG-CG 4.05Å; P380-G382 PolarHBondContact O-N 2.95Å; P380-S383 WeakPolarHBondContact O-CB 3.44Å; P380-S383 PolarHBondContact O-N 3.31Å
381	P	93.3	Very high	94.3	Very high	46 Å²	46	48.4 Å²	48.4	30%	0.299	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-20	-179.3	-28.9	36.6	0	0	0	116.2	V318 P320 F335	V318-P381 HydrophobicContact CB-CG 4.22Å; V318-P381 HydrophobicContact CG1-CG 3.93Å; V318-P381 WeakPolarHBondContact O-CA 3.33Å; P320-P381 WeakPolarHBondContact CG-O 3.47Å; F335-P381 HydrophobicContact CZ-CG 4.48Å
382	G	92	Very high	94.5	Very high	71 Å²	71	46.2 Å²	46.2	73%	0.732	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.5	176.9	0	0	0	0	0	115.5	P380 K384	P380-G382 PolarHBondContact O-N 2.95Å; G382-K384 PolarHBondContact O-N 3.47Å
383	S	94.5	Very high	94.5	Very high	17 Å²	17	42.4 Å²	42.4	12%	0.119	24%	0.235	C	C	.	.			trans	-73.7	123.9	-172.9	-77.3	0	0	0	0	113.5	R317 P380 E387	R317-S383 PolarHBondContact NH2-O 2.7Å; P380-S383 WeakPolarHBondContact O-CB 3.44Å; P380-S383 PolarHBondContact O-N 3.31Å; S383-E387 WeakPolarHBondContact CA-OE2 3.46Å; S383-E387 WeakPolarHBondContact CB-OE2 3.5Å; S383-E387 VanDerWaalsContact OG-CD 3.3Å; S383-E387 PolarHBondContact OG-OE1 3.45Å; S383-E387 PolarHBondContact OG-OE2 2.91Å
384	K	94.6	Very high	94.4	Very high	134 Å²	134	45.8 Å²	45.8	58%	0.583	25%	0.252	S	S	*	.			trans	-76.3	162	-174.8	-63.7	-174.9	-179.4	-177.1	0	112.4	G382 E386 V388	G382-K384 PolarHBondContact O-N 3.47Å; K384-E386 PolarHBondContact O-N 3.1Å; K384-V388 WeakPolarHBondContact O-CB 3.46Å; K384-V388 VanDerWaalsContact O-CG2 3.23Å; K384-V388 WeakPolarHBondContact O-CG2 3.45Å; K384-V388 PolarHBondContact O-N 3.34Å; K384-V388 VanDerWaalsContact O-N 3.16Å
385	Q	94.9	Very high	94.5	Very high	7 Å²	7	42.7 Å²	42.7	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-58.7	-32.4	173.3	-61.4	-75.4	58.8	0	0	112.7	R317 F389 F419 Q430 L431 E432	R317-Q385 VanDerWaalsContact CZ-OE1 3.25Å; Q385-F389 WeakPolarHBondContact O-CB 3.02Å; Q385-F389 PolarHBondContact O-N 3.43Å; Q385-F419 HydrophobicContact CG-CE1 4.28Å; Q385-F419 HydrophobicContact CG-CZ 4.23Å; Q385-F419 PolarHBondContact NE2-O 2.83Å; Q385-Q430 WeakPolarHBondContact CG-O 3.14Å; Q385-L431 PolarHBondContact NE2-O 2.76Å; Q385-E432 VanDerWaalsContact CB-O 3.23Å; Q385-E432 WeakPolarHBondContact CB-O 3.49Å; Q385-E432 WeakPolarHBondContact CG-O 3.48Å; Q385-E432 PolarHBondContact NE2-O 2.8Å
386	E	94.8	Very high	94.5	Very high	110 Å²	110	42.5 Å²	42.5	51%	0.514	23%	0.23	S	C	.	.	H	α-helix	trans	-68.8	-56	179.9	-169.8	157.5	-119.9	0	0	111.8	K384 V388 F389 E390	K384-E386 PolarHBondContact O-N 3.1Å; E386-V388 PolarHBondContact O-N 3.28Å; E386-F389 CarbonylContact O-C 3.6Å; E386-F389 WeakPolarHBondContact O-CA 3.36Å; E386-F389 WeakPolarHBondContact O-CB 3.37Å; E386-F389 PolarHBondContact O-N 2.67Å; E386-E390 WeakPolarHBondContact O-CG 3.43Å; E386-E390 PolarHBondContact O-N 3.34Å
387	E	94.8	Very high	94.6	Very high	56 Å²	56	39.8 Å²	39.8	26%	0.262	22%	0.215	S	C	.	.	H	α-helix	trans	-51.2	-43.9	172.7	-174.1	-156.7	158	0	0	112	R377 F379 S383 F389 E390 E391	R377-E387 IonicContact CZ-OE1 3.31Å; R377-E387 IonicContact NH1-OE1 2.8Å; R377-E387 PolarHBondContact NH1-OE1 2.84Å; R377-E387 IonicContact NH2-OE1 3.01Å; R377-E387 PolarHBondContact NH2-OE1 3.17Å; F379-E387 HydrophobicContact CE1-CG 4.33Å; S383-E387 WeakPolarHBondContact CA-OE2 3.46Å; S383-E387 WeakPolarHBondContact CB-OE2 3.5Å; S383-E387 VanDerWaalsContact OG-CD 3.3Å; S383-E387 PolarHBondContact OG-OE1 3.45Å; S383-E387 PolarHBondContact OG-OE2 2.91Å; E387-F389 VanDerWaalsContact C-N 3.27Å; E387-F389 PolarHBondContact O-N 3.1Å; E387-E390 PolarHBondContact O-N 3.31Å; E387-E391 WeakPolarHBondContact O-CG 3.45Å; E387-E391 PolarHBondContact O-N 2.96Å
388	V	95.9	Very high	94.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-26.4	178.8	173.2	0	0	0	0	112.3	F379 K384 E386 L434 F638	F379-V388 HydrophobicContact CB-CG2 4.37Å; F379-V388 HydrophobicContact CD1-CG2 3.53Å; F379-V388 HydrophobicContact CD2-CG2 4.2Å; F379-V388 HydrophobicContact CE1-CB 4.32Å; F379-V388 HydrophobicContact CE1-CG2 3.7Å; F379-V388 HydrophobicContact CE2-CG2 4.34Å; F379-V388 HydrophobicContact CG-CG2 3.78Å; F379-V388 HydrophobicContact CZ-CB 4.41Å; F379-V388 HydrophobicContact CZ-CG2 4.1Å; K384-V388 WeakPolarHBondContact O-CB 3.46Å; K384-V388 VanDerWaalsContact O-CG2 3.23Å; K384-V388 WeakPolarHBondContact O-CG2 3.45Å; K384-V388 PolarHBondContact O-N 3.34Å; K384-V388 VanDerWaalsContact O-N 3.16Å; E386-V388 PolarHBondContact O-N 3.28Å; V388-L434 HydrophobicContact CG1-CD2 4.26Å; V388-F638 HydrophobicContact CG1-CE1 3.62Å; V388-F638 HydrophobicContact CG1-CZ 3.79Å
389	F	96.6	Very high	94.5	Very high	23 Å²	23	39 Å²	39	10%	0.101	21%	0.212	C	C	.	.	H	α-helix	trans	-83.6	-40.7	175.2	-179.5	-100.9	0	0	0	112.8	Q385 E386 E387 E391 I392 A393 V396 L434 R437 A438 H441	Q385-F389 WeakPolarHBondContact O-CB 3.02Å; Q385-F389 PolarHBondContact O-N 3.43Å; E386-F389 CarbonylContact O-C 3.6Å; E386-F389 WeakPolarHBondContact O-CA 3.36Å; E386-F389 WeakPolarHBondContact O-CB 3.37Å; E386-F389 PolarHBondContact O-N 2.67Å; E387-F389 VanDerWaalsContact C-N 3.27Å; E387-F389 PolarHBondContact O-N 3.1Å; F389-E391 VanDerWaalsContact C-N 3.3Å; F389-E391 PolarHBondContact O-N 3.23Å; F389-I392 HydrophobicContact CD2-CD1 4.19Å; F389-I392 HydrophobicContact CD2-CG1 3.96Å; F389-I392 HydrophobicContact CE2-CD1 4.42Å; F389-I392 HydrophobicContact CE2-CG1 4.34Å; F389-I392 CarbonylContact O-C 3.49Å; F389-I392 WeakPolarHBondContact O-CA 3.34Å; F389-I392 VanDerWaalsContact O-CG1 3.26Å; F389-I392 WeakPolarHBondContact O-CG1 3.39Å; F389-I392 PolarHBondContact O-N 2.83Å; F389-A393 HydrophobicContact CE1-CB 4Å; F389-A393 HydrophobicContact CZ-CB 4.3Å; F389-A393 PolarHBondContact O-N 3.45Å; F389-V396 HydrophobicContact CE2-CG2 4.38Å; F389-L434 HydrophobicContact CB-CD2 4.21Å; F389-L434 HydrophobicContact CD2-CD2 4.04Å; F389-R437 HydrophobicContact CB-CB 4.37Å; F389-R437 HydrophobicContact CD1-CB 3.96Å; F389-R437 HydrophobicContact CD2-CB 3.54Å; F389-R437 HydrophobicContact CE1-CB 4.15Å; F389-R437 HydrophobicContact CE2-CB 3.77Å; F389-R437 HydrophobicContact CG-CB 3.65Å; F389-R437 HydrophobicContact CG-CG 4.38Å; F389-R437 HydrophobicContact CZ-CB 4.08Å; F389-R437 WeakPolarHBondContact CZ-O 3.5Å; F389-A438 HydrophobicContact CE2-CB 4.02Å; F389-H441 HydrophobicContact CE1-CB 4.07Å; F389-H441 HydrophobicContact CZ-CB 3.74Å
390	E	95.4	Very high	94.3	Very high	128 Å²	128	39 Å²	39	60%	0.598	21%	0.212	S	C	*	.	H	α-helix	trans	-54.9	-44.9	179.8	-72.5	172.5	153.5	0	0	111.8	E386 E387 I392 A393	E386-E390 WeakPolarHBondContact O-CG 3.43Å; E386-E390 PolarHBondContact O-N 3.34Å; E387-E390 PolarHBondContact O-N 3.31Å; E390-I392 PolarHBondContact O-N 2.98Å; E390-I392 VanDerWaalsContact O-N 3.16Å; E390-A393 PolarHBondContact O-N 3.28Å
391	E	93.3	Very high	94.1	Very high	61 Å²	61	37.9 Å²	37.9	29%	0.285	20%	0.204	S	C	.	.	H	α-helix	trans	-60.3	-23.3	176.1	-67.1	-82.3	-154.4	0	0	113.5	F315 R377 F379 E387 F389	F315-E391 HydrophobicContact CE2-CB 3.97Å; F315-E391 HydrophobicContact CZ-CB 4.4Å; R377-E391 IonicContact CZ-OE1 2.73Å; R377-E391 VanDerWaalsContact CZ-OE1 3.31Å; R377-E391 IonicContact NE-OE1 3.4Å; R377-E391 PolarHBondContact NE-OE1 3.36Å; R377-E391 IonicContact NH2-OE1 2.68Å; R377-E391 PolarHBondContact NH2-OE1 3.11Å; F379-E391 HydrophobicContact CE1-CG 4.16Å; F379-E391 HydrophobicContact CZ-CB 4.15Å; F379-E391 HydrophobicContact CZ-CG 3.95Å; E387-E391 WeakPolarHBondContact O-CG 3.45Å; E387-E391 PolarHBondContact O-N 2.96Å; F389-E391 VanDerWaalsContact C-N 3.3Å; F389-E391 PolarHBondContact O-N 3.23Å
392	I	94.7	Very high	94.1	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-108.6	-7	178.9	78.2	146.8	0	0	0	114.5	F315 F389 E390 M394 L395 V396 I407 L434 L636 F638	F315-I392 HydrophobicContact CD2-CG2 4.19Å; F315-I392 HydrophobicContact CE2-CG2 3.66Å; F389-I392 HydrophobicContact CD2-CD1 4.19Å; F389-I392 HydrophobicContact CD2-CG1 3.96Å; F389-I392 HydrophobicContact CE2-CD1 4.42Å; F389-I392 HydrophobicContact CE2-CG1 4.34Å; F389-I392 CarbonylContact O-C 3.49Å; F389-I392 WeakPolarHBondContact O-CA 3.34Å; F389-I392 VanDerWaalsContact O-CG1 3.26Å; F389-I392 WeakPolarHBondContact O-CG1 3.39Å; F389-I392 PolarHBondContact O-N 2.83Å; E390-I392 PolarHBondContact O-N 2.98Å; E390-I392 VanDerWaalsContact O-N 3.16Å; I392-M394 VanDerWaalsContact C-N 3.28Å; I392-M394 PolarHBondContact O-N 3.43Å; I392-L395 CarbonylContact O-C 3.31Å; I392-L395 WeakPolarHBondContact O-CA 3.49Å; I392-L395 VanDerWaalsContact O-CB 3.29Å; I392-L395 WeakPolarHBondContact O-CB 3.19Å; I392-L395 PolarHBondContact O-N 3.15Å; I392-V396 HydrophobicContact CD1-CG2 3.91Å; I392-V396 HydrophobicContact CG1-CG2 4.43Å; I392-V396 PolarHBondContact O-N 3.36Å; I392-I407 HydrophobicContact CD1-CD1 3.58Å; I392-L434 HydrophobicContact CD1-CD1 4.11Å; I392-L434 HydrophobicContact CD1-CD2 3.75Å; I392-L434 HydrophobicContact CD1-CG 4.36Å; I392-L434 HydrophobicContact CG1-CD2 4.16Å; I392-L636 HydrophobicContact CB-CD2 4.25Å; I392-L636 HydrophobicContact CG2-CD2 3.35Å; I392-F638 HydrophobicContact CG2-CE2 4.24Å; I392-F638 HydrophobicContact CG2-CZ 3.93Å
393	A	95.1	Very high	94.1	Very high	17 Å²	17	33.7 Å²	33.7	14%	0.14	16%	0.163	C	C	.	.	H	α-helix	trans	-57	-44.3	-175.9	0	0	0	0	0	111.1	F389 E390 L395 V396 Q397 H441	F389-A393 HydrophobicContact CE1-CB 4Å; F389-A393 HydrophobicContact CZ-CB 4.3Å; F389-A393 PolarHBondContact O-N 3.45Å; E390-A393 PolarHBondContact O-N 3.28Å; A393-L395 VanDerWaalsContact C-N 3.29Å; A393-L395 PolarHBondContact O-N 3.49Å; A393-V396 WeakPolarHBondContact O-CB 3.41Å; A393-V396 PolarHBondContact O-N 2.87Å; A393-V396 VanDerWaalsContact O-N 3.15Å; A393-Q397 PolarHBondContact O-N 3.43Å; A393-H441 PolarHBondContact O-NE2 3.39Å
394	M	92.5	Very high	94.1	Very high	96 Å²	96	33.1 Å²	33.1	47%	0.473	16%	0.159	S	C	.	.	H	α-helix	trans	-64.3	-30	174.3	-67.7	-71.1	-82.6	0	0	113.3	H302 Q306 I392 S398	H302-M394 WeakPolarHBondContact CE1-CA 3.25Å; H302-M394 WeakPolarHBondContact CE1-CB 3.24Å; H302-M394 WeakPolarHBondContact CE1-CE 3.4Å; H302-M394 PolarHBondContact CE1-O 3.44Å; H302-M394 PolarHBondContact CE1-SD 3.11Å; H302-M394 VanDerWaalsContact ND1-CE 3.27Å; H302-M394 WeakPolarHBondContact ND1-CE 3.4Å; H302-M394 PolarHBondContact NE2-O 2.86Å; Q306-M394 PolarHBondContact NE2-O 3Å; I392-M394 VanDerWaalsContact C-N 3.28Å; I392-M394 PolarHBondContact O-N 3.43Å; M394-S398 PolarHBondContact O-OG 3.29Å
395	L	93.4	Very high	94.1	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-68.6	-46.6	172	172.9	62	0	0	0	110.1	I392 A393 Q397 S398 V405 I407 K634 L636	I392-L395 CarbonylContact O-C 3.31Å; I392-L395 WeakPolarHBondContact O-CA 3.49Å; I392-L395 VanDerWaalsContact O-CB 3.29Å; I392-L395 WeakPolarHBondContact O-CB 3.19Å; I392-L395 PolarHBondContact O-N 3.15Å; A393-L395 VanDerWaalsContact C-N 3.29Å; A393-L395 PolarHBondContact O-N 3.49Å; L395-Q397 VanDerWaalsContact C-N 3.34Å; L395-Q397 PolarHBondContact O-N 3Å; L395-S398 WeakPolarHBondContact O-CB 3.37Å; L395-S398 PolarHBondContact O-N 2.85Å; L395-S398 PolarHBondContact O-OG 3.1Å; L395-S398 VanDerWaalsContact O-OG 3.1Å; L395-V405 HydrophobicContact CD1-CG1 3.99Å; L395-V405 HydrophobicContact CD1-CG2 4.39Å; L395-V405 HydrophobicContact CD2-CG1 4.42Å; L395-V405 HydrophobicContact CG-CG1 3.91Å; L395-I407 HydrophobicContact CD2-CD1 4.04Å; L395-I407 HydrophobicContact CD2-CG1 4.26Å; L395-K634 HydrophobicContact CD1-CB 3.45Å; L395-K634 VanDerWaalsContact CD1-CB 3.45Å; L395-K634 HydrophobicContact CD1-CD 4.15Å; L395-K634 HydrophobicContact CD1-CG 4.38Å; L395-L636 HydrophobicContact CD2-CB 3.54Å; L395-L636 HydrophobicContact CD2-CD2 3.78Å; L395-L636 HydrophobicContact CD2-CG 4.3Å
396	V	94.9	Very high	94.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58	-43.2	175.6	171.6	0	0	0	0	111.6	F389 I392 A393 S398 A399 I407 A438 L442 L562	F389-V396 HydrophobicContact CE2-CG2 4.38Å; I392-V396 HydrophobicContact CD1-CG2 3.91Å; I392-V396 HydrophobicContact CG1-CG2 4.43Å; I392-V396 PolarHBondContact O-N 3.36Å; A393-V396 WeakPolarHBondContact O-CB 3.41Å; A393-V396 PolarHBondContact O-N 2.87Å; A393-V396 VanDerWaalsContact O-N 3.15Å; V396-S398 PolarHBondContact O-N 3.46Å; V396-S398 VanDerWaalsContact O-N 3.1Å; V396-A399 WeakPolarHBondContact O-CB 3.47Å; V396-A399 PolarHBondContact O-N 3.14Å; V396-I407 HydrophobicContact CG2-CD1 4.33Å; V396-A438 HydrophobicContact CG1-CB 4Å; V396-A438 HydrophobicContact CG2-CB 4.15Å; V396-L442 HydrophobicContact CG1-CD1 3.99Å; V396-L442 HydrophobicContact CG1-CD2 3.72Å; V396-L442 HydrophobicContact CG1-CG 3.67Å; V396-L562 HydrophobicContact CG1-CD2 4.18Å
397	Q	93.7	Very high	94.4	Very high	11 Å²	11	21.2 Å²	21.2	5%	0.051	11%	0.105	C	C	.	.	H	α-helix	trans	-54.3	-29.8	174	178.2	56.7	36.5	0	0	113.2	H302 A393 L395 A399 L400 D401	H302-Q397 VanDerWaalsContact CE1-CB 3.49Å; H302-Q397 WeakPolarHBondContact CE1-CB 3.47Å; A393-Q397 PolarHBondContact O-N 3.43Å; L395-Q397 VanDerWaalsContact C-N 3.34Å; L395-Q397 PolarHBondContact O-N 3Å; Q397-A399 PolarHBondContact O-N 2.79Å; Q397-A399 VanDerWaalsContact O-N 3.1Å; Q397-L400 PolarHBondContact O-N 2.87Å; Q397-L400 VanDerWaalsContact O-N 3.07Å; Q397-D401 PolarHBondContact NE2-OD1 2.69Å; Q397-D401 PolarHBondContact O-N 2.87Å
398	S	94.6	Very high	94.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-22.6	179.3	-49.6	0	0	0	0	112.9	H302 M394 L395 V396 D401 G402 Y403	H302-S398 WeakPolarHBondContact NE2-CA 3.46Å; H302-S398 WeakPolarHBondContact NE2-CB 3.23Å; H302-S398 PolarHBondContact NE2-N 3.35Å; H302-S398 PolarHBondContact NE2-OG 3.5Å; M394-S398 PolarHBondContact O-OG 3.29Å; L395-S398 WeakPolarHBondContact O-CB 3.37Å; L395-S398 PolarHBondContact O-N 2.85Å; L395-S398 PolarHBondContact O-OG 3.1Å; L395-S398 VanDerWaalsContact O-OG 3.1Å; V396-S398 PolarHBondContact O-N 3.46Å; V396-S398 VanDerWaalsContact O-N 3.1Å; S398-D401 PolarHBondContact O-N 3.27Å; S398-G402 PolarHBondContact O-N 3.11Å; S398-Y403 WeakPolarHBondContact O-CB 3.26Å; S398-Y403 PolarHBondContact O-N 2.97Å
399	A	94.1	Very high	94.4	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.008	9%	0.093	C	C	.	.	H	α-helix	trans	-73.5	-36.2	175.6	0	0	0	0	0	112.8	V396 Q397 D401 G402 Y403 V405 I547 L562	V396-A399 WeakPolarHBondContact O-CB 3.47Å; V396-A399 PolarHBondContact O-N 3.14Å; Q397-A399 PolarHBondContact O-N 2.79Å; Q397-A399 VanDerWaalsContact O-N 3.1Å; A399-D401 VanDerWaalsContact C-N 3.31Å; A399-G402 PolarHBondContact O-N 2.84Å; A399-Y403 WeakPolarHBondContact CA-O 3.27Å; A399-V405 HydrophobicContact CB-CG2 4.07Å; A399-I547 HydrophobicContact CB-CD1 3.61Å; A399-L562 HydrophobicContact CB-CB 4.1Å
400	L	92.2	Very high	94.4	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-68.1	-32.1	170.2	-75.7	168	0	0	0	112.4	Q397 G402 L442 V445 A446 Y456 F458 I547	Q397-L400 PolarHBondContact O-N 2.87Å; Q397-L400 VanDerWaalsContact O-N 3.07Å; L400-G402 PolarHBondContact O-N 2.86Å; L400-L442 HydrophobicContact CD1-CD2 3.74Å; L400-L442 HydrophobicContact CD2-CD2 4.44Å; L400-L442 HydrophobicContact CG-CD2 3.64Å; L400-V445 HydrophobicContact CD1-CB 3.85Å; L400-V445 HydrophobicContact CD1-CG1 3.98Å; L400-A446 HydrophobicContact CD2-CB 4.36Å; L400-Y456 HydrophobicContact CB-CE1 4.34Å; L400-Y456 HydrophobicContact CD2-CD1 3.55Å; L400-Y456 HydrophobicContact CD2-CD2 4.41Å; L400-Y456 HydrophobicContact CD2-CE1 3.49Å; L400-Y456 VanDerWaalsContact CD2-CE1 3.49Å; L400-Y456 HydrophobicContact CD2-CE2 4.36Å; L400-Y456 HydrophobicContact CD2-CG 4.03Å; L400-Y456 PolarHBondContact O-OH 3.37Å; L400-Y456 VanDerWaalsContact O-OH 3.05Å; L400-F458 HydrophobicContact CD2-CE1 4.06Å; L400-F458 HydrophobicContact CD2-CZ 3.98Å; L400-I547 HydrophobicContact CD2-CG2 4.02Å
401	D	91.5	Very high	94.3	Very high	11 Å²	11	12.3 Å²	12.3	6%	0.059	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-7.8	177.6	-70	9.3	0	0	0	112.8	R298 R299 H302 Q397 S398 A399 Y403	R298-D401 IonicContact CZ-OD1 3.17Å; R298-D401 IonicContact CZ-OD2 2.73Å; R298-D401 IonicContact NH1-OD1 3.05Å; R298-D401 PolarHBondContact NH1-OD1 2.9Å; R298-D401 IonicContact NH1-OD2 2.8Å; R298-D401 PolarHBondContact NH1-OD2 2.63Å; R298-D401 IonicContact NH2-OD1 3.65Å; R298-D401 PolarHBondContact NH2-OD1 3.42Å; R298-D401 IonicContact NH2-OD2 2.82Å; R298-D401 PolarHBondContact NH2-OD2 2.95Å; R299-D401 HydrophobicContact CG-CB 4.29Å; H302-D401 IonicContact CD2-OD2 3.62Å; H302-D401 PolarHBondContact CD2-OD2 2.88Å; H302-D401 VanDerWaalsContact CD2-OD2 3.25Å; H302-D401 IonicContact CG-OD2 3.99Å; Q397-D401 PolarHBondContact NE2-OD1 2.69Å; Q397-D401 PolarHBondContact O-N 2.87Å; S398-D401 PolarHBondContact O-N 3.27Å; A399-D401 VanDerWaalsContact C-N 3.31Å; D401-Y403 HydrophobicContact CB-CD2 4.16Å; D401-Y403 HydrophobicContact CB-CE2 4.27Å
402	G	91.9	Very high	94.1	Very high	8 Å²	8	10.1 Å²	10.1	8%	0.082	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.4	18	173.7	0	0	0	0	0	116.4	S398 A399 L400	S398-G402 PolarHBondContact O-N 3.11Å; A399-G402 PolarHBondContact O-N 2.84Å; L400-G402 PolarHBondContact O-N 2.86Å
403	Y	92.4	Very high	93.9	Very high	22 Å²	22	12.7 Å²	12.7	9%	0.086	7%	0.069	C	C	.	.			trans	-106.3	134.1	176.6	-59.5	-90	0	0	0	111.4	N303 S398 A399 D401 V405 A560 K634 A671	N303-Y403 HydrophobicContact CB-CE1 4.41Å; N303-Y403 HydrophobicContact CB-CE2 3.94Å; N303-Y403 WeakPolarHBondContact CB-OH 3.49Å; N303-Y403 WeakPolarHBondContact OD1-CE1 3.41Å; S398-Y403 WeakPolarHBondContact O-CB 3.26Å; S398-Y403 PolarHBondContact O-N 2.97Å; A399-Y403 WeakPolarHBondContact CA-O 3.27Å; D401-Y403 HydrophobicContact CB-CD2 4.16Å; D401-Y403 HydrophobicContact CB-CE2 4.27Å; Y403-V405 PolarHBondContact O-N 3.07Å; Y403-A560 VanDerWaalsContact C-CB 3.42Å; Y403-A560 WeakPolarHBondContact O-CB 3.21Å; Y403-K634 VanDerWaalsContact CD1-NZ 3.3Å; Y403-K634 VanDerWaalsContact CG-NZ 3.32Å; Y403-A671 HydrophobicContact CE1-CB 3.62Å
404	P	94.1	Very high	93.5	Very high	5 Å²	5	14.2 Å²	14.2	3%	0.032	9%	0.086	C	C	.	.			trans	-58.8	136.9	172.6	-22.6	33.4	0	0	0	111.5	P561 A633 K634	P404-P561 HydrophobicContact CB-CG 4.32Å; P404-A633 HydrophobicContact CB-CB 4.09Å; P404-A633 VanDerWaalsContact O-CA 3.3Å; P404-A633 WeakPolarHBondContact O-CA 3.33Å; P404-K634 PolarHBondContact O-N 3.1Å
405	V	96.3	Very high	93.5	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.2	177.6	179.1	0	0	0	0	109.4	L395 A399 Y403 I407 P561 L562 N563 K634	L395-V405 HydrophobicContact CD1-CG1 3.99Å; L395-V405 HydrophobicContact CD1-CG2 4.39Å; L395-V405 HydrophobicContact CD2-CG1 4.42Å; L395-V405 HydrophobicContact CG-CG1 3.91Å; A399-V405 HydrophobicContact CB-CG2 4.07Å; Y403-V405 PolarHBondContact O-N 3.07Å; V405-I407 HydrophobicContact CG1-CD1 4.32Å; V405-I407 HydrophobicContact CG1-CG1 4Å; V405-P561 PolarHBondContact N-O 3.33Å; V405-L562 HydrophobicContact CB-CD1 3.67Å; V405-L562 HydrophobicContact CG1-CD1 3.51Å; V405-N563 PolarHBondContact O-N 2.9Å; V405-N563 PolarHBondContact O-ND2 2.97Å; V405-K634 WeakPolarHBondContact CA-O 3.31Å
406	C	96.5	Very high	93.5	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	118.3	175.8	-164.6	0	0	0	0	110.7	F408 N563 S628 K634 M635 L636	C406-F408 HydrophobicContact CB-CE2 4.31Å; C406-F408 VanDerWaalsContact SG-CE2 3.54Å; C406-F408 WeakPolarHBondContact SG-CZ 3.38Å; C406-N563 WeakPolarHBondContact CA-O 3.26Å; C406-N563 HydrophobicContact CB-CB 4.38Å; C406-S628 VanDerWaalsContact CB-O 3.22Å; C406-S628 WeakPolarHBondContact CB-O 3.22Å; C406-K634 PolarHBondContact N-O 3.37Å; C406-M635 WeakPolarHBondContact O-CA 3.39Å; C406-L636 PolarHBondContact O-N 2.91Å
407	I	97.6	Very high	93.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.1	-179.7	-46.9	-172.9	0	0	0	109.1	I392 L395 V396 V405 M421 L434 N563 L564 V565 L636 F638	I392-I407 HydrophobicContact CD1-CD1 3.58Å; L395-I407 HydrophobicContact CD2-CD1 4.04Å; L395-I407 HydrophobicContact CD2-CG1 4.26Å; V396-I407 HydrophobicContact CG2-CD1 4.33Å; V405-I407 HydrophobicContact CG1-CD1 4.32Å; V405-I407 HydrophobicContact CG1-CG1 4Å; I407-M421 HydrophobicContact CB-CE 4.37Å; I407-M421 HydrophobicContact CG2-CE 3.97Å; I407-M421 VanDerWaalsContact O-CE 3.31Å; I407-M421 WeakPolarHBondContact O-CE 3.44Å; I407-L434 HydrophobicContact CG2-CD1 4.46Å; I407-N563 PolarHBondContact N-O 3.46Å; I407-L564 HydrophobicContact CB-CD2 3.8Å; I407-L564 HydrophobicContact CD1-CD2 3.84Å; I407-L564 HydrophobicContact CG1-CD2 3.91Å; I407-V565 PolarHBondContact O-N 3.03Å; I407-L636 CarbonylContact C-O 3.54Å; I407-L636 VanDerWaalsContact CA-O 3.3Å; I407-L636 WeakPolarHBondContact CA-O 3.31Å; I407-L636 HydrophobicContact CG1-CB 4.41Å; I407-L636 HydrophobicContact CG2-CB 4.21Å; I407-L636 HydrophobicContact CG2-CD2 4.09Å; I407-L636 HydrophobicContact CG2-CG 4.18Å; I407-F638 HydrophobicContact CG2-CD2 3.88Å; I407-F638 HydrophobicContact CG2-CE2 3.89Å
408	F	95.4	Very high	93.3	Very high	1 Å²	1	13 Å²	13	0%	0.004	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	145.8	179.1	-61.8	-81.1	0	0	0	111.4	C406 M421 V565 L567 L600 L625 L629 M635 L636 M637 F638	C406-F408 HydrophobicContact CB-CE2 4.31Å; C406-F408 VanDerWaalsContact SG-CE2 3.54Å; C406-F408 WeakPolarHBondContact SG-CZ 3.38Å; F408-M421 VanDerWaalsContact C-CE 3.5Å; F408-V565 CarbonylContact C-O 3.54Å; F408-V565 WeakPolarHBondContact CA-O 3.44Å; F408-V565 HydrophobicContact CD1-CB 3.72Å; F408-V565 HydrophobicContact CD1-CG1 3.79Å; F408-V565 HydrophobicContact CD1-CG2 4.22Å; F408-V565 HydrophobicContact CE1-CB 4.09Å; F408-V565 HydrophobicContact CE1-CG1 4.03Å; F408-V565 HydrophobicContact CE1-CG2 4.13Å; F408-L567 HydrophobicContact CB-CD1 4.23Å; F408-L567 HydrophobicContact CD1-CD1 4Å; F408-L567 HydrophobicContact CD1-CD2 4.08Å; F408-L567 HydrophobicContact CD1-CG 4.17Å; F408-L567 HydrophobicContact CG-CD1 4.47Å; F408-L600 HydrophobicContact CD1-CD2 4.16Å; F408-L600 HydrophobicContact CE1-CD1 4.32Å; F408-L600 HydrophobicContact CE1-CD2 3.93Å; F408-L600 HydrophobicContact CZ-CD1 4.03Å; F408-L600 HydrophobicContact CZ-CD2 4.34Å; F408-L625 HydrophobicContact CE1-CD1 3.61Å; F408-L625 HydrophobicContact CZ-CD1 3.84Å; F408-L629 HydrophobicContact CE2-CD2 4.07Å; F408-L629 HydrophobicContact CZ-CD2 3.76Å; F408-M635 HydrophobicContact CD2-CG 4.18Å; F408-M635 HydrophobicContact CE2-CG 3.88Å; F408-M635 HydrophobicContact CE2-SD 4.06Å; F408-L636 PolarHBondContact N-O 3.26Å; F408-M637 HydrophobicContact CB-CB 4.38Å; F408-M637 HydrophobicContact CB-CG 4.17Å; F408-F638 WeakPolarHBondContact O-CB 3.49Å; F408-F638 PolarHBondContact O-N 3.06Å
409	A	96.7	Very high	93.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.1	157.7	0	0	0	0	0	108.7	K417 M421 V565 L567	A409-K417 HydrophobicContact CB-CB 3.83Å; A409-K417 HydrophobicContact CB-CG 4.28Å; A409-M421 HydrophobicContact CB-CE 3.87Å; A409-M421 HydrophobicContact CB-CG 3.91Å; A409-V565 PolarHBondContact N-O 3.4Å; A409-L567 VanDerWaalsContact O-CB 3.24Å; A409-L567 WeakPolarHBondContact O-CB 3.37Å; A409-L567 WeakPolarHBondContact O-CG 3.47Å; A409-L567 PolarHBondContact O-N 3.37Å; A409-L567 VanDerWaalsContact O-N 3.15Å
410	Y	95.6	Very high	93.4	Very high	20 Å²	20	16.3 Å²	16.3	8%	0.078	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	155.1	-171	176.9	-105.5	0	0	0	111.7	L567 S570 L597 M637 F638 V639 N640 F657	Y410-L567 HydrophobicContact CD2-CD1 3.94Å; Y410-L567 HydrophobicContact CG-CD1 4.46Å; Y410-S570 WeakPolarHBondContact OH-CB 3.39Å; Y410-L597 HydrophobicContact CD2-CD2 4.16Å; Y410-L597 HydrophobicContact CE2-CD1 4.3Å; Y410-L597 HydrophobicContact CE2-CD2 4.07Å; Y410-M637 HydrophobicContact CD1-SD 4.29Å; Y410-M637 HydrophobicContact CG-SD 4.19Å; Y410-F638 PolarHBondContact N-O 3.42Å; Y410-V639 HydrophobicContact CD1-CG2 4.22Å; Y410-N640 PolarHBondContact O-N 3.26Å; Y410-F657 AromaticContact CD1-CD1 3.85Å; Y410-F657 HydrophobicContact CD1-CD1 3.85Å; Y410-F657 HydrophobicContact CD1-CE1 4.35Å; Y410-F657 HydrophobicContact CE1-CB 3.98Å; Y410-F657 AromaticContact CE1-CD1 3.35Å; Y410-F657 HydrophobicContact CE1-CD1 3.35Å; Y410-F657 HydrophobicContact CE1-CE1 4.12Å; Y410-F657 AromaticContact CE1-CG 3.92Å; Y410-F657 HydrophobicContact CE1-CG 3.92Å; Y410-F657 HydrophobicContact CE2-CD1 4.26Å; Y410-F657 HydrophobicContact CE2-CE1 4.34Å; Y410-F657 HydrophobicContact CG-CD1 4.48Å; Y410-F657 AromaticContact CZ-CD1 3.59Å; Y410-F657 AromaticContact CZ-CG 3.95Å
411	G	93.7	Very high	93.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.102	C	C	.	.	S	Bend	trans	126.3	-177.8	179.8	0	0	0	0	0	112.8	K417 S570	G411-K417 WeakPolarHBondContact O-CE 3.25Å; G411-K417 PolarHBondContact O-NZ 3.37Å; G411-S570 WeakPolarHBondContact CA-OG 3.23Å; G411-S570 PolarHBondContact O-N 2.79Å; G411-S570 VanDerWaalsContact O-N 3.16Å; G411-S570 PolarHBondContact O-OG 3.1Å
412	Q	90.2	Very high	93.5	Very high	15 Å²	15	17.6 Å²	17.6	7%	0.07	11%	0.108	C	C	.	.	S	Bend	trans	-66.1	164.8	-176.2	63.6	168.6	94.1	0	0	114.1	S415 K417 S570 E571 N647 E650	Q412-S415 PolarHBondContact O-N 3.04Å; Q412-S415 PolarHBondContact O-OG 3.42Å; Q412-S415 VanDerWaalsContact O-OG 3.06Å; Q412-K417 VanDerWaalsContact C-NZ 3.31Å; Q412-K417 PolarHBondContact O-NZ 2.93Å; Q412-S570 PolarHBondContact N-OG 3.1Å; Q412-E571 VanDerWaalsContact CA-OE2 3.3Å; Q412-E571 WeakPolarHBondContact CA-OE2 3.46Å; Q412-N647 PolarHBondContact NE2-OD1 2.98Å; Q412-E650 HydrophobicContact CB-CB 4.32Å
413	T	89.3	Confident	93.4	Very high	54 Å²	54	17.9 Å²	17.9	33%	0.331	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	138.5	163.7	-66.5	0	0	0	0	110.9	S415 S537 E571	T413-S415 PolarHBondContact O-N 2.73Å; T413-S537 WeakPolarHBondContact OG1-CB 3.41Å; T413-E571 WeakPolarHBondContact CB-OE1 3.47Å; T413-E571 PolarHBondContact N-OE2 3.37Å; T413-E571 PolarHBondContact OG1-OE1 3.18Å; T413-E571 PolarHBondContact OG1-OE2 2.93Å
414	G	87.3	Confident	92.9	Very high	49 Å²	49	18.1 Å²	18.1	51%	0.505	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-3.3	-178.8	0	0	0	0	0	115.8	R319 G416	R319-G414 PolarHBondContact NE-O 2.94Å; G414-G416 PolarHBondContact O-N 3.35Å
415	S	91.9	Very high	91.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-81.9	-5.9	-178.1	73.1	0	0	0	0	115.9	Q412 T413 N640	Q412-S415 PolarHBondContact O-N 3.04Å; Q412-S415 PolarHBondContact O-OG 3.42Å; Q412-S415 VanDerWaalsContact O-OG 3.06Å; T413-S415 PolarHBondContact O-N 2.73Å; S415-N640 WeakPolarHBondContact CB-O 3.4Å; S415-N640 VanDerWaalsContact OG-CB 3.3Å; S415-N640 WeakPolarHBondContact OG-CB 3.47Å; S415-N640 PolarHBondContact OG-O 3.49Å
416	G	92.7	Very high	90.3	Very high	17 Å²	17	31.2 Å²	31.2	18%	0.175	18%	0.183	C	C	.	.	S	Bend	trans	102.7	17.7	176.1	0	0	0	0	0	116.6	G414 F419 T420	G414-G416 PolarHBondContact O-N 3.35Å; G416-F419 PolarHBondContact O-N 2.94Å; G416-T420 PolarHBondContact O-N 3.44Å; G416-T420 PolarHBondContact O-OG1 3.13Å
417	K	94.1	Very high	88.8	Confident	14 Å²	14	35 Å²	35	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-56.2	-60.2	177.4	-57.9	-171.4	-65.4	-75.4	0	113.4	A409 G411 Q412 F419 T420 M421 D566 L567 N640	A409-K417 HydrophobicContact CB-CB 3.83Å; A409-K417 HydrophobicContact CB-CG 4.28Å; G411-K417 WeakPolarHBondContact O-CE 3.25Å; G411-K417 PolarHBondContact O-NZ 3.37Å; Q412-K417 VanDerWaalsContact C-NZ 3.31Å; Q412-K417 PolarHBondContact O-NZ 2.93Å; K417-F419 VanDerWaalsContact C-N 3.29Å; K417-F419 PolarHBondContact O-N 2.87Å; K417-T420 WeakPolarHBondContact O-CA 3.48Å; K417-T420 VanDerWaalsContact O-CB 3.29Å; K417-T420 WeakPolarHBondContact O-CB 3.37Å; K417-T420 PolarHBondContact O-N 2.74Å; K417-M421 PolarHBondContact O-N 3.48Å; K417-D566 WeakPolarHBondContact CB-OD1 3.39Å; K417-L567 WeakPolarHBondContact CE-O 3.48Å; K417-N640 WeakPolarHBondContact CA-OD1 3.35Å; K417-N640 HydrophobicContact CG-CB 3.95Å
418	T	92.1	Very high	88	Confident	54 Å²	54	38 Å²	38	33%	0.331	24%	0.238	S	C	.	.	H	α-helix	trans	-61.7	-34.8	178.7	-39.6	0	0	0	0	112.5	T420 M421 E422 G423 D566	T418-T420 VanDerWaalsContact C-N 3.28Å; T418-T420 PolarHBondContact O-N 3Å; T418-M421 PolarHBondContact O-N 2.96Å; T418-E422 HydrophobicContact CG2-CB 4.48Å; T418-E422 HydrophobicContact CG2-CG 4.27Å; T418-E422 WeakPolarHBondContact CG2-OE2 3.49Å; T418-E422 PolarHBondContact O-N 3.27Å; T418-G423 PolarHBondContact O-N 3.46Å; T418-D566 WeakPolarHBondContact CA-OD2 3.35Å; T418-D566 VanDerWaalsContact CB-OD2 3.32Å; T418-D566 WeakPolarHBondContact CB-OD2 3.42Å; T418-D566 WeakPolarHBondContact CG2-OD2 3.39Å; T418-D566 PolarHBondContact N-OD1 2.93Å; T418-D566 PolarHBondContact OG1-OD2 2.82Å
419	F	93.3	Very high	87.4	Confident	71 Å²	71	41.7 Å²	41.7	31%	0.311	26%	0.262	S	S	.	.	H	α-helix	trans	-65.3	-31.5	171.9	-179.8	-96.1	0	0	0	112.4	Q385 G416 K417 G423 L431	Q385-F419 HydrophobicContact CG-CE1 4.28Å; Q385-F419 HydrophobicContact CG-CZ 4.23Å; Q385-F419 PolarHBondContact NE2-O 2.83Å; G416-F419 PolarHBondContact O-N 2.94Å; K417-F419 VanDerWaalsContact C-N 3.29Å; K417-F419 PolarHBondContact O-N 2.87Å; F419-G423 VanDerWaalsContact O-CA 3.3Å; F419-G423 WeakPolarHBondContact O-CA 3.49Å; F419-G423 PolarHBondContact O-N 2.94Å; F419-L431 HydrophobicContact CE2-CD2 4.36Å; F419-L431 HydrophobicContact CZ-CD2 4.16Å
420	T	96.1	Very high	86.9	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-71.8	-44.2	173.1	-57.3	0	0	0	0	110.8	R317 G416 K417 T418 G433 L434 F638 N640	R317-T420 PolarHBondContact NH1-OG1 3.47Å; G416-T420 PolarHBondContact O-N 3.44Å; G416-T420 PolarHBondContact O-OG1 3.13Å; K417-T420 WeakPolarHBondContact O-CA 3.48Å; K417-T420 VanDerWaalsContact O-CB 3.29Å; K417-T420 WeakPolarHBondContact O-CB 3.37Å; K417-T420 PolarHBondContact O-N 2.74Å; T418-T420 VanDerWaalsContact C-N 3.28Å; T418-T420 PolarHBondContact O-N 3Å; T420-G433 WeakPolarHBondContact O-CA 3.48Å; T420-L434 HydrophobicContact CG2-CD1 3.83Å; T420-L434 HydrophobicContact CG2-CG 4.18Å; T420-L434 WeakPolarHBondContact O-CG 3.46Å; T420-L434 PolarHBondContact O-N 3.34Å; T420-F638 HydrophobicContact CG2-CD1 4.38Å; T420-F638 HydrophobicContact CG2-CD2 4.47Å; T420-F638 HydrophobicContact CG2-CG 4.26Å; T420-N640 PolarHBondContact OG1-ND2 3.26Å
421	M	94.8	Very high	86.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-77.8	-57.9	-177.2	-73.4	-65.3	175.6	0	0	114.2	I407 F408 A409 K417 T418 G433 L434 I435 L564 D566	I407-M421 HydrophobicContact CB-CE 4.37Å; I407-M421 HydrophobicContact CG2-CE 3.97Å; I407-M421 VanDerWaalsContact O-CE 3.31Å; I407-M421 WeakPolarHBondContact O-CE 3.44Å; F408-M421 VanDerWaalsContact C-CE 3.5Å; A409-M421 HydrophobicContact CB-CE 3.87Å; A409-M421 HydrophobicContact CB-CG 3.91Å; K417-M421 PolarHBondContact O-N 3.48Å; T418-M421 PolarHBondContact O-N 2.96Å; M421-G433 CarbonylContact O-C 3.47Å; M421-L434 PolarHBondContact O-N 3.41Å; M421-L434 VanDerWaalsContact O-N 3.12Å; M421-L434 HydrophobicContact SD-CD1 4.38Å; M421-I435 HydrophobicContact CB-CD1 4.19Å; M421-I435 VanDerWaalsContact O-CG1 3.32Å; M421-I435 WeakPolarHBondContact O-CG1 3.48Å; M421-I435 PolarHBondContact O-N 3.14Å; M421-L564 HydrophobicContact SD-CB 4.15Å; M421-D566 HydrophobicContact CB-CB 4.32Å; M421-D566 HydrophobicContact CG-CB 4.16Å
422	E	91.6	Very high	86.5	Confident	39 Å²	39	52.5 Å²	52.5	18%	0.182	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-49.1	-176	-61.7	-174.6	153.1	0	0	111.6	T418 G433 I435 Y462	T418-E422 HydrophobicContact CG2-CB 4.48Å; T418-E422 HydrophobicContact CG2-CG 4.27Å; T418-E422 WeakPolarHBondContact CG2-OE2 3.49Å; T418-E422 PolarHBondContact O-N 3.27Å; E422-G433 PolarHBondContact O-N 3.24Å; E422-I435 HydrophobicContact CG-CD1 4.18Å; E422-Y462 PolarHBondContact OE1-OH 2.88Å
423	G	90.5	Very high	86.6	Confident	14 Å²	14	51.8 Å²	51.8	14%	0.144	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	126.2	-161	179.6	0	0	0	0	0	114.5	T418 F419 L431 G433	T418-G423 PolarHBondContact O-N 3.46Å; F419-G423 VanDerWaalsContact O-CA 3.3Å; F419-G423 WeakPolarHBondContact O-CA 3.49Å; F419-G423 PolarHBondContact O-N 2.94Å; G423-L431 CarbonylContact C-O 3.5Å; G423-L431 WeakPolarHBondContact CA-O 3.41Å; G423-G433 VanDerWaalsContact CA-N 3.34Å
424	G	81.7	Confident	86.9	Confident	27 Å²	27	49.2 Å²	49.2	28%	0.278	30%	0.296	S	S	.	.	S	Bend	trans	-81	-176.2	169.5	0	0	0	0	0	113.7	L431	G424-L431 PolarHBondContact N-O 2.96Å
425	P	69.2	Low	87.3	Confident	116 Å²	116	47 Å²	47	75%	0.753	27%	0.272	S	S	*	.	S	Bend	trans	-57.1	152.6	173	-24.2	35.4	0	0	0	113	G427	P425-G427 PolarHBondContact O-N 3.1Å
426	R	66.7	Low	87.4	Confident	164 Å²	164	47.5 Å²	47.5	62%	0.619	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	131	-170	-163.5	178.8	-161.2	176	7.4	113.1	E515 H519	R426-E515 IonicContact CZ-OE1 3.18Å; R426-E515 IonicContact NE-OE1 3.08Å; R426-E515 PolarHBondContact NE-OE1 2.87Å; R426-E515 IonicContact NH2-OE1 2.73Å; R426-E515 PolarHBondContact NH2-OE1 3.07Å; R426-H519 WeakPolarHBondContact CD-NE2 3.36Å; R426-H519 WeakPolarHBondContact CG-NE2 3.34Å; R426-H519 PolarHBondContact NE-CD2 3.02Å; R426-H519 PolarHBondContact NE-NE2 3.47Å; R426-H519 VanDerWaalsContact NE-NE2 3.1Å; R426-H519 PolarHBondContact NH2-CD2 3.34Å; R426-H519 VanDerWaalsContact NH2-CD2 3.28Å
427	G	64.5	Low	87.5	Confident	78 Å²	78	47.4 Å²	47.4	80%	0.804	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.2	-8.9	166.3	0	0	0	0	0	116.4	P425	P425-G427 PolarHBondContact O-N 3.1Å
428	D	81.2	Confident	87.6	Confident	64 Å²	64	46.8 Å²	46.8	34%	0.342	27%	0.267	S	S	.	.			trans	-111.3	108.4	177.2	-173.4	-8.1	0	0	0	112.2	Q430 L431 E432	D428-Q430 PolarHBondContact O-N 2.94Å; D428-Q430 VanDerWaalsContact O-N 3.14Å; D428-Q430 VanDerWaalsContact OD1-CB 3.32Å; D428-Q430 WeakPolarHBondContact OD1-CB 3.14Å; D428-Q430 PolarHBondContact OD1-N 3.3Å; D428-L431 HydrophobicContact CB-CB 4.29Å; D428-L431 HydrophobicContact CB-CD1 4.1Å; D428-L431 HydrophobicContact CB-CG 4.13Å; D428-L431 PolarHBondContact O-N 3.3Å; D428-L431 WeakPolarHBondContact OD2-CG 3.46Å; D428-E432 PolarHBondContact O-N 3.21Å
429	P	81.4	Confident	87.7	Confident	78 Å²	78	44.2 Å²	44.2	51%	0.506	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.8	175.3	-24.8	35.6	0	0	0	115.3	R437	P429-R437 PolarHBondContact O-NH2 3.47Å
430	Q	86.2	Confident	87.8	Confident	141 Å²	141	45.3 Å²	45.3	66%	0.659	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-24.7	175	-55.3	-169.7	20.9	0	0	112.2	Q385 D428 R437	Q385-Q430 WeakPolarHBondContact CG-O 3.14Å; D428-Q430 PolarHBondContact O-N 2.94Å; D428-Q430 VanDerWaalsContact O-N 3.14Å; D428-Q430 VanDerWaalsContact OD1-CB 3.32Å; D428-Q430 WeakPolarHBondContact OD1-CB 3.14Å; D428-Q430 PolarHBondContact OD1-N 3.3Å; Q430-R437 PolarHBondContact O-NH2 2.88Å
431	L	89.1	Confident	87.7	Confident	64 Å²	64	47.6 Å²	47.6	34%	0.335	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-9.6	-177.3	-60.3	180	0	0	0	114	Q385 F419 G423 G424 D428 G433	Q385-L431 PolarHBondContact NE2-O 2.76Å; F419-L431 HydrophobicContact CE2-CD2 4.36Å; F419-L431 HydrophobicContact CZ-CD2 4.16Å; G423-L431 CarbonylContact C-O 3.5Å; G423-L431 WeakPolarHBondContact CA-O 3.41Å; G424-L431 PolarHBondContact N-O 2.96Å; D428-L431 HydrophobicContact CB-CB 4.29Å; D428-L431 HydrophobicContact CB-CD1 4.1Å; D428-L431 HydrophobicContact CB-CG 4.13Å; D428-L431 PolarHBondContact O-N 3.3Å; D428-L431 WeakPolarHBondContact OD2-CG 3.46Å; L431-G433 PolarHBondContact O-N 3.2Å
432	E	92.1	Very high	87.8	Confident	42 Å²	42	47.6 Å²	47.6	20%	0.196	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-47.5	132.4	170.3	-73.8	170.9	174.7	0	0	112.7	Q385 D428 P436 R437 R440	Q385-E432 VanDerWaalsContact CB-O 3.23Å; Q385-E432 WeakPolarHBondContact CB-O 3.49Å; Q385-E432 WeakPolarHBondContact CG-O 3.48Å; Q385-E432 PolarHBondContact NE2-O 2.8Å; D428-E432 PolarHBondContact O-N 3.21Å; E432-P436 HydrophobicContact CB-CG 3.89Å; E432-P436 HydrophobicContact CG-CG 4.23Å; E432-R437 HydrophobicContact CB-CG 4.48Å; E432-R437 PolarHBondContact O-NE 3.48Å; E432-R437 PolarHBondContact O-NH2 2.72Å; E432-R440 IonicContact OE1-CZ 2.67Å; E432-R440 IonicContact OE1-NH2 3.34Å; E432-R440 PolarHBondContact OE1-NH2 3.27Å; E432-R440 IonicContact OE2-CZ 3.17Å; E432-R440 IonicContact OE2-NH1 3.1Å; E432-R440 PolarHBondContact OE2-NH1 3.4Å; E432-R440 IonicContact OE2-NH2 3.45Å; E432-R440 PolarHBondContact OE2-NH2 2.91Å
433	G	93.8	Very high	88	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.261	C	S	.	.			trans	-83.3	-167.3	178.3	0	0	0	0	0	114.3	T420 M421 E422 G423 L431 I435 P436 R437	T420-G433 WeakPolarHBondContact O-CA 3.48Å; M421-G433 CarbonylContact O-C 3.47Å; E422-G433 PolarHBondContact O-N 3.24Å; G423-G433 VanDerWaalsContact CA-N 3.34Å; L431-G433 PolarHBondContact O-N 3.2Å; G433-I435 PolarHBondContact O-N 2.71Å; G433-P436 WeakPolarHBondContact O-CD 3.48Å; G433-P436 WeakPolarHBondContact O-CG 3.46Å; G433-R437 WeakPolarHBondContact O-CG 3.48Å
434	L	95.6	Very high	88.2	Confident	1 Å²	1	49 Å²	49	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-34.3	-177.2	-64.9	-179.3	0	0	0	113.6	V388 F389 I392 I407 T420 M421 A438 F638	V388-L434 HydrophobicContact CG1-CD2 4.26Å; F389-L434 HydrophobicContact CB-CD2 4.21Å; F389-L434 HydrophobicContact CD2-CD2 4.04Å; I392-L434 HydrophobicContact CD1-CD1 4.11Å; I392-L434 HydrophobicContact CD1-CD2 3.75Å; I392-L434 HydrophobicContact CD1-CG 4.36Å; I392-L434 HydrophobicContact CG1-CD2 4.16Å; I407-L434 HydrophobicContact CG2-CD1 4.46Å; T420-L434 HydrophobicContact CG2-CD1 3.83Å; T420-L434 HydrophobicContact CG2-CG 4.18Å; T420-L434 WeakPolarHBondContact O-CG 3.46Å; T420-L434 PolarHBondContact O-N 3.34Å; M421-L434 PolarHBondContact O-N 3.41Å; M421-L434 VanDerWaalsContact O-N 3.12Å; M421-L434 HydrophobicContact SD-CD1 4.38Å; L434-A438 WeakPolarHBondContact O-CB 3.32Å; L434-A438 PolarHBondContact O-N 3.3Å; L434-F638 HydrophobicContact CD1-CD2 3.98Å; L434-F638 HydrophobicContact CD1-CE2 3.43Å; L434-F638 VanDerWaalsContact CD1-CE2 3.43Å; L434-F638 HydrophobicContact CD1-CZ 3.99Å
435	I	95.2	Very high	88.7	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-62.1	-177.7	-59.2	164.2	0	0	0	111.5	M421 E422 G433 R437 A438 M439 V514 L518 F543 L564	M421-I435 HydrophobicContact CB-CD1 4.19Å; M421-I435 VanDerWaalsContact O-CG1 3.32Å; M421-I435 WeakPolarHBondContact O-CG1 3.48Å; M421-I435 PolarHBondContact O-N 3.14Å; E422-I435 HydrophobicContact CG-CD1 4.18Å; G433-I435 PolarHBondContact O-N 2.71Å; I435-R437 VanDerWaalsContact C-N 3.35Å; I435-R437 PolarHBondContact O-N 3.08Å; I435-A438 PolarHBondContact O-N 2.98Å; I435-M439 WeakPolarHBondContact O-CG 3.3Å; I435-M439 PolarHBondContact O-N 3.31Å; I435-V514 HydrophobicContact CG2-CG1 4.33Å; I435-L518 HydrophobicContact CB-CD1 4.32Å; I435-L518 HydrophobicContact CD1-CD2 4.08Å; I435-L518 HydrophobicContact CG2-CD1 3.99Å; I435-L518 HydrophobicContact CG2-CD2 4.23Å; I435-F543 HydrophobicContact CD1-CB 4.27Å; I435-F543 HydrophobicContact CG2-CD1 3.99Å; I435-F543 HydrophobicContact CG2-CD2 4.42Å; I435-F543 HydrophobicContact CG2-CE1 3.96Å; I435-F543 HydrophobicContact CG2-CE2 4.4Å; I435-F543 HydrophobicContact CG2-CG 4.23Å; I435-F543 HydrophobicContact CG2-CZ 4.18Å; I435-L564 HydrophobicContact CB-CD1 4.09Å; I435-L564 HydrophobicContact CG1-CB 3.97Å; I435-L564 HydrophobicContact CG1-CD1 3.63Å; I435-L564 HydrophobicContact CG1-CG 4.44Å; I435-L564 HydrophobicContact CG2-CD1 4.27Å
436	P	93.6	Very high	89.9	Confident	10 Å²	10	43.6 Å²	43.6	7%	0.065	23%	0.233	C	C	.	.	H	α-helix	trans	-57.5	-44.6	-180	21.4	-33.2	0	0	0	112.6	E432 G433 A438 M439 R440	E432-P436 HydrophobicContact CB-CG 3.89Å; E432-P436 HydrophobicContact CG-CG 4.23Å; G433-P436 WeakPolarHBondContact O-CD 3.48Å; G433-P436 WeakPolarHBondContact O-CG 3.46Å; P436-A438 PolarHBondContact O-N 3.02Å; P436-M439 WeakPolarHBondContact O-CB 3.46Å; P436-M439 PolarHBondContact O-N 3.21Å; P436-M439 VanDerWaalsContact O-N 3.09Å; P436-R440 PolarHBondContact O-N 2.82Å
437	R	94.6	Very high	91.2	Very high	15 Å²	15	42.9 Å²	42.9	6%	0.057	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-42.2	177.4	-65.9	180	-170.2	-80.1	-13.9	112.8	F389 P429 Q430 E432 G433 I435 R440 H441	F389-R437 HydrophobicContact CB-CB 4.37Å; F389-R437 HydrophobicContact CD1-CB 3.96Å; F389-R437 HydrophobicContact CD2-CB 3.54Å; F389-R437 HydrophobicContact CE1-CB 4.15Å; F389-R437 HydrophobicContact CE2-CB 3.77Å; F389-R437 HydrophobicContact CG-CB 3.65Å; F389-R437 HydrophobicContact CG-CG 4.38Å; F389-R437 HydrophobicContact CZ-CB 4.08Å; F389-R437 WeakPolarHBondContact CZ-O 3.5Å; P429-R437 PolarHBondContact O-NH2 3.47Å; Q430-R437 PolarHBondContact O-NH2 2.88Å; E432-R437 HydrophobicContact CB-CG 4.48Å; E432-R437 PolarHBondContact O-NE 3.48Å; E432-R437 PolarHBondContact O-NH2 2.72Å; G433-R437 WeakPolarHBondContact O-CG 3.48Å; I435-R437 VanDerWaalsContact C-N 3.35Å; I435-R437 PolarHBondContact O-N 3.08Å; R437-R440 PolarHBondContact O-N 3.07Å; R437-H441 WeakPolarHBondContact O-CB 3.33Å; R437-H441 PolarHBondContact O-N 3.4Å
438	A	96.1	Very high	92.5	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-61.7	-43.3	174.7	0	0	0	0	0	111.3	F389 V396 L434 I435 P436 H441 L442 L562 L564	F389-A438 HydrophobicContact CE2-CB 4.02Å; V396-A438 HydrophobicContact CG1-CB 4Å; V396-A438 HydrophobicContact CG2-CB 4.15Å; L434-A438 WeakPolarHBondContact O-CB 3.32Å; L434-A438 PolarHBondContact O-N 3.3Å; I435-A438 PolarHBondContact O-N 2.98Å; P436-A438 PolarHBondContact O-N 3.02Å; A438-H441 PolarHBondContact O-N 2.71Å; A438-L442 WeakPolarHBondContact O-CB 3.45Å; A438-L442 WeakPolarHBondContact O-CD1 3.43Å; A438-L442 WeakPolarHBondContact O-CG 2.97Å; A438-L442 PolarHBondContact O-N 2.97Å; A438-L562 HydrophobicContact CB-CD2 4.35Å; A438-L564 HydrophobicContact CB-CD1 4.27Å
439	M	95.4	Very high	92.9	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-47.6	177.8	-57.7	-54.5	98	0	0	111.3	I435 P436 H441 L442 F443 V514 F543 L545 L562 L564	I435-M439 WeakPolarHBondContact O-CG 3.3Å; I435-M439 PolarHBondContact O-N 3.31Å; P436-M439 WeakPolarHBondContact O-CB 3.46Å; P436-M439 PolarHBondContact O-N 3.21Å; P436-M439 VanDerWaalsContact O-N 3.09Å; M439-H441 VanDerWaalsContact C-N 3.32Å; M439-H441 PolarHBondContact O-N 3.41Å; M439-L442 HydrophobicContact CE-CD1 4.02Å; M439-L442 PolarHBondContact O-N 3.26Å; M439-F443 HydrophobicContact CB-CD2 4.16Å; M439-F443 HydrophobicContact CB-CE2 3.78Å; M439-F443 WeakPolarHBondContact O-CB 3.39Å; M439-F443 WeakPolarHBondContact O-CD2 3.34Å; M439-F443 VanDerWaalsContact O-CG 3.31Å; M439-F443 WeakPolarHBondContact O-CG 3.14Å; M439-F443 PolarHBondContact O-N 3.14Å; M439-V514 HydrophobicContact CB-CG2 4.46Å; M439-V514 HydrophobicContact CG-CB 3.93Å; M439-V514 HydrophobicContact CG-CG1 3.75Å; M439-V514 HydrophobicContact CG-CG2 3.85Å; M439-V514 HydrophobicContact SD-CG1 4.27Å; M439-V514 HydrophobicContact SD-CG2 4.07Å; M439-F543 HydrophobicContact CE-CE1 3.8Å; M439-F543 HydrophobicContact CE-CZ 4.45Å; M439-F543 HydrophobicContact SD-CE1 3.89Å; M439-F543 HydrophobicContact SD-CZ 3.95Å; M439-L545 HydrophobicContact CE-CD2 3.95Å; M439-L545 HydrophobicContact SD-CD1 4.08Å; M439-L545 HydrophobicContact SD-CD2 3.81Å; M439-L545 HydrophobicContact SD-CG 4.44Å; M439-L562 HydrophobicContact CE-CD2 4.19Å; M439-L564 HydrophobicContact CE-CD1 4.31Å
440	R	93.9	Very high	93.4	Very high	94 Å²	94	41.5 Å²	41.5	36%	0.355	21%	0.209	S	C	.	.	H	α-helix	trans	-53.4	-47.7	176.5	-173.9	-178.5	-66.4	151.3	1.8	111.8	E432 P436 R437 S444 E511	E432-R440 IonicContact OE1-CZ 2.67Å; E432-R440 IonicContact OE1-NH2 3.34Å; E432-R440 PolarHBondContact OE1-NH2 3.27Å; E432-R440 IonicContact OE2-CZ 3.17Å; E432-R440 IonicContact OE2-NH1 3.1Å; E432-R440 PolarHBondContact OE2-NH1 3.4Å; E432-R440 IonicContact OE2-NH2 3.45Å; E432-R440 PolarHBondContact OE2-NH2 2.91Å; P436-R440 PolarHBondContact O-N 2.82Å; R437-R440 PolarHBondContact O-N 3.07Å; R440-S444 PolarHBondContact O-N 3.27Å; R440-S444 VanDerWaalsContact O-N 3.1Å; R440-E511 IonicContact CZ-OE1 2.83Å; R440-E511 IonicContact CZ-OE2 2.83Å; R440-E511 VanDerWaalsContact NE-CD 3.35Å; R440-E511 IonicContact NE-OE1 3.68Å; R440-E511 PolarHBondContact NE-OE1 2.82Å; R440-E511 VanDerWaalsContact NE-OE1 3.17Å; R440-E511 IonicContact NE-OE2 2.71Å; R440-E511 PolarHBondContact NE-OE2 2.91Å; R440-E511 IonicContact NH2-OE1 3.38Å; R440-E511 PolarHBondContact NH2-OE1 3.23Å; R440-E511 IonicContact NH2-OE2 2.7Å; R440-E511 PolarHBondContact NH2-OE2 3.45Å; R440-E511 VanDerWaalsContact NH2-OE2 3.1Å
441	H	95.3	Very high	93.4	Very high	49 Å²	49	38.3 Å²	38.3	23%	0.227	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-48.5	177.7	179.5	49.4	0	0	0	112.4	F389 A393 R437 A438 M439 F443 S444 V445	F389-H441 HydrophobicContact CE1-CB 4.07Å; F389-H441 HydrophobicContact CZ-CB 3.74Å; A393-H441 PolarHBondContact O-NE2 3.39Å; R437-H441 WeakPolarHBondContact O-CB 3.33Å; R437-H441 PolarHBondContact O-N 3.4Å; A438-H441 PolarHBondContact O-N 2.71Å; M439-H441 VanDerWaalsContact C-N 3.32Å; M439-H441 PolarHBondContact O-N 3.41Å; H441-F443 VanDerWaalsContact C-N 3.35Å; H441-F443 PolarHBondContact O-N 2.93Å; H441-S444 PolarHBondContact O-N 3.02Å; H441-V445 PolarHBondContact O-N 3.47Å
442	L	95.9	Very high	93.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-41.4	179.8	-70.3	167.1	0	0	0	112.4	V396 L400 A438 M439 A446 F458 L545 I547 L562	V396-L442 HydrophobicContact CG1-CD1 3.99Å; V396-L442 HydrophobicContact CG1-CD2 3.72Å; V396-L442 HydrophobicContact CG1-CG 3.67Å; L400-L442 HydrophobicContact CD1-CD2 3.74Å; L400-L442 HydrophobicContact CD2-CD2 4.44Å; L400-L442 HydrophobicContact CG-CD2 3.64Å; A438-L442 WeakPolarHBondContact O-CB 3.45Å; A438-L442 WeakPolarHBondContact O-CD1 3.43Å; A438-L442 WeakPolarHBondContact O-CG 2.97Å; A438-L442 PolarHBondContact O-N 2.97Å; M439-L442 HydrophobicContact CE-CD1 4.02Å; M439-L442 PolarHBondContact O-N 3.26Å; L442-A446 WeakPolarHBondContact O-CB 3.12Å; L442-A446 PolarHBondContact O-N 3.44Å; L442-F458 HydrophobicContact CB-CE1 4.36Å; L442-L545 HydrophobicContact CD1-CD2 3.63Å; L442-I547 HydrophobicContact CD1-CD1 4.27Å; L442-I547 HydrophobicContact CD2-CD1 4.03Å; L442-L562 HydrophobicContact CD1-CD2 3.75Å
443	F	95.8	Very high	93.2	Very high	26 Å²	26	38.6 Å²	38.6	11%	0.114	22%	0.223	C	C	.	.	H	α-helix	trans	-69.3	-37.9	177.4	-63.8	-47.2	0	0	0	112.3	M439 H441 Q447 F458 V508 V514	M439-F443 HydrophobicContact CB-CD2 4.16Å; M439-F443 HydrophobicContact CB-CE2 3.78Å; M439-F443 WeakPolarHBondContact O-CB 3.39Å; M439-F443 WeakPolarHBondContact O-CD2 3.34Å; M439-F443 VanDerWaalsContact O-CG 3.31Å; M439-F443 WeakPolarHBondContact O-CG 3.14Å; M439-F443 PolarHBondContact O-N 3.14Å; H441-F443 VanDerWaalsContact C-N 3.35Å; H441-F443 PolarHBondContact O-N 2.93Å; F443-Q447 WeakPolarHBondContact O-CB 3.44Å; F443-Q447 PolarHBondContact O-N 2.8Å; F443-F458 AromaticContact CD1-CD2 3.94Å; F443-F458 HydrophobicContact CD1-CD2 3.94Å; F443-F458 AromaticContact CD1-CE2 3.78Å; F443-F458 HydrophobicContact CD1-CE2 3.78Å; F443-F458 HydrophobicContact CD1-CZ 4.24Å; F443-F458 HydrophobicContact CE1-CB 4.27Å; F443-F458 HydrophobicContact CE1-CD1 4.46Å; F443-F458 AromaticContact CE1-CD2 3.59Å; F443-F458 HydrophobicContact CE1-CD2 3.59Å; F443-F458 AromaticContact CE1-CE2 3.94Å; F443-F458 HydrophobicContact CE1-CE2 3.94Å; F443-F458 AromaticContact CE1-CG 3.88Å; F443-F458 HydrophobicContact CE1-CG 3.88Å; F443-F458 HydrophobicContact CE1-CZ 4.49Å; F443-V508 HydrophobicContact CZ-CB 4.3Å; F443-V508 HydrophobicContact CZ-CG2 4.02Å; F443-V514 HydrophobicContact CE2-CG2 4.44Å; F443-V514 HydrophobicContact CZ-CG2 4.44Å
444	S	94.7	Very high	93.1	Very high	56 Å²	56	38.9 Å²	38.9	39%	0.392	22%	0.224	S	C	.	.	H	α-helix	trans	-60	-55	173.9	-167.6	0	0	0	0	111.2	R440 H441 A446 Q447 E448	R440-S444 PolarHBondContact O-N 3.27Å; R440-S444 VanDerWaalsContact O-N 3.1Å; H441-S444 PolarHBondContact O-N 3.02Å; S444-A446 VanDerWaalsContact C-N 3.32Å; S444-A446 PolarHBondContact O-N 3.08Å; S444-Q447 WeakPolarHBondContact O-CA 3.44Å; S444-Q447 WeakPolarHBondContact O-CB 3.28Å; S444-Q447 PolarHBondContact O-N 3.04Å; S444-E448 VanDerWaalsContact C-OE1 3.29Å; S444-E448 WeakPolarHBondContact O-CG 3.45Å; S444-E448 PolarHBondContact O-N 3.47Å; S444-E448 PolarHBondContact OG-OE1 2.83Å
445	V	93.3	Very high	93	Very high	19 Å²	19	43.7 Å²	43.7	12%	0.115	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-37.7	-177.3	-178.2	0	0	0	0	110.9	L400 H441 Q447 E448 M449	L400-V445 HydrophobicContact CD1-CB 3.85Å; L400-V445 HydrophobicContact CD1-CG1 3.98Å; H441-V445 PolarHBondContact O-N 3.47Å; V445-Q447 VanDerWaalsContact C-N 3.29Å; V445-Q447 PolarHBondContact O-N 3.16Å; V445-E448 PolarHBondContact O-N 2.85Å; V445-M449 HydrophobicContact CG1-CG 4.09Å; V445-M449 WeakPolarHBondContact O-CB 3.42Å; V445-M449 VanDerWaalsContact O-CG 3.23Å; V445-M449 WeakPolarHBondContact O-CG 3.34Å; V445-M449 PolarHBondContact O-N 2.7Å
446	A	93.9	Very high	93.1	Very high	11 Å²	11	45 Å²	45	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-34.9	173.3	0	0	0	0	0	113.2	L400 L442 S444 S450 Y456 F458	L400-A446 HydrophobicContact CD2-CB 4.36Å; L442-A446 WeakPolarHBondContact O-CB 3.12Å; L442-A446 PolarHBondContact O-N 3.44Å; S444-A446 VanDerWaalsContact C-N 3.32Å; S444-A446 PolarHBondContact O-N 3.08Å; A446-S450 PolarHBondContact O-N 3.32Å; A446-Y456 HydrophobicContact CB-CD2 3.93Å; A446-Y456 HydrophobicContact CB-CG 4.1Å; A446-F458 HydrophobicContact CB-CE2 3.97Å; A446-F458 HydrophobicContact CB-CZ 3.73Å
447	Q	93.4	Very high	93.2	Very high	149 Å²	149	47.6 Å²	47.6	70%	0.696	28%	0.278	S	S	*	.	H	α-helix	trans	-68.8	-42.6	173.1	-173.2	174	3.6	0	0	111.5	F443 S444 V445 M449 S450	F443-Q447 WeakPolarHBondContact O-CB 3.44Å; F443-Q447 PolarHBondContact O-N 2.8Å; S444-Q447 WeakPolarHBondContact O-CA 3.44Å; S444-Q447 WeakPolarHBondContact O-CB 3.28Å; S444-Q447 PolarHBondContact O-N 3.04Å; V445-Q447 VanDerWaalsContact C-N 3.29Å; V445-Q447 PolarHBondContact O-N 3.16Å; Q447-M449 PolarHBondContact O-N 2.62Å; Q447-S450 WeakPolarHBondContact O-CB 3.31Å; Q447-S450 PolarHBondContact O-N 3.14Å; Q447-S450 PolarHBondContact O-OG 3.5Å
448	E	91.9	Very high	93.4	Very high	114 Å²	114	47.5 Å²	47.5	53%	0.533	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-43.2	175.3	-67	157.8	-130.1	0	0	111.7	S444 V445 S450 G451	S444-E448 VanDerWaalsContact C-OE1 3.29Å; S444-E448 WeakPolarHBondContact O-CG 3.45Å; S444-E448 PolarHBondContact O-N 3.47Å; S444-E448 PolarHBondContact OG-OE1 2.83Å; V445-E448 PolarHBondContact O-N 2.85Å; E448-S450 PolarHBondContact O-N 2.93Å; E448-G451 PolarHBondContact O-N 3.04Å
449	M	90.6	Very high	93.4	Very high	9 Å²	9	49.4 Å²	49.4	4%	0.044	29%	0.289	C	S	.	.	H	α-helix	trans	-68.4	-18.4	177	-66.4	-52.7	-56	0	0	113.7	E295 V445 Q447 G451 Q452 W454 Y456	E295-M449 HydrophobicContact CG-CE 3.73Å; E295-M449 VanDerWaalsContact OE1-CE 3.29Å; E295-M449 WeakPolarHBondContact OE1-CE 3.45Å; V445-M449 HydrophobicContact CG1-CG 4.09Å; V445-M449 WeakPolarHBondContact O-CB 3.42Å; V445-M449 VanDerWaalsContact O-CG 3.23Å; V445-M449 WeakPolarHBondContact O-CG 3.34Å; V445-M449 PolarHBondContact O-N 2.7Å; Q447-M449 PolarHBondContact O-N 2.62Å; M449-G451 VanDerWaalsContact C-N 3.29Å; M449-G451 PolarHBondContact O-N 3.05Å; M449-Q452 HydrophobicContact CE-CB 4.23Å; M449-Q452 HydrophobicContact CE-CG 4.4Å; M449-Q452 CarbonylContact O-C 3.58Å; M449-Q452 WeakPolarHBondContact O-CA 3.39Å; M449-Q452 WeakPolarHBondContact O-CB 3.43Å; M449-Q452 PolarHBondContact O-N 2.94Å; M449-Q452 PolarHBondContact SD-NE2 2.97Å; M449-Q452 VanDerWaalsContact SD-NE2 3.44Å; M449-W454 HydrophobicContact CB-CB 4.11Å; M449-W454 VanDerWaalsContact CE-CD1 3.5Å; M449-W454 HydrophobicContact CE-CG 4.33Å; M449-W454 PolarHBondContact O-N 2.71Å; M449-Y456 HydrophobicContact CB-CE2 4.02Å; M449-Y456 HydrophobicContact CG-CE2 4.45Å
450	S	91.2	Very high	93.5	Very high	69 Å²	69	49.4 Å²	49.4	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-65.2	-32.2	175.8	77.4	0	0	0	0	113	A446 Q447 E448 Q452 G453 W454	A446-S450 PolarHBondContact O-N 3.32Å; Q447-S450 WeakPolarHBondContact O-CB 3.31Å; Q447-S450 PolarHBondContact O-N 3.14Å; Q447-S450 PolarHBondContact O-OG 3.5Å; E448-S450 PolarHBondContact O-N 2.93Å; S450-Q452 PolarHBondContact O-N 3.5Å; S450-G453 PolarHBondContact O-N 2.96Å; S450-G453 VanDerWaalsContact O-N 3.07Å; S450-W454 VanDerWaalsContact CA-O 3.32Å; S450-W454 WeakPolarHBondContact CA-O 3.45Å
451	G	86.9	Confident	93.7	Very high	73 Å²	73	45 Å²	45	75%	0.753	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.4	171	0	0	0	0	0	113.9	E448 M449	E448-G451 PolarHBondContact O-N 3.04Å; M449-G451 VanDerWaalsContact C-N 3.29Å; M449-G451 PolarHBondContact O-N 3.05Å
452	Q	86.3	Confident	93.7	Very high	74 Å²	74	42.9 Å²	42.9	35%	0.346	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	12.5	175.7	-53.3	-178.6	39.2	0	0	112.5	M449 S450 H551	M449-Q452 HydrophobicContact CE-CB 4.23Å; M449-Q452 HydrophobicContact CE-CG 4.4Å; M449-Q452 CarbonylContact O-C 3.58Å; M449-Q452 WeakPolarHBondContact O-CA 3.39Å; M449-Q452 WeakPolarHBondContact O-CB 3.43Å; M449-Q452 PolarHBondContact O-N 2.94Å; M449-Q452 PolarHBondContact SD-NE2 2.97Å; M449-Q452 VanDerWaalsContact SD-NE2 3.44Å; S450-Q452 PolarHBondContact O-N 3.5Å; Q452-H551 PolarHBondContact O-CD2 3.5Å; Q452-H551 PolarHBondContact O-NE2 2.88Å
453	G	89.2	Confident	93.6	Very high	38 Å²	38	43.1 Å²	43.1	39%	0.392	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	7.9	176.2	0	0	0	0	0	116	S450	S450-G453 PolarHBondContact O-N 2.96Å; S450-G453 VanDerWaalsContact O-N 3.07Å
454	W	92.1	Very high	93.5	Very high	7 Å²	7	42.1 Å²	42.1	3%	0.027	26%	0.26	C	S	.	.			trans	-88.3	125.7	173	-70.7	90.4	0	0	0	111.8	M449 S450 Y456 E550 H551 L556 C558	M449-W454 HydrophobicContact CB-CB 4.11Å; M449-W454 VanDerWaalsContact CE-CD1 3.5Å; M449-W454 HydrophobicContact CE-CG 4.33Å; M449-W454 PolarHBondContact O-N 2.71Å; S450-W454 VanDerWaalsContact CA-O 3.32Å; S450-W454 WeakPolarHBondContact CA-O 3.45Å; W454-Y456 HydrophobicContact CB-CD2 4.19Å; W454-Y456 HydrophobicContact CB-CE2 3.74Å; W454-Y456 HydrophobicContact CG-CE2 4.29Å; W454-E550 WeakPolarHBondContact CA-O 3.42Å; W454-H551 AromaticContact CD1-CD2 3.93Å; W454-H551 HydrophobicContact CD2-CB 3.84Å; W454-H551 AromaticContact CE2-CD2 3.98Å; W454-H551 HydrophobicContact CE3-CB 3.9Å; W454-H551 HydrophobicContact CG-CB 4.38Å; W454-H551 HydrophobicContact CH2-CB 4.18Å; W454-H551 HydrophobicContact CZ2-CB 4.14Å; W454-H551 HydrophobicContact CZ3-CB 4.07Å; W454-H551 AromaticContact NE1-CD2 3.73Å; W454-L556 HydrophobicContact CH2-CB 4.19Å; W454-C558 VanDerWaalsContact CZ3-SG 3.52Å
455	T	94.8	Very high	93.3	Very high	102 Å²	102	39.6 Å²	39.6	63%	0.626	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.5	169	-58.3	0	0	0	0	108.8	G549 E550	T455-G549 CarbonylContact O-C 3.59Å; T455-G549 WeakPolarHBondContact O-CA 3.43Å; T455-E550 PolarHBondContact N-O 3.12Å; T455-E550 PolarHBondContact O-N 2.9Å
456	Y	95.9	Very high	93	Very high	28 Å²	28	40.9 Å²	40.9	11%	0.11	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	144.9	175.5	-75.4	-87.6	0	0	0	111.8	R299 L400 A446 M449 W454 I547 G549	R299-Y456 PolarHBondContact NH2-OH 3.17Å; R299-Y456 VanDerWaalsContact NH2-OH 3.09Å; L400-Y456 HydrophobicContact CB-CE1 4.34Å; L400-Y456 HydrophobicContact CD2-CD1 3.55Å; L400-Y456 HydrophobicContact CD2-CD2 4.41Å; L400-Y456 HydrophobicContact CD2-CE1 3.49Å; L400-Y456 VanDerWaalsContact CD2-CE1 3.49Å; L400-Y456 HydrophobicContact CD2-CE2 4.36Å; L400-Y456 HydrophobicContact CD2-CG 4.03Å; L400-Y456 PolarHBondContact O-OH 3.37Å; L400-Y456 VanDerWaalsContact O-OH 3.05Å; A446-Y456 HydrophobicContact CB-CD2 3.93Å; A446-Y456 HydrophobicContact CB-CG 4.1Å; M449-Y456 HydrophobicContact CB-CE2 4.02Å; M449-Y456 HydrophobicContact CG-CE2 4.45Å; W454-Y456 HydrophobicContact CB-CD2 4.19Å; W454-Y456 HydrophobicContact CB-CE2 3.74Å; W454-Y456 HydrophobicContact CG-CE2 4.29Å; Y456-I547 HydrophobicContact CD1-CG2 3.94Å; Y456-I547 HydrophobicContact CE1-CG2 4.34Å; Y456-G549 VanDerWaalsContact CD1-CA 3.48Å
457	S	96.5	Very high	92.5	Very high	66 Å²	66	44.3 Å²	44.3	46%	0.462	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.1	173	60.8	0	0	0	0	109.6	S548	S457-S548 PolarHBondContact N-O 3.38Å; S457-S548 PolarHBondContact O-N 3.09Å; S457-S548 PolarHBondContact OG-O 3.3Å
458	F	97.5	Very high	92.2	Very high	13 Å²	13	40.1 Å²	40.1	6%	0.057	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133	-173	-57.4	-88.4	0	0	0	110.4	L400 L442 F443 A446 P507 V508 L545 Q546 I547	L400-F458 HydrophobicContact CD2-CE1 4.06Å; L400-F458 HydrophobicContact CD2-CZ 3.98Å; L442-F458 HydrophobicContact CB-CE1 4.36Å; F443-F458 AromaticContact CD1-CD2 3.94Å; F443-F458 HydrophobicContact CD1-CD2 3.94Å; F443-F458 AromaticContact CD1-CE2 3.78Å; F443-F458 HydrophobicContact CD1-CE2 3.78Å; F443-F458 HydrophobicContact CD1-CZ 4.24Å; F443-F458 HydrophobicContact CE1-CB 4.27Å; F443-F458 HydrophobicContact CE1-CD1 4.46Å; F443-F458 AromaticContact CE1-CD2 3.59Å; F443-F458 HydrophobicContact CE1-CD2 3.59Å; F443-F458 AromaticContact CE1-CE2 3.94Å; F443-F458 HydrophobicContact CE1-CE2 3.94Å; F443-F458 AromaticContact CE1-CG 3.88Å; F443-F458 HydrophobicContact CE1-CG 3.88Å; F443-F458 HydrophobicContact CE1-CZ 4.49Å; A446-F458 HydrophobicContact CB-CE2 3.97Å; A446-F458 HydrophobicContact CB-CZ 3.73Å; F458-P507 WeakPolarHBondContact O-CA 3.39Å; F458-V508 HydrophobicContact CB-CG2 3.88Å; F458-V508 PolarHBondContact O-N 2.66Å; F458-L545 HydrophobicContact CB-CD1 4.12Å; F458-L545 HydrophobicContact CD1-CD2 3.85Å; F458-L545 HydrophobicContact CD1-CG 4.32Å; F458-L545 HydrophobicContact CE1-CD2 4.47Å; F458-Q546 WeakPolarHBondContact CA-O 3.22Å; F458-I547 HydrophobicContact CD1-CB 4.38Å; F458-I547 HydrophobicContact CD1-CD1 4.42Å; F458-I547 HydrophobicContact CD1-CG1 3.95Å; F458-I547 HydrophobicContact CD1-CG2 4.11Å; F458-I547 HydrophobicContact CE1-CB 4.46Å; F458-I547 HydrophobicContact CE1-CD1 4.13Å; F458-I547 HydrophobicContact CE1-CG1 4.09Å; F458-I547 HydrophobicContact CE1-CG2 3.8Å
459	V	97.5	Very high	92	Very high	40 Å²	40	36.8 Å²	36.8	24%	0.242	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	115.3	178	-177.2	0	0	0	0	109	Y505 Q546	V459-Y505 HydrophobicContact CG1-CD1 4.17Å; V459-Y505 HydrophobicContact CG1-CG 4.47Å; V459-Q546 HydrophobicContact CB-CB 4.36Å; V459-Q546 PolarHBondContact N-O 2.78Å; V459-Q546 PolarHBondContact O-N 2.86Å
460	A	97.6	Very high	92	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	141.2	179.2	0	0	0	0	0	111.2	V506 V508 L517 F543 L545	A460-V506 PolarHBondContact N-O 3.02Å; A460-V506 PolarHBondContact O-N 2.85Å; A460-V508 HydrophobicContact CB-CG1 4.08Å; A460-V508 HydrophobicContact CB-CG2 4.08Å; A460-L517 HydrophobicContact CB-CD1 3.92Å; A460-F543 HydrophobicContact CB-CE2 4.18Å; A460-F543 HydrophobicContact CB-CZ 4.09Å; A460-L545 HydrophobicContact CB-CD1 4.09Å
461	S	96.6	Very high	91.9	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.8	166.8	61	0	0	0	0	108.9	R504 Q544	S461-R504 VanDerWaalsContact CB-O 3.26Å; S461-R504 WeakPolarHBondContact CB-O 3.32Å; S461-Q544 PolarHBondContact N-O 2.92Å; S461-Q544 PolarHBondContact O-N 3.03Å; S461-Q544 PolarHBondContact OG-O 3.35Å
462	Y	96.2	Very high	92.2	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	118.1	178.1	-162.5	-177.4	0	0	0	109.5	E422 L473 L518 A521 V542 F543	E422-Y462 PolarHBondContact OE1-OH 2.88Å; Y462-L473 HydrophobicContact CD1-CD1 4.22Å; Y462-L473 HydrophobicContact CD2-CD1 3.88Å; Y462-L473 HydrophobicContact CE1-CD1 4.22Å; Y462-L473 HydrophobicContact CE2-CD1 3.95Å; Y462-L473 HydrophobicContact CG-CB 4.36Å; Y462-L473 HydrophobicContact CG-CD1 4.04Å; Y462-L473 WeakPolarHBondContact O-CB 3.33Å; Y462-L473 PolarHBondContact O-N 3.1Å; Y462-L518 HydrophobicContact CD1-CD2 4.14Å; Y462-L518 HydrophobicContact CE1-CD2 3.75Å; Y462-A521 HydrophobicContact CD1-CB 3.31Å; Y462-A521 HydrophobicContact CE1-CB 3.54Å; Y462-A521 HydrophobicContact CG-CB 4.3Å; Y462-V542 WeakPolarHBondContact CD2-O 3.46Å; Y462-F543 HydrophobicContact CD1-CD2 4.29Å; Y462-F543 HydrophobicContact CD2-CB 3.92Å; Y462-F543 HydrophobicContact CE2-CB 4.03Å; Y462-F543 HydrophobicContact CG-CB 4.3Å; Y462-F543 HydrophobicContact CG-CD2 4.15Å
463	V	94.4	Very high	92.4	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.7	-177.3	-61.5	0	0	0	0	112.5	V470 R471 V500 A503 V542 L624	V463-V470 HydrophobicContact CB-CG1 3.93Å; V463-V470 HydrophobicContact CG1-CG1 4.33Å; V463-V470 HydrophobicContact CG2-CG1 4.2Å; V463-R471 CarbonylContact C-O 3.6Å; V463-R471 VanDerWaalsContact CA-O 3.27Å; V463-R471 WeakPolarHBondContact CA-O 3.27Å; V463-R471 WeakPolarHBondContact CB-O 3.37Å; V463-V500 HydrophobicContact CG1-CG2 4.44Å; V463-A503 HydrophobicContact CG1-CB 4.09Å; V463-V542 HydrophobicContact CG2-CB 4.01Å; V463-V542 PolarHBondContact N-O 3.46Å; V463-V542 PolarHBondContact O-N 2.8Å; V463-L624 HydrophobicContact CG2-CD2 3.97Å
464	E	92.3	Very high	92.6	Very high	5 Å²	5	31.4 Å²	31.4	2%	0.023	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.5	171.5	-175.9	177.7	-107.8	0	0	109.9	V470 R471 L473 R525 R535 S539 H540	E464-V470 CarbonylContact O-C 3.55Å; E464-V470 WeakPolarHBondContact O-CA 3.27Å; E464-R471 PolarHBondContact N-O 3.43Å; E464-R471 PolarHBondContact O-N 2.87Å; E464-L473 HydrophobicContact CB-CD1 4.09Å; E464-L473 HydrophobicContact CB-CD2 3.82Å; E464-L473 HydrophobicContact CB-CG 3.95Å; E464-R525 IonicContact OE1-CZ 2.79Å; E464-R525 IonicContact OE1-NE 2.84Å; E464-R525 PolarHBondContact OE1-NE 3.31Å; E464-R525 IonicContact OE1-NH2 3.81Å; E464-R535 IonicContact OE1-NE 3.14Å; E464-R535 IonicContact OE2-CZ 2.72Å; E464-R535 IonicContact OE2-NE 2.75Å; E464-R535 PolarHBondContact OE2-NE 3.24Å; E464-R535 IonicContact OE2-NH2 3.11Å; E464-R535 PolarHBondContact OE2-NH2 2.88Å; E464-S539 WeakPolarHBondContact CG-OG 3.22Å; E464-S539 WeakPolarHBondContact OE1-CB 3.42Å; E464-S539 PolarHBondContact OE1-OG 3.09Å; E464-H540 CarbonylContact C-O 3.49Å; E464-H540 WeakPolarHBondContact CA-O 3.31Å
465	I	91.4	Very high	92.4	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.015	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	113.9	170.4	-52.3	-179	0	0	0	108.2	T469 V470 S539 H540 K620 L621 L624	I465-T469 WeakPolarHBondContact CA-O 2.95Å; I465-V470 HydrophobicContact CG1-CG1 4.48Å; I465-V470 HydrophobicContact CG1-CG2 4.36Å; I465-S539 WeakPolarHBondContact O-CA 3.44Å; I465-H540 HydrophobicContact CB-CB 4.36Å; I465-H540 PolarHBondContact N-O 3.21Å; I465-H540 PolarHBondContact O-N 2.89Å; I465-K620 HydrophobicContact CD1-CB 4.35Å; I465-K620 HydrophobicContact CG2-CB 4.13Å; I465-L621 HydrophobicContact CD1-CB 4.18Å; I465-L621 HydrophobicContact CD1-CD1 4.26Å; I465-L624 HydrophobicContact CD1-CD2 4.29Å
466	Y	86.8	Confident	91.8	Very high	46 Å²	46	29.8 Å²	29.8	18%	0.18	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124.6	-179.4	172.1	-91.7	0	0	0	109.2	E468 T469 R535 R538 E589	Y466-E468 VanDerWaalsContact C-N 3.33Å; Y466-E468 PolarHBondContact O-N 2.78Å; Y466-T469 PolarHBondContact N-O 2.96Å; Y466-T469 VanDerWaalsContact O-CB 3.3Å; Y466-T469 WeakPolarHBondContact O-CB 3.07Å; Y466-T469 PolarHBondContact O-N 3.42Å; Y466-T469 PolarHBondContact O-OG1 2.98Å; Y466-R535 VanDerWaalsContact CB-NH2 3.3Å; Y466-R538 WeakPolarHBondContact CD2-O 3.14Å; Y466-R538 HydrophobicContact CE2-CB 4.41Å; Y466-E589 HydrophobicContact CE2-CG 4.32Å; Y466-E589 PolarHBondContact OH-OE1 3.01Å
467	N	83.4	Confident	90.5	Very high	83 Å²	83	30.9 Å²	30.9	44%	0.444	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	53.2	-177.8	-168.9	59.6	0	0	0	112.4	T469 A592	N467-T469 PolarHBondContact O-N 3.01Å; N467-T469 PolarHBondContact O-OG1 2.84Å; N467-T469 VanDerWaalsContact O-OG1 3.13Å; N467-A592 VanDerWaalsContact OD1-CB 3.28Å; N467-A592 WeakPolarHBondContact OD1-CB 3.24Å
468	E	87.5	Confident	88.4	Confident	61 Å²	61	32.5 Å²	32.5	29%	0.285	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	17.5	-177.2	-64.1	-64.2	128.2	0	0	115.6	Y466 S619 K620	Y466-E468 VanDerWaalsContact C-N 3.33Å; Y466-E468 PolarHBondContact O-N 2.78Å; E468-S619 WeakPolarHBondContact OE1-CB 3.07Å; E468-S619 PolarHBondContact OE1-OG 3.42Å; E468-S619 VanDerWaalsContact OE2-CA 3.27Å; E468-S619 WeakPolarHBondContact OE2-CA 3.49Å; E468-S619 PolarHBondContact OE2-OG 2.93Å; E468-K620 HydrophobicContact CB-CG 4.4Å; E468-K620 WeakPolarHBondContact O-CE 3.49Å; E468-K620 VanDerWaalsContact O-CG 3.26Å; E468-K620 WeakPolarHBondContact O-CG 3.32Å; E468-K620 WeakPolarHBondContact OE2-CG 3.46Å; E468-K620 PolarHBondContact OE2-N 3.2Å
469	T	87.4	Confident	86.2	Confident	44 Å²	44	39.9 Å²	39.9	27%	0.27	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.5	174.8	-44.7	0	0	0	0	109.5	I465 Y466 N467	I465-T469 WeakPolarHBondContact CA-O 2.95Å; Y466-T469 PolarHBondContact N-O 2.96Å; Y466-T469 VanDerWaalsContact O-CB 3.3Å; Y466-T469 WeakPolarHBondContact O-CB 3.07Å; Y466-T469 PolarHBondContact O-N 3.42Å; Y466-T469 PolarHBondContact O-OG1 2.98Å; N467-T469 PolarHBondContact O-N 3.01Å; N467-T469 PolarHBondContact O-OG1 2.84Å; N467-T469 VanDerWaalsContact O-OG1 3.13Å
470	V	90.6	Very high	84.3	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	147.3	177	-166.7	0	0	0	0	110	V463 E464 I465 C486 I488 V500 K620	V463-V470 HydrophobicContact CB-CG1 3.93Å; V463-V470 HydrophobicContact CG1-CG1 4.33Å; V463-V470 HydrophobicContact CG2-CG1 4.2Å; E464-V470 CarbonylContact O-C 3.55Å; E464-V470 WeakPolarHBondContact O-CA 3.27Å; I465-V470 HydrophobicContact CG1-CG1 4.48Å; I465-V470 HydrophobicContact CG1-CG2 4.36Å; V470-C486 HydrophobicContact CB-CB 4.04Å; V470-C486 HydrophobicContact CG1-CB 4.34Å; V470-C486 WeakPolarHBondContact O-CB 3.45Å; V470-I488 HydrophobicContact CG2-CD1 4.4Å; V470-I488 HydrophobicContact CG2-CG1 4.36Å; V470-V500 HydrophobicContact CB-CG1 4.45Å; V470-V500 HydrophobicContact CG1-CG1 3.81Å; V470-V500 HydrophobicContact CG1-CG2 4.3Å; V470-K620 HydrophobicContact CG2-CB 4.35Å; V470-K620 HydrophobicContact CG2-CG 4.42Å
471	R	89.4	Confident	82.2	Confident	111 Å²	111	47 Å²	47	42%	0.419	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	138	177.5	-57	-176.4	-177.5	-158.2	-4.2	111.1	V463 E464	V463-R471 CarbonylContact C-O 3.6Å; V463-R471 VanDerWaalsContact CA-O 3.27Å; V463-R471 WeakPolarHBondContact CA-O 3.27Å; V463-R471 WeakPolarHBondContact CB-O 3.37Å; E464-R471 PolarHBondContact N-O 3.43Å; E464-R471 PolarHBondContact O-N 2.87Å
472	D	92.2	Very high	80	Confident	24 Å²	24	54.1 Å²	54.1	13%	0.128	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	121.7	172.5	-177.3	15.9	0	0	0	111.4	L474 A475 A503 R504	D472-L474 WeakPolarHBondContact OD1-CA 3.3Å; D472-L474 PolarHBondContact OD1-N 3.03Å; D472-A475 HydrophobicContact CB-CB 4.3Å; D472-A475 PolarHBondContact OD2-N 2.92Å; D472-A503 HydrophobicContact CB-CB 4.22Å; D472-R504 PolarHBondContact OD2-N 2.87Å
473	L	91.8	Very high	78.1	Confident	7 Å²	7	55.5 Å²	55.5	4%	0.037	31%	0.311	C	S	.	.	S	Bend	trans	-86.2	-13.6	174	-65.8	-179.1	0	0	0	112.8	Y462 E464 A521 N524 R525	Y462-L473 HydrophobicContact CD1-CD1 4.22Å; Y462-L473 HydrophobicContact CD2-CD1 3.88Å; Y462-L473 HydrophobicContact CE1-CD1 4.22Å; Y462-L473 HydrophobicContact CE2-CD1 3.95Å; Y462-L473 HydrophobicContact CG-CB 4.36Å; Y462-L473 HydrophobicContact CG-CD1 4.04Å; Y462-L473 WeakPolarHBondContact O-CB 3.33Å; Y462-L473 PolarHBondContact O-N 3.1Å; E464-L473 HydrophobicContact CB-CD1 4.09Å; E464-L473 HydrophobicContact CB-CD2 3.82Å; E464-L473 HydrophobicContact CB-CG 3.95Å; L473-A521 HydrophobicContact CB-CB 3.75Å; L473-A521 HydrophobicContact CD1-CB 4.25Å; L473-A521 WeakPolarHBondContact O-CA 3.39Å; L473-N524 PolarHBondContact O-ND2 2.86Å; L473-R525 HydrophobicContact CD1-CG 4.2Å; L473-R525 HydrophobicContact CD2-CG 3.57Å
474	L	93	Very high	76.7	Confident	1 Å²	1	58 Å²	58	1%	0.005	34%	0.338	C	S	.	.	S	Bend	trans	-97.2	9	-179.5	-52.3	-176.9	0	0	0	112.8	D472 R504 V506 L517 L520 A521	D472-L474 WeakPolarHBondContact OD1-CA 3.3Å; D472-L474 PolarHBondContact OD1-N 3.03Å; L474-R504 HydrophobicContact CB-CB 3.99Å; L474-R504 WeakPolarHBondContact O-CD 3.49Å; L474-R504 PolarHBondContact O-NH1 3.25Å; L474-V506 HydrophobicContact CD1-CG2 4.13Å; L474-L517 HydrophobicContact CD1-CD1 4.36Å; L474-L517 HydrophobicContact CD1-CD2 4.22Å; L474-L517 HydrophobicContact CD2-CB 3.91Å; L474-L517 HydrophobicContact CD2-CD2 4.04Å; L474-L517 HydrophobicContact CD2-CG 4.48Å; L474-L520 HydrophobicContact CB-CD2 4.46Å; L474-A521 HydrophobicContact CD2-CB 4.39Å
475	A	86.9	Confident	76	Confident	14 Å²	14	64.1 Å²	64.1	12%	0.116	37%	0.366	C	S	.	.			trans	-65	133.1	178.3	0	0	0	0	0	112.5	D472 N524	D472-A475 HydrophobicContact CB-CB 4.3Å; D472-A475 PolarHBondContact OD2-N 2.92Å; A475-N524 PolarHBondContact O-ND2 3.15Å
476	T	82.1	Confident	75.8	Confident	61 Å²	61	64.8 Å²	64.8	37%	0.374	37%	0.371	S	S	.	.			trans	-132.8	157.4	171.7	68.1	0	0	0	0	111.9	R504 L520	T476-R504 PolarHBondContact OG1-NH1 3.33Å; T476-R504 PolarHBondContact OG1-NH2 3.34Å; T476-R504 VanDerWaalsContact OG1-NH2 3.12Å; T476-L520 HydrophobicContact CG2-CD1 3.73Å; T476-L520 HydrophobicContact CG2-CD2 3.66Å; T476-L520 HydrophobicContact CG2-CG 4.36Å
477	G	69.8	Low	75.9	Confident	51 Å²	51	66 Å²	66	53%	0.526	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	-159.7	178.2	0	0	0	0	0	113.6	R479 K480	G477-R479 PolarHBondContact O-N 3.3Å; G477-R479 VanDerWaalsContact O-N 3.08Å; G477-K480 WeakPolarHBondContact O-CB 3.37Å; G477-K480 PolarHBondContact O-N 3.15Å; G477-K480 VanDerWaalsContact O-N 3.14Å
478	P	51.1	Low	76.4	Confident	100 Å²	100	62.6 Å²	62.6	65%	0.649	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.7	-173.7	26.5	-35.2	0	0	0	114.3	K480 Q482	P478-K480 PolarHBondContact O-N 2.64Å; P478-K480 VanDerWaalsContact O-N 3.1Å; P478-Q482 WeakPolarHBondContact O-CB 3.49Å; P478-Q482 VanDerWaalsContact O-CG 3.26Å; P478-Q482 WeakPolarHBondContact O-CG 3.41Å; P478-Q482 PolarHBondContact O-OE1 2.4Å
479	R	53.1	Low	76.5	Confident	168 Å²	168	66 Å²	66	63%	0.634	37%	0.37	S	S	*	.	H	α-helix	trans	-59.1	-18.5	171	-74.8	-170	176	-166.9	0.1	113.6	G477 G481 Q482 G483	G477-R479 PolarHBondContact O-N 3.3Å; G477-R479 VanDerWaalsContact O-N 3.08Å; R479-G481 PolarHBondContact O-N 2.66Å; R479-Q482 PolarHBondContact O-N 3.19Å; R479-Q482 VanDerWaalsContact O-N 3.17Å; R479-G483 PolarHBondContact O-N 2.99Å
480	K	55.8	Low	76.6	Confident	108 Å²	108	70.5 Å²	70.5	47%	0.47	38%	0.383	S	S	.	.	H	α-helix	trans	-66.9	78.3	175.4	-166.1	167.8	-179.6	171.9	0	111	G477 P478 N524	G477-K480 WeakPolarHBondContact O-CB 3.37Å; G477-K480 PolarHBondContact O-N 3.15Å; G477-K480 VanDerWaalsContact O-N 3.14Å; P478-K480 PolarHBondContact O-N 2.64Å; P478-K480 VanDerWaalsContact O-N 3.1Å; K480-N524 WeakPolarHBondContact CE-OD1 3.08Å; K480-N524 PolarHBondContact NZ-OD1 3.1Å
481	G	54.1	Low	76.2	Confident	82 Å²	82	72.4 Å²	72.4	85%	0.845	40%	0.399	S	S	*	.	H	α-helix	trans	115.7	-20	-175	0	0	0	0	0	114.6	R479	R479-G481 PolarHBondContact O-N 2.66Å
482	Q	51.5	Low	75.8	Confident	153 Å²	153	70 Å²	70	72%	0.715	40%	0.399	S	S	*	.	H	α-helix	trans	-99	-4.5	-179.7	-62.6	-177.7	-12.1	0	0	114.5	P478 R479 G484	P478-Q482 WeakPolarHBondContact O-CB 3.49Å; P478-Q482 VanDerWaalsContact O-CG 3.26Å; P478-Q482 WeakPolarHBondContact O-CG 3.41Å; P478-Q482 PolarHBondContact O-OE1 2.4Å; R479-Q482 PolarHBondContact O-N 3.19Å; R479-Q482 VanDerWaalsContact O-N 3.17Å; Q482-G484 PolarHBondContact O-N 3.25Å
483	G	56.4	Low	75	Confident	31 Å²	31	75.6 Å²	75.6	32%	0.32	44%	0.437	S	S	.	.	S	Bend	trans	-70.7	-8	-175.2	0	0	0	0	0	116.3	R479 N502	R479-G483 PolarHBondContact O-N 2.99Å; G483-N502 VanDerWaalsContact O-CB 3.26Å; G483-N502 WeakPolarHBondContact O-CB 3.47Å; G483-N502 PolarHBondContact O-ND2 3.02Å; G483-N502 PolarHBondContact O-OD1 2.76Å
484	G	65.1	Low	74.1	Confident	58 Å²	58	79 Å²	79	60%	0.598	47%	0.473	S	S	*	.			trans	79.7	178.3	-164	0	0	0	0	0	112.3	Q482	Q482-G484 PolarHBondContact O-N 3.25Å
485	E	77.1	Confident	73.4	Confident	133 Å²	133	80.1 Å²	80.1	62%	0.621	48%	0.481	S	S	*	.			trans	-75.8	147.3	-178.4	-167.4	164.6	-177	0	0	112	T501 N502	E485-T501 PolarHBondContact O-OG1 2.8Å; E485-N502 PolarHBondContact O-ND2 2.88Å
486	C	86.2	Confident	73.1	Confident	17 Å²	17	85.9 Å²	85.9	12%	0.115	51%	0.506	C	S	.	.	B	Isolated β-bridge	trans	-93.2	105.3	178.1	-70.4	0	0	0	0	110.1	V470 V500 T501	V470-C486 HydrophobicContact CB-CB 4.04Å; V470-C486 HydrophobicContact CG1-CB 4.34Å; V470-C486 WeakPolarHBondContact O-CB 3.45Å; C486-V500 HydrophobicContact CB-CG1 3.7Å; C486-T501 WeakPolarHBondContact CA-O 3.41Å
487	E	90.4	Very high	73.2	Confident	72 Å²	72	86.6 Å²	86.6	34%	0.336	51%	0.505	S	S	.	.			trans	-112.8	145.3	179.8	-67.6	-178.8	-153.3	0	0	112	R489 V500 T501	E487-R489 HydrophobicContact CB-CG 4.26Å; E487-R489 PolarHBondContact O-N 3.03Å; E487-R489 IonicContact OE1-NH2 3.59Å; E487-R489 PolarHBondContact OE1-NH2 2.85Å; E487-R489 VanDerWaalsContact OE1-NH2 3.11Å; E487-R489 IonicContact OE2-CZ 3.68Å; E487-R489 IonicContact OE2-NE 2.75Å; E487-R489 PolarHBondContact OE2-NE 2.54Å; E487-R489 IonicContact OE2-NH2 2.68Å; E487-R489 PolarHBondContact OE2-NH2 3.46Å; E487-V500 CarbonylContact O-C 3.55Å; E487-V500 WeakPolarHBondContact O-CA 3.45Å; E487-T501 PolarHBondContact N-OG1 2.41Å; E487-T501 PolarHBondContact O-N 2.85Å; E487-T501 PolarHBondContact O-OG1 3.15Å
488	I	92.2	Very high	74.1	Confident	12 Å²	12	84.6 Å²	84.6	6%	0.062	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.8	172.2	-56.9	159.5	0	0	0	108.9	V470 L498 T499 V500 K620 Y623 L624	V470-I488 HydrophobicContact CG2-CD1 4.4Å; V470-I488 HydrophobicContact CG2-CG1 4.36Å; I488-L498 HydrophobicContact CG2-CB 4.12Å; I488-L498 HydrophobicContact CG2-CD1 4.31Å; I488-T499 WeakPolarHBondContact CA-O 3.16Å; I488-V500 HydrophobicContact CG1-CG2 4.4Å; I488-K620 HydrophobicContact CD1-CB 3.8Å; I488-K620 HydrophobicContact CD1-CD 3.97Å; I488-K620 HydrophobicContact CD1-CG 4.42Å; I488-K620 WeakPolarHBondContact CD1-O 3.37Å; I488-Y623 HydrophobicContact CB-CD1 3.83Å; I488-Y623 HydrophobicContact CB-CE1 3.84Å; I488-Y623 HydrophobicContact CD1-CD1 4Å; I488-Y623 HydrophobicContact CG2-CD1 3.68Å; I488-Y623 HydrophobicContact CG2-CE1 3.61Å; I488-Y623 HydrophobicContact CG2-CG 4.38Å; I488-L624 HydrophobicContact CD1-CB 3.79Å; I488-L624 HydrophobicContact CG1-CB 4.32Å; I488-L624 HydrophobicContact CG1-CD1 4.43Å; I488-L624 HydrophobicContact CG2-CD1 4.49Å
489	R	91.1	Very high	76	Confident	131 Å²	131	81.1 Å²	81.1	49%	0.494	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	160.5	179.5	-61.6	-167.4	-178.5	-175.5	0.4	111.1	E487 L498 T499 T501	E487-R489 HydrophobicContact CB-CG 4.26Å; E487-R489 PolarHBondContact O-N 3.03Å; E487-R489 IonicContact OE1-NH2 3.59Å; E487-R489 PolarHBondContact OE1-NH2 2.85Å; E487-R489 VanDerWaalsContact OE1-NH2 3.11Å; E487-R489 IonicContact OE2-CZ 3.68Å; E487-R489 IonicContact OE2-NE 2.75Å; E487-R489 PolarHBondContact OE2-NE 2.54Å; E487-R489 IonicContact OE2-NH2 2.68Å; E487-R489 PolarHBondContact OE2-NH2 3.46Å; R489-L498 WeakPolarHBondContact O-CA 3.4Å; R489-T499 PolarHBondContact N-O 3.34Å; R489-T499 PolarHBondContact O-N 3.45Å; R489-T499 VanDerWaalsContact O-O 3.07Å; R489-T499 PolarHBondContact O-OG1 3.33Å; R489-T499 VanDerWaalsContact O-OG1 3.11Å; R489-T501 HydrophobicContact CB-CG2 4.28Å; R489-T501 HydrophobicContact CG-CG2 3.92Å
490	R	87.8	Confident	77.9	Confident	140 Å²	140	73.4 Å²	73.4	53%	0.528	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	137.7	173.7	-77.2	174.6	167.8	-173.1	-9.4	110.9	S492 S495 E497 L498	R490-S492 VanDerWaalsContact C-N 3.28Å; R490-S492 PolarHBondContact O-N 2.92Å; R490-S495 VanDerWaalsContact CD-O 3.31Å; R490-S495 WeakPolarHBondContact CD-O 3.4Å; R490-E497 CarbonylContact C-O 3.57Å; R490-E497 VanDerWaalsContact CA-O 3.26Å; R490-E497 WeakPolarHBondContact CA-O 3.32Å; R490-L498 HydrophobicContact CG-CD2 3.79Å
491	A	82.9	Confident	79.5	Confident	46 Å²	46	69.9 Å²	69.9	38%	0.38	42%	0.418	S	S	.	.	S	Bend	trans	-59.5	-36	-175.6	0	0	0	0	0	113.3	E497 T499	A491-E497 HydrophobicContact CB-CB 4.08Å; A491-E497 HydrophobicContact CB-CG 4.26Å; A491-E497 PolarHBondContact N-O 2.79Å; A491-T499 HydrophobicContact CB-CG2 3.76Å
492	S	81.9	Confident	81.1	Confident	60 Å²	60	70.4 Å²	70.4	42%	0.42	40%	0.402	S	S	.	.	S	Bend	trans	-154.4	160.3	176.3	64.8	0	0	0	0	111.9	R490 G494 S495	R490-S492 VanDerWaalsContact C-N 3.28Å; R490-S492 PolarHBondContact O-N 2.92Å; S492-G494 PolarHBondContact O-N 3.36Å; S492-S495 PolarHBondContact O-N 2.72Å; S492-S495 VanDerWaalsContact OG-CB 3.26Å; S492-S495 WeakPolarHBondContact OG-CB 3.29Å
493	P	75.3	Confident	83	Confident	142 Å²	142	63.8 Å²	63.8	92%	0.922	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	111.1	174.9	-21.9	34.1	0	0	0	111.1
494	G	71.6	Confident	84.7	Confident	78 Å²	78	65.8 Å²	65.8	80%	0.804	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.8	-5.8	-176.9	0	0	0	0	0	115.2	S492	S492-G494 PolarHBondContact O-N 3.36Å
495	S	79.5	Confident	86.1	Confident	25 Å²	25	66.3 Å²	66.3	18%	0.175	36%	0.355	C	S	.	.			trans	-82.3	144.3	163.6	-171.5	0	0	0	0	110.8	R490 S492 E497	R490-S495 VanDerWaalsContact CD-O 3.31Å; R490-S495 WeakPolarHBondContact CD-O 3.4Å; S492-S495 PolarHBondContact O-N 2.72Å; S492-S495 VanDerWaalsContact OG-CB 3.26Å; S492-S495 WeakPolarHBondContact OG-CB 3.29Å; S495-E497 WeakPolarHBondContact OG-CB 3.4Å; S495-E497 PolarHBondContact OG-N 3.08Å; S495-E497 VanDerWaalsContact OG-N 3.12Å
496	E	79.8	Confident	87	Confident	136 Å²	136	62 Å²	62	64%	0.636	34%	0.338	S	S	*	.			trans	-87.4	-15.3	168.7	-56.2	-152.5	116.9	0	0	112.2	N627	E496-N627 PolarHBondContact O-ND2 2.7Å
497	E	84.4	Confident	87.6	Confident	76 Å²	76	65.9 Å²	65.9	36%	0.355	36%	0.363	S	S	.	.			trans	-57.9	136.4	177.9	-172.6	176.8	-160.1	0	0	111.7	R490 A491 S495 Q546 N627	R490-E497 CarbonylContact C-O 3.57Å; R490-E497 VanDerWaalsContact CA-O 3.26Å; R490-E497 WeakPolarHBondContact CA-O 3.32Å; A491-E497 HydrophobicContact CB-CB 4.08Å; A491-E497 HydrophobicContact CB-CG 4.26Å; A491-E497 PolarHBondContact N-O 2.79Å; S495-E497 WeakPolarHBondContact OG-CB 3.4Å; S495-E497 PolarHBondContact OG-N 3.08Å; S495-E497 VanDerWaalsContact OG-N 3.12Å; E497-Q546 PolarHBondContact OE1-NE2 3.46Å; E497-N627 WeakPolarHBondContact CA-ND2 3.5Å
498	L	89.8	Confident	87.9	Confident	8 Å²	8	62.9 Å²	62.9	4%	0.042	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	140.5	179.9	-61.9	177.8	0	0	0	110.4	I488 R489 R490 Y623 Q626	I488-L498 HydrophobicContact CG2-CB 4.12Å; I488-L498 HydrophobicContact CG2-CD1 4.31Å; R489-L498 WeakPolarHBondContact O-CA 3.4Å; R490-L498 HydrophobicContact CG-CD2 3.79Å; L498-Y623 HydrophobicContact CD1-CD2 4.03Å; L498-Y623 HydrophobicContact CD1-CE2 3.81Å; L498-Y623 WeakPolarHBondContact CD1-O 3.14Å; L498-Y623 HydrophobicContact CD2-CE2 4.38Å; L498-Q626 HydrophobicContact CD1-CB 4.1Å
499	T	91.2	Very high	87.9	Confident	28 Å²	28	66.3 Å²	66.3	17%	0.172	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	157.9	-176.3	50.7	0	0	0	0	109.4	I488 R489 A491 Y505	I488-T499 WeakPolarHBondContact CA-O 3.16Å; R489-T499 PolarHBondContact N-O 3.34Å; R489-T499 PolarHBondContact O-N 3.45Å; R489-T499 VanDerWaalsContact O-O 3.07Å; R489-T499 PolarHBondContact O-OG1 3.33Å; R489-T499 VanDerWaalsContact O-OG1 3.11Å; A491-T499 HydrophobicContact CB-CG2 3.76Å; T499-Y505 WeakPolarHBondContact CA-OH 3.3Å; T499-Y505 WeakPolarHBondContact CB-OH 3.34Å
500	V	92.6	Very high	87.8	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.03	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.2	176.8	-177.3	0	0	0	0	109	V463 V470 C486 E487 I488 A503 Y505 L624	V463-V500 HydrophobicContact CG1-CG2 4.44Å; V470-V500 HydrophobicContact CB-CG1 4.45Å; V470-V500 HydrophobicContact CG1-CG1 3.81Å; V470-V500 HydrophobicContact CG1-CG2 4.3Å; C486-V500 HydrophobicContact CB-CG1 3.7Å; E487-V500 CarbonylContact O-C 3.55Å; E487-V500 WeakPolarHBondContact O-CA 3.45Å; I488-V500 HydrophobicContact CG1-CG2 4.4Å; V500-A503 HydrophobicContact CB-CB 3.87Å; V500-A503 HydrophobicContact CG1-CB 3.83Å; V500-Y505 PolarHBondContact N-OH 2.96Å; V500-L624 HydrophobicContact CG2-CD1 3.89Å
501	T	89.4	Confident	87.9	Confident	35 Å²	35	57.8 Å²	57.8	22%	0.215	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	143.7	176.1	59.6	0	0	0	0	110.5	E485 C486 E487 R489 A503	E485-T501 PolarHBondContact O-OG1 2.8Å; C486-T501 WeakPolarHBondContact CA-O 3.41Å; E487-T501 PolarHBondContact N-OG1 2.41Å; E487-T501 PolarHBondContact O-N 2.85Å; E487-T501 PolarHBondContact O-OG1 3.15Å; R489-T501 HydrophobicContact CB-CG2 4.28Å; R489-T501 HydrophobicContact CG-CG2 3.92Å; T501-A503 PolarHBondContact O-N 3.22Å
502	N	87.3	Confident	88.2	Confident	93 Å²	93	63.5 Å²	63.5	50%	0.497	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	-4.9	174.9	-48.9	-44.6	0	0	0	115.9	G483 E485	G483-N502 VanDerWaalsContact O-CB 3.26Å; G483-N502 WeakPolarHBondContact O-CB 3.47Å; G483-N502 PolarHBondContact O-ND2 3.02Å; G483-N502 PolarHBondContact O-OD1 2.76Å; E485-N502 PolarHBondContact O-ND2 2.88Å
503	A	90.8	Very high	88.8	Confident	13 Å²	13	64.4 Å²	64.4	11%	0.107	37%	0.365	C	S	.	.			trans	-73.3	158.9	167.9	0	0	0	0	0	111.9	V463 D472 V500 T501	V463-A503 HydrophobicContact CG1-CB 4.09Å; D472-A503 HydrophobicContact CB-CB 4.22Å; V500-A503 HydrophobicContact CB-CB 3.87Å; V500-A503 HydrophobicContact CG1-CB 3.83Å; T501-A503 PolarHBondContact O-N 3.22Å
504	R	92.4	Very high	89.6	Confident	74 Å²	74	57.6 Å²	57.6	28%	0.279	32%	0.321	S	S	.	.			trans	-90.7	131.4	178.2	-95	176	159.7	171.9	0.8	113.1	S461 D472 L474 T476 V506	S461-R504 VanDerWaalsContact CB-O 3.26Å; S461-R504 WeakPolarHBondContact CB-O 3.32Å; D472-R504 PolarHBondContact OD2-N 2.87Å; L474-R504 HydrophobicContact CB-CB 3.99Å; L474-R504 WeakPolarHBondContact O-CD 3.49Å; L474-R504 PolarHBondContact O-NH1 3.25Å; T476-R504 PolarHBondContact OG1-NH1 3.33Å; T476-R504 PolarHBondContact OG1-NH2 3.34Å; T476-R504 VanDerWaalsContact OG1-NH2 3.12Å; R504-V506 HydrophobicContact CB-CG2 4.28Å
505	Y	94.8	Very high	90.5	Very high	69 Å²	69	57.2 Å²	57.2	27%	0.271	30%	0.299	S	S	.	.			trans	-109.7	112.4	169.1	-69.5	-85.6	0	0	0	106.7	V459 T499 V500 Q546	V459-Y505 HydrophobicContact CG1-CD1 4.17Å; V459-Y505 HydrophobicContact CG1-CG 4.47Å; T499-Y505 WeakPolarHBondContact CA-OH 3.3Å; T499-Y505 WeakPolarHBondContact CB-OH 3.34Å; V500-Y505 PolarHBondContact N-OH 2.96Å; Y505-Q546 VanDerWaalsContact CD1-OE1 3.3Å
506	V	96.6	Very high	91.1	Very high	41 Å²	41	58.7 Å²	58.7	25%	0.248	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116	-172.9	-174.9	0	0	0	0	108.7	A460 L474 R504 V508 L517	A460-V506 PolarHBondContact N-O 3.02Å; A460-V506 PolarHBondContact O-N 2.85Å; L474-V506 HydrophobicContact CD1-CG2 4.13Å; R504-V506 HydrophobicContact CB-CG2 4.28Å; V506-V508 PolarHBondContact O-N 3.24Å; V506-L517 HydrophobicContact CB-CD1 4.06Å; V506-L517 HydrophobicContact CB-CD2 4.42Å; V506-L517 HydrophobicContact CG1-CD1 4.13Å; V506-L517 HydrophobicContact CG1-CD2 4.24Å; V506-L517 HydrophobicContact CG2-CD2 4.18Å
507	P	97.4	Very high	91.8	Very high	99 Å²	99	53.1 Å²	53.1	64%	0.643	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	135.9	170.1	-22.7	34.2	0	0	0	110.6	F458	F458-P507 WeakPolarHBondContact O-CA 3.39Å
508	V	96.8	Very high	92.1	Very high	10 Å²	10	50.3 Å²	50.3	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.1	177.9	-68.2	0	0	0	0	110.5	F443 F458 A460 V506 E513 V514 L517 L545	F443-V508 HydrophobicContact CZ-CB 4.3Å; F443-V508 HydrophobicContact CZ-CG2 4.02Å; F458-V508 HydrophobicContact CB-CG2 3.88Å; F458-V508 PolarHBondContact O-N 2.66Å; A460-V508 HydrophobicContact CB-CG1 4.08Å; A460-V508 HydrophobicContact CB-CG2 4.08Å; V506-V508 PolarHBondContact O-N 3.24Å; V508-E513 HydrophobicContact CG1-CB 4.15Å; V508-V514 HydrophobicContact CB-CG2 4.07Å; V508-V514 HydrophobicContact CG1-CG2 3.99Å; V508-V514 HydrophobicContact CG2-CG2 4.06Å; V508-L517 HydrophobicContact CG1-CD1 3.81Å; V508-L545 HydrophobicContact CG2-CD1 3.82Å
509	S	92.1	Very high	92.1	Very high	84 Å²	84	52.3 Å²	52.3	59%	0.587	28%	0.283	S	S	*	.			trans	-132.9	-22	-173.1	68.4	0	0	0	0	113	E513	S509-E513 WeakPolarHBondContact CA-OE2 3.23Å; S509-E513 PolarHBondContact N-OE2 2.76Å; S509-E513 PolarHBondContact OG-OE1 3.14Å; S509-E513 PolarHBondContact OG-OE2 2.88Å
510	C	90.4	Very high	92.1	Very high	52 Å²	52	52.7 Å²	52.7	35%	0.351	28%	0.284	S	S	.	.	S	Bend	trans	-144.8	161.4	175.6	71.4	0	0	0	0	112.7	K512 E513	C510-K512 VanDerWaalsContact C-N 3.27Å; C510-K512 PolarHBondContact O-N 2.89Å; C510-E513 PolarHBondContact N-OE2 3.46Å; C510-E513 WeakPolarHBondContact O-CB 3.34Å; C510-E513 PolarHBondContact O-N 3.46Å; C510-E513 VanDerWaalsContact O-N 3.15Å
511	E	88.8	Confident	91.9	Very high	40 Å²	40	52.4 Å²	52.4	19%	0.187	28%	0.282	C	S	.	.	H	α-helix	trans	-55.8	-38.8	-177.4	179.5	176.3	-155.9	0	0	113.6	R440 E513 V514 E515	R440-E511 IonicContact CZ-OE1 2.83Å; R440-E511 IonicContact CZ-OE2 2.83Å; R440-E511 VanDerWaalsContact NE-CD 3.35Å; R440-E511 IonicContact NE-OE1 3.68Å; R440-E511 PolarHBondContact NE-OE1 2.82Å; R440-E511 VanDerWaalsContact NE-OE1 3.17Å; R440-E511 IonicContact NE-OE2 2.71Å; R440-E511 PolarHBondContact NE-OE2 2.91Å; R440-E511 IonicContact NH2-OE1 3.38Å; R440-E511 PolarHBondContact NH2-OE1 3.23Å; R440-E511 IonicContact NH2-OE2 2.7Å; R440-E511 PolarHBondContact NH2-OE2 3.45Å; R440-E511 VanDerWaalsContact NH2-OE2 3.1Å; E511-E513 PolarHBondContact O-N 3.04Å; E511-V514 PolarHBondContact O-N 3.46Å; E511-E515 PolarHBondContact O-N 3.32Å
512	K	89.6	Confident	91.7	Very high	165 Å²	165	55.9 Å²	55.9	72%	0.717	30%	0.296	S	S	*	.	H	α-helix	trans	-61.9	-28.4	-178.1	-63.8	178.9	-179.8	176.6	0	112.9	C510 A516	C510-K512 VanDerWaalsContact C-N 3.27Å; C510-K512 PolarHBondContact O-N 2.89Å; K512-A516 WeakPolarHBondContact O-CB 3.45Å; K512-A516 PolarHBondContact O-N 2.81Å; K512-A516 VanDerWaalsContact O-N 3.11Å
513	E	93.8	Very high	91.6	Very high	79 Å²	79	57.1 Å²	57.1	37%	0.369	30%	0.298	S	S	.	.	H	α-helix	trans	-71.3	-41.4	174.3	-66.7	168.1	140	0	0	110.4	V508 S509 C510 E511 A516 L517	V508-E513 HydrophobicContact CG1-CB 4.15Å; S509-E513 WeakPolarHBondContact CA-OE2 3.23Å; S509-E513 PolarHBondContact N-OE2 2.76Å; S509-E513 PolarHBondContact OG-OE1 3.14Å; S509-E513 PolarHBondContact OG-OE2 2.88Å; C510-E513 PolarHBondContact N-OE2 3.46Å; C510-E513 WeakPolarHBondContact O-CB 3.34Å; C510-E513 PolarHBondContact O-N 3.46Å; C510-E513 VanDerWaalsContact O-N 3.15Å; E511-E513 PolarHBondContact O-N 3.04Å; E513-A516 PolarHBondContact O-N 2.81Å; E513-L517 WeakPolarHBondContact O-CG 3.08Å; E513-L517 PolarHBondContact O-N 3.43Å
514	V	92.4	Very high	91.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-69.8	-37.9	176.1	-174.5	0	0	0	0	111.6	I435 M439 F443 V508 E511 A516 L517 L518 F543	I435-V514 HydrophobicContact CG2-CG1 4.33Å; M439-V514 HydrophobicContact CB-CG2 4.46Å; M439-V514 HydrophobicContact CG-CB 3.93Å; M439-V514 HydrophobicContact CG-CG1 3.75Å; M439-V514 HydrophobicContact CG-CG2 3.85Å; M439-V514 HydrophobicContact SD-CG1 4.27Å; M439-V514 HydrophobicContact SD-CG2 4.07Å; F443-V514 HydrophobicContact CE2-CG2 4.44Å; F443-V514 HydrophobicContact CZ-CG2 4.44Å; V508-V514 HydrophobicContact CB-CG2 4.07Å; V508-V514 HydrophobicContact CG1-CG2 3.99Å; V508-V514 HydrophobicContact CG2-CG2 4.06Å; E511-V514 PolarHBondContact O-N 3.46Å; V514-A516 VanDerWaalsContact C-N 3.3Å; V514-A516 PolarHBondContact O-N 3.43Å; V514-L517 WeakPolarHBondContact O-CB 3.49Å; V514-L517 PolarHBondContact O-N 3.37Å; V514-L517 VanDerWaalsContact O-N 3.11Å; V514-L518 HydrophobicContact CG1-CG 4.48Å; V514-L518 WeakPolarHBondContact O-CG 3.39Å; V514-L518 PolarHBondContact O-N 3.39Å; V514-F543 HydrophobicContact CG1-CE2 3.75Å; V514-F543 HydrophobicContact CG1-CZ 3.6Å
515	E	90.4	Very high	90.8	Very high	70 Å²	70	54.8 Å²	54.8	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-56.3	-45.7	171.1	-164.4	-137	127.3	0	0	110.8	R426 E511 L517 L518 H519	R426-E515 IonicContact CZ-OE1 3.18Å; R426-E515 IonicContact NE-OE1 3.08Å; R426-E515 PolarHBondContact NE-OE1 2.87Å; R426-E515 IonicContact NH2-OE1 2.73Å; R426-E515 PolarHBondContact NH2-OE1 3.07Å; E511-E515 PolarHBondContact O-N 3.32Å; E515-L517 VanDerWaalsContact C-N 3.33Å; E515-L517 PolarHBondContact O-N 3.21Å; E515-L518 PolarHBondContact O-N 2.65Å; E515-H519 PolarHBondContact O-CD2 3.04Å; E515-H519 PolarHBondContact O-N 3.18Å; E515-H519 IonicContact OE1-CD2 2.85Å; E515-H519 PolarHBondContact OE1-CD2 3.42Å; E515-H519 IonicContact OE1-NE2 3.14Å; E515-H519 PolarHBondContact OE1-NE2 3.33Å
516	A	92	Very high	89.7	Confident	55 Å²	55	53.7 Å²	53.7	46%	0.455	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-36.2	175.5	0	0	0	0	0	113.1	K512 E513 V514 H519 L520	K512-A516 WeakPolarHBondContact O-CB 3.45Å; K512-A516 PolarHBondContact O-N 2.81Å; K512-A516 VanDerWaalsContact O-N 3.11Å; E513-A516 PolarHBondContact O-N 2.81Å; V514-A516 VanDerWaalsContact C-N 3.3Å; V514-A516 PolarHBondContact O-N 3.43Å; A516-H519 PolarHBondContact O-N 3.31Å; A516-L520 WeakPolarHBondContact O-CB 3.33Å; A516-L520 PolarHBondContact O-N 2.9Å
517	L	93.9	Very high	88.1	Confident	20 Å²	20	55.7 Å²	55.7	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-68.4	-40.8	174.1	-67.3	177.9	0	0	0	112.5	A460 L474 V506 V508 E513 V514 E515 H519 L520 A521	A460-L517 HydrophobicContact CB-CD1 3.92Å; L474-L517 HydrophobicContact CD1-CD1 4.36Å; L474-L517 HydrophobicContact CD1-CD2 4.22Å; L474-L517 HydrophobicContact CD2-CB 3.91Å; L474-L517 HydrophobicContact CD2-CD2 4.04Å; L474-L517 HydrophobicContact CD2-CG 4.48Å; V506-L517 HydrophobicContact CB-CD1 4.06Å; V506-L517 HydrophobicContact CB-CD2 4.42Å; V506-L517 HydrophobicContact CG1-CD1 4.13Å; V506-L517 HydrophobicContact CG1-CD2 4.24Å; V506-L517 HydrophobicContact CG2-CD2 4.18Å; V508-L517 HydrophobicContact CG1-CD1 3.81Å; E513-L517 WeakPolarHBondContact O-CG 3.08Å; E513-L517 PolarHBondContact O-N 3.43Å; V514-L517 WeakPolarHBondContact O-CB 3.49Å; V514-L517 PolarHBondContact O-N 3.37Å; V514-L517 VanDerWaalsContact O-N 3.11Å; E515-L517 VanDerWaalsContact C-N 3.33Å; E515-L517 PolarHBondContact O-N 3.21Å; L517-H519 VanDerWaalsContact C-N 3.34Å; L517-H519 PolarHBondContact O-N 3.19Å; L517-L520 PolarHBondContact O-N 3.4Å; L517-A521 WeakPolarHBondContact O-CB 2.9Å; L517-A521 PolarHBondContact O-N 2.86Å
518	L	91.8	Very high	86.2	Confident	16 Å²	16	52.2 Å²	52.2	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-42.2	173.2	-70.2	176.2	0	0	0	111.2	I435 Y462 V514 E515 A521 H522	I435-L518 HydrophobicContact CB-CD1 4.32Å; I435-L518 HydrophobicContact CD1-CD2 4.08Å; I435-L518 HydrophobicContact CG2-CD1 3.99Å; I435-L518 HydrophobicContact CG2-CD2 4.23Å; Y462-L518 HydrophobicContact CD1-CD2 4.14Å; Y462-L518 HydrophobicContact CE1-CD2 3.75Å; V514-L518 HydrophobicContact CG1-CG 4.48Å; V514-L518 WeakPolarHBondContact O-CG 3.39Å; V514-L518 PolarHBondContact O-N 3.39Å; E515-L518 PolarHBondContact O-N 2.65Å; L518-A521 WeakPolarHBondContact O-CB 3.29Å; L518-A521 PolarHBondContact O-N 3.17Å; L518-H522 WeakPolarHBondContact O-CB 3.47Å; L518-H522 PolarHBondContact O-N 3.36Å
519	H	89.1	Confident	84.2	Confident	50 Å²	50	55.4 Å²	55.4	23%	0.231	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-34.6	176.9	-74.9	-56.1	0	0	0	113.8	R426 E515 A516 L517 Q523	R426-H519 WeakPolarHBondContact CD-NE2 3.36Å; R426-H519 WeakPolarHBondContact CG-NE2 3.34Å; R426-H519 PolarHBondContact NE-CD2 3.02Å; R426-H519 PolarHBondContact NE-NE2 3.47Å; R426-H519 VanDerWaalsContact NE-NE2 3.1Å; R426-H519 PolarHBondContact NH2-CD2 3.34Å; R426-H519 VanDerWaalsContact NH2-CD2 3.28Å; E515-H519 PolarHBondContact O-CD2 3.04Å; E515-H519 PolarHBondContact O-N 3.18Å; E515-H519 IonicContact OE1-CD2 2.85Å; E515-H519 PolarHBondContact OE1-CD2 3.42Å; E515-H519 IonicContact OE1-NE2 3.14Å; E515-H519 PolarHBondContact OE1-NE2 3.33Å; A516-H519 PolarHBondContact O-N 3.31Å; L517-H519 VanDerWaalsContact C-N 3.34Å; L517-H519 PolarHBondContact O-N 3.19Å; H519-Q523 WeakPolarHBondContact O-CB 3.44Å; H519-Q523 VanDerWaalsContact O-CG 3.25Å; H519-Q523 WeakPolarHBondContact O-CG 3.41Å; H519-Q523 PolarHBondContact O-N 2.99Å
520	L	90.9	Very high	82.1	Confident	36 Å²	36	57.3 Å²	57.3	19%	0.188	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-44.2	169.5	173.2	60.2	0	0	0	111.4	L474 T476 A516 L517 Q523 N524	L474-L520 HydrophobicContact CB-CD2 4.46Å; T476-L520 HydrophobicContact CG2-CD1 3.73Å; T476-L520 HydrophobicContact CG2-CD2 3.66Å; T476-L520 HydrophobicContact CG2-CG 4.36Å; A516-L520 WeakPolarHBondContact O-CB 3.33Å; A516-L520 PolarHBondContact O-N 2.9Å; L517-L520 PolarHBondContact O-N 3.4Å; L520-Q523 PolarHBondContact O-N 2.8Å; L520-N524 WeakPolarHBondContact O-CB 3.26Å; L520-N524 PolarHBondContact O-N 2.83Å
521	A	90.1	Very high	80	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.9	-47.4	176.9	0	0	0	0	0	111.9	Y462 L473 L474 L517 L518 Q523 N524 R525	Y462-A521 HydrophobicContact CD1-CB 3.31Å; Y462-A521 HydrophobicContact CE1-CB 3.54Å; Y462-A521 HydrophobicContact CG-CB 4.3Å; L473-A521 HydrophobicContact CB-CB 3.75Å; L473-A521 HydrophobicContact CD1-CB 4.25Å; L473-A521 WeakPolarHBondContact O-CA 3.39Å; L474-A521 HydrophobicContact CD2-CB 4.39Å; L517-A521 WeakPolarHBondContact O-CB 2.9Å; L517-A521 PolarHBondContact O-N 2.86Å; L518-A521 WeakPolarHBondContact O-CB 3.29Å; L518-A521 PolarHBondContact O-N 3.17Å; A521-Q523 PolarHBondContact O-N 2.85Å; A521-N524 PolarHBondContact O-N 2.93Å; A521-N524 VanDerWaalsContact O-N 3.14Å; A521-R525 WeakPolarHBondContact O-CG 3.42Å; A521-R525 PolarHBondContact O-N 2.98Å
522	H	85.1	Confident	77.8	Confident	108 Å²	108	64.5 Å²	64.5	50%	0.5	35%	0.349	S	S	.	.	H	α-helix	trans	-58.1	-45.2	175.2	-178.4	-82.7	0	0	0	111.9	L518 N524 R525 A526	L518-H522 WeakPolarHBondContact O-CB 3.47Å; L518-H522 PolarHBondContact O-N 3.36Å; H522-N524 VanDerWaalsContact C-N 3.35Å; H522-N524 PolarHBondContact O-N 3.33Å; H522-R525 PolarHBondContact O-N 3.35Å; H522-A526 WeakPolarHBondContact O-CB 3.38Å; H522-A526 PolarHBondContact O-N 3.25Å
523	Q	85.5	Confident	75.7	Confident	118 Å²	118	59.6 Å²	59.6	55%	0.551	33%	0.331	S	S	*	.	H	α-helix	trans	-61	-42	174.3	-73.6	173.3	13.9	0	0	112.1	H519 L520 A521 A526 V527	H519-Q523 WeakPolarHBondContact O-CB 3.44Å; H519-Q523 VanDerWaalsContact O-CG 3.25Å; H519-Q523 WeakPolarHBondContact O-CG 3.41Å; H519-Q523 PolarHBondContact O-N 2.99Å; L520-Q523 PolarHBondContact O-N 2.8Å; A521-Q523 PolarHBondContact O-N 2.85Å; Q523-A526 PolarHBondContact O-N 3.26Å; Q523-V527 WeakPolarHBondContact O-CG2 3.39Å; Q523-V527 PolarHBondContact O-N 2.86Å
524	N	84.7	Confident	73.8	Confident	19 Å²	19	63.2 Å²	63.2	10%	0.102	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-38.1	178	-83.3	-29.1	0	0	0	112.5	L473 A475 K480 L520 A521 H522 A528	L473-N524 PolarHBondContact O-ND2 2.86Å; A475-N524 PolarHBondContact O-ND2 3.15Å; K480-N524 WeakPolarHBondContact CE-OD1 3.08Å; K480-N524 PolarHBondContact NZ-OD1 3.1Å; L520-N524 WeakPolarHBondContact O-CB 3.26Å; L520-N524 PolarHBondContact O-N 2.83Å; A521-N524 PolarHBondContact O-N 2.93Å; A521-N524 VanDerWaalsContact O-N 3.14Å; H522-N524 VanDerWaalsContact C-N 3.35Å; H522-N524 PolarHBondContact O-N 3.33Å; N524-A528 PolarHBondContact O-N 3.46Å
525	R	80.8	Confident	72.3	Confident	20 Å²	20	64.1 Å²	64.1	8%	0.075	35%	0.349	C	S	.	.	H	α-helix	trans	-67.6	-40.8	171.9	-65.6	-178.4	89.9	-167.2	2.7	112	E464 L473 A521 H522 V527 A528 H529 S536 S539 S541	E464-R525 IonicContact OE1-CZ 2.79Å; E464-R525 IonicContact OE1-NE 2.84Å; E464-R525 PolarHBondContact OE1-NE 3.31Å; E464-R525 IonicContact OE1-NH2 3.81Å; L473-R525 HydrophobicContact CD1-CG 4.2Å; L473-R525 HydrophobicContact CD2-CG 3.57Å; A521-R525 WeakPolarHBondContact O-CG 3.42Å; A521-R525 PolarHBondContact O-N 2.98Å; H522-R525 PolarHBondContact O-N 3.35Å; R525-V527 PolarHBondContact O-N 3.37Å; R525-A528 WeakPolarHBondContact O-CB 3.27Å; R525-A528 PolarHBondContact O-N 3.4Å; R525-A528 VanDerWaalsContact O-N 3.15Å; R525-H529 PolarHBondContact O-N 3.04Å; R525-S536 PolarHBondContact NH2-O 2.91Å; R525-S536 VanDerWaalsContact NH2-O 3.09Å; R525-S539 PolarHBondContact NH2-OG 2.85Å; R525-S541 PolarHBondContact NH1-OG 2.87Å; R525-S541 PolarHBondContact NH2-OG 3.25Å
526	A	71.6	Confident	71.1	Confident	45 Å²	45	63.4 Å²	63.4	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-40.5	177.3	0	0	0	0	0	112.8	H522 Q523 A528 H529 T530	H522-A526 WeakPolarHBondContact O-CB 3.38Å; H522-A526 PolarHBondContact O-N 3.25Å; Q523-A526 PolarHBondContact O-N 3.26Å; A526-A528 VanDerWaalsContact C-N 3.29Å; A526-A528 PolarHBondContact O-N 3.02Å; A526-H529 WeakPolarHBondContact O-CB 3.28Å; A526-H529 PolarHBondContact O-N 3.42Å; A526-H529 VanDerWaalsContact O-N 3.11Å; A526-T530 PolarHBondContact O-N 3.32Å
527	V	63.6	Low	70.2	Confident	83 Å²	83	62 Å²	62	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-67.1	-29	174.3	171.7	0	0	0	0	112.2	Q523 R525 T530	Q523-V527 WeakPolarHBondContact O-CG2 3.39Å; Q523-V527 PolarHBondContact O-N 2.86Å; R525-V527 PolarHBondContact O-N 3.37Å; V527-T530 PolarHBondContact O-OG1 2.94Å
528	A	57.9	Low	69.5	Low	26 Å²	26	63.3 Å²	63.3	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-75.3	-27.1	171.4	0	0	0	0	0	112.6	N524 R525 A526 A531	N524-A528 PolarHBondContact O-N 3.46Å; R525-A528 WeakPolarHBondContact O-CB 3.27Å; R525-A528 PolarHBondContact O-N 3.4Å; R525-A528 VanDerWaalsContact O-N 3.15Å; A526-A528 VanDerWaalsContact C-N 3.29Å; A526-A528 PolarHBondContact O-N 3.02Å; A528-A531 PolarHBondContact O-N 3.28Å
529	H	54.3	Low	69.3	Low	77 Å²	77	62.6 Å²	62.6	36%	0.356	34%	0.338	S	S	.	.	H	α-helix	trans	-72.8	-24.7	180	-166.5	-46.1	0	0	0	113.2	R525 A526	R525-H529 PolarHBondContact O-N 3.04Å; A526-H529 WeakPolarHBondContact O-CB 3.28Å; A526-H529 PolarHBondContact O-N 3.42Å; A526-H529 VanDerWaalsContact O-N 3.11Å
530	T	48.3	Very low	69.5	Low	125 Å²	125	60.4 Å²	60.4	77%	0.767	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.5	172.3	48.3	0	0	0	0	113.7	A526 V527	A526-T530 PolarHBondContact O-N 3.32Å; V527-T530 PolarHBondContact O-OG1 2.94Å
531	A	46	Very low	69.6	Low	79 Å²	79	58.7 Å²	58.7	65%	0.653	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-41.7	-179.8	0	0	0	0	0	113.3	A528	A528-A531 PolarHBondContact O-N 3.28Å
532	Q	41.2	Very low	69.9	Low	163 Å²	163	58.8 Å²	58.8	76%	0.762	32%	0.32	S	S	*	.	S	Bend	trans	-168.6	126.1	175.4	-110	163.3	4.5	0	0	112.4
533	N	45.8	Very low	70.5	Confident	62 Å²	62	53.7 Å²	53.7	33%	0.332	30%	0.296	S	S	.	.	S	Bend	trans	59.2	165.5	173.6	-70	-35.1	0	0	0	117.6	R535 R586	N533-R535 PolarHBondContact O-N 3.49Å; N533-R586 PolarHBondContact OD1-NH2 2.87Å
534	K	54.9	Low	71.1	Confident	156 Å²	156	48.6 Å²	48.6	68%	0.678	27%	0.272	S	S	*	.			trans	-65.2	93.9	165.5	-77.9	-173.3	175.6	-177.6	0	109.3	S537	K534-S537 PolarHBondContact O-OG 3.44Å
535	R	60.7	Low	71.7	Confident	19 Å²	19	47.7 Å²	47.7	7%	0.072	27%	0.268	C	S	.	.			trans	-84.7	-37.7	-169	-174.5	-177	176.7	78	10.6	114.4	E464 Y466 N533 S537 R538 S539	E464-R535 IonicContact OE1-NE 3.14Å; E464-R535 IonicContact OE2-CZ 2.72Å; E464-R535 IonicContact OE2-NE 2.75Å; E464-R535 PolarHBondContact OE2-NE 3.24Å; E464-R535 IonicContact OE2-NH2 3.11Å; E464-R535 PolarHBondContact OE2-NH2 2.88Å; Y466-R535 VanDerWaalsContact CB-NH2 3.3Å; N533-R535 PolarHBondContact O-N 3.49Å; R535-S537 VanDerWaalsContact C-N 3.32Å; R535-S537 PolarHBondContact O-N 3.15Å; R535-R538 WeakPolarHBondContact O-CA 3.24Å; R535-R538 PolarHBondContact O-N 2.85Å; R535-S539 PolarHBondContact O-N 2.8Å; R535-S539 PolarHBondContact O-OG 2.85Å
536	S	65.2	Low	72.4	Confident	55 Å²	55	48.4 Å²	48.4	39%	0.385	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-64.5	-31.8	-170	46.8	0	0	0	0	114.1	R525 R538	R525-S536 PolarHBondContact NH2-O 2.91Å; R525-S536 VanDerWaalsContact NH2-O 3.09Å; S536-R538 PolarHBondContact O-N 3.27Å
537	S	73.4	Confident	73.5	Confident	26 Å²	26	46.4 Å²	46.4	18%	0.182	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-71.5	-11.6	172.5	40.9	0	0	0	0	114.2	T413 K534 R535 G569	T413-S537 WeakPolarHBondContact OG1-CB 3.41Å; K534-S537 PolarHBondContact O-OG 3.44Å; R535-S537 VanDerWaalsContact C-N 3.32Å; R535-S537 PolarHBondContact O-N 3.15Å; S537-G569 PolarHBondContact O-N 2.92Å
538	R	79.8	Confident	75	Confident	47 Å²	47	45.6 Å²	45.6	18%	0.177	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-119.6	11.6	-166.4	-66.9	-169	173.2	-169.1	-11.7	113.5	Y466 R535 S536 E589 I593	Y466-R538 WeakPolarHBondContact CD2-O 3.14Å; Y466-R538 HydrophobicContact CE2-CB 4.41Å; R535-R538 WeakPolarHBondContact O-CA 3.24Å; R535-R538 PolarHBondContact O-N 2.85Å; S536-R538 PolarHBondContact O-N 3.27Å; R538-E589 WeakPolarHBondContact CD-OE1 3.49Å; R538-E589 IonicContact CZ-OE1 2.8Å; R538-E589 IonicContact CZ-OE2 3.3Å; R538-E589 IonicContact NE-OE1 2.66Å; R538-E589 IonicContact NH1-OE1 3.54Å; R538-E589 PolarHBondContact NH1-OE1 3.16Å; R538-E589 IonicContact NH1-OE2 3.5Å; R538-E589 PolarHBondContact NH1-OE2 3.42Å; R538-I593 HydrophobicContact CB-CD1 3.66Å; R538-I593 HydrophobicContact CG-CD1 4.09Å; R538-I593 VanDerWaalsContact O-CD1 3.3Å; R538-I593 WeakPolarHBondContact O-CD1 3.47Å
539	S	87.6	Confident	76.8	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	25%	0.245	C	C	.	.	S	Bend	trans	-133.7	142	177.6	58.3	0	0	0	0	110.7	E464 I465 R525 R535	E464-S539 WeakPolarHBondContact CG-OG 3.22Å; E464-S539 WeakPolarHBondContact OE1-CB 3.42Å; E464-S539 PolarHBondContact OE1-OG 3.09Å; I465-S539 WeakPolarHBondContact O-CA 3.44Å; R525-S539 PolarHBondContact NH2-OG 2.85Å; R535-S539 PolarHBondContact O-N 2.8Å; R535-S539 PolarHBondContact O-OG 2.85Å
540	H	92.1	Very high	78.7	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.019	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	143.4	169.9	-49.6	-72	0	0	0	109.1	E464 I465 D566 L567 A568 S596 L621	E464-H540 CarbonylContact C-O 3.49Å; E464-H540 WeakPolarHBondContact CA-O 3.31Å; I465-H540 HydrophobicContact CB-CB 4.36Å; I465-H540 PolarHBondContact N-O 3.21Å; I465-H540 PolarHBondContact O-N 2.89Å; H540-D566 CarbonylContact C-O 3.55Å; H540-D566 WeakPolarHBondContact CA-O 3.24Å; H540-L567 HydrophobicContact CB-CD2 4.49Å; H540-L567 WeakPolarHBondContact ND1-CA 3.29Å; H540-L567 WeakPolarHBondContact ND1-CD2 3.37Å; H540-A568 PolarHBondContact ND1-N 3.32Å; H540-S596 PolarHBondContact NE2-OG 3.24Å; H540-L621 HydrophobicContact CB-CD1 4.27Å
541	S	94.1	Very high	80.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	114.2	-176.8	-28.2	0	0	0	0	107.5	R525 V565 D566	R525-S541 PolarHBondContact NH1-OG 2.87Å; R525-S541 PolarHBondContact NH2-OG 3.25Å; S541-V565 WeakPolarHBondContact O-CA 3.47Å; S541-D566 PolarHBondContact N-O 3.48Å; S541-D566 PolarHBondContact O-N 3.02Å; S541-D566 PolarHBondContact OG-O 2.7Å
542	V	96.6	Very high	82.8	Confident	1 Å²	1	39 Å²	39	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	101.4	-176.8	179.7	0	0	0	0	108.7	Y462 V463 V565 L621 L624 L625	Y462-V542 WeakPolarHBondContact CD2-O 3.46Å; V463-V542 HydrophobicContact CG2-CB 4.01Å; V463-V542 PolarHBondContact N-O 3.46Å; V463-V542 PolarHBondContact O-N 2.8Å; V542-V565 HydrophobicContact CG1-CG2 4.33Å; V542-V565 HydrophobicContact CG2-CG1 4.09Å; V542-V565 HydrophobicContact CG2-CG2 4.28Å; V542-L621 HydrophobicContact CG2-CD1 4.02Å; V542-L624 HydrophobicContact CB-CD2 4.28Å; V542-L624 HydrophobicContact CG1-CD2 4.04Å; V542-L624 HydrophobicContact CG2-CD2 4.31Å; V542-L625 HydrophobicContact CG1-CD2 4.09Å
543	F	97.3	Very high	85	Confident	1 Å²	1	35.8 Å²	35.8	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	120.1	165.9	178.3	-89.4	0	0	0	108	I435 M439 A460 Y462 V514 L545 N563 L564	I435-F543 HydrophobicContact CD1-CB 4.27Å; I435-F543 HydrophobicContact CG2-CD1 3.99Å; I435-F543 HydrophobicContact CG2-CD2 4.42Å; I435-F543 HydrophobicContact CG2-CE1 3.96Å; I435-F543 HydrophobicContact CG2-CE2 4.4Å; I435-F543 HydrophobicContact CG2-CG 4.23Å; I435-F543 HydrophobicContact CG2-CZ 4.18Å; M439-F543 HydrophobicContact CE-CE1 3.8Å; M439-F543 HydrophobicContact CE-CZ 4.45Å; M439-F543 HydrophobicContact SD-CE1 3.89Å; M439-F543 HydrophobicContact SD-CZ 3.95Å; A460-F543 HydrophobicContact CB-CE2 4.18Å; A460-F543 HydrophobicContact CB-CZ 4.09Å; Y462-F543 HydrophobicContact CD1-CD2 4.29Å; Y462-F543 HydrophobicContact CD2-CB 3.92Å; Y462-F543 HydrophobicContact CE2-CB 4.03Å; Y462-F543 HydrophobicContact CG-CB 4.3Å; Y462-F543 HydrophobicContact CG-CD2 4.15Å; V514-F543 HydrophobicContact CG1-CE2 3.75Å; V514-F543 HydrophobicContact CG1-CZ 3.6Å; F543-L545 HydrophobicContact CE1-CB 4.15Å; F543-N563 WeakPolarHBondContact O-CA 3.36Å; F543-L564 HydrophobicContact CB-CB 4.42Å; F543-L564 HydrophobicContact CD1-CB 4.39Å; F543-L564 HydrophobicContact CD1-CD1 4.22Å; F543-L564 PolarHBondContact N-O 2.92Å; F543-L564 PolarHBondContact O-N 2.99Å
544	Q	96.9	Very high	86.9	Confident	12 Å²	12	36.8 Å²	36.8	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.3	-178.7	178.5	-176.8	-8.3	0	0	109.5	S461 P561 L562	S461-Q544 PolarHBondContact N-O 2.92Å; S461-Q544 PolarHBondContact O-N 3.03Å; S461-Q544 PolarHBondContact OG-O 3.35Å; Q544-P561 HydrophobicContact CG-CB 4.35Å; Q544-L562 WeakPolarHBondContact CA-O 3.23Å
545	L	97.2	Very high	88.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	109.5	171.5	-170.4	78.4	0	0	0	108.7	M439 L442 F458 A460 V508 F543 I547 P561 L562	M439-L545 HydrophobicContact CE-CD2 3.95Å; M439-L545 HydrophobicContact SD-CD1 4.08Å; M439-L545 HydrophobicContact SD-CD2 3.81Å; M439-L545 HydrophobicContact SD-CG 4.44Å; L442-L545 HydrophobicContact CD1-CD2 3.63Å; F458-L545 HydrophobicContact CB-CD1 4.12Å; F458-L545 HydrophobicContact CD1-CD2 3.85Å; F458-L545 HydrophobicContact CD1-CG 4.32Å; F458-L545 HydrophobicContact CE1-CD2 4.47Å; A460-L545 HydrophobicContact CB-CD1 4.09Å; V508-L545 HydrophobicContact CG2-CD1 3.82Å; F543-L545 HydrophobicContact CE1-CB 4.15Å; L545-I547 HydrophobicContact CD2-CD1 4.2Å; L545-I547 HydrophobicContact CD2-CG1 4.03Å; L545-I547 HydrophobicContact CG-CG1 4.29Å; L545-P561 WeakPolarHBondContact O-CA 3.3Å; L545-L562 HydrophobicContact CB-CB 4.44Å; L545-L562 PolarHBondContact N-O 2.96Å; L545-L562 PolarHBondContact O-N 2.99Å
546	Q	95.6	Very high	89.8	Confident	34 Å²	34	34.3 Å²	34.3	16%	0.159	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.1	167.1	-69.8	168.6	-62.2	0	0	108.4	F458 V459 E497 Y505	F458-Q546 WeakPolarHBondContact CA-O 3.22Å; V459-Q546 HydrophobicContact CB-CB 4.36Å; V459-Q546 PolarHBondContact N-O 2.78Å; V459-Q546 PolarHBondContact O-N 2.86Å; E497-Q546 PolarHBondContact OE1-NE2 3.46Å; Y505-Q546 VanDerWaalsContact CD1-OE1 3.3Å
547	I	95.8	Very high	91	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.015	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.9	176.3	-50.2	-173.2	0	0	0	108.5	A399 L400 L442 Y456 F458 L545 G559 A560	A399-I547 HydrophobicContact CB-CD1 3.61Å; L400-I547 HydrophobicContact CD2-CG2 4.02Å; L442-I547 HydrophobicContact CD1-CD1 4.27Å; L442-I547 HydrophobicContact CD2-CD1 4.03Å; Y456-I547 HydrophobicContact CD1-CG2 3.94Å; Y456-I547 HydrophobicContact CE1-CG2 4.34Å; F458-I547 HydrophobicContact CD1-CB 4.38Å; F458-I547 HydrophobicContact CD1-CD1 4.42Å; F458-I547 HydrophobicContact CD1-CG1 3.95Å; F458-I547 HydrophobicContact CD1-CG2 4.11Å; F458-I547 HydrophobicContact CE1-CB 4.46Å; F458-I547 HydrophobicContact CE1-CD1 4.13Å; F458-I547 HydrophobicContact CE1-CG1 4.09Å; F458-I547 HydrophobicContact CE1-CG2 3.8Å; L545-I547 HydrophobicContact CD2-CD1 4.2Å; L545-I547 HydrophobicContact CD2-CG1 4.03Å; L545-I547 HydrophobicContact CG-CG1 4.29Å; I547-G559 CarbonylContact O-C 3.53Å; I547-G559 WeakPolarHBondContact O-CA 3.3Å; I547-A560 WeakPolarHBondContact CB-O 3.42Å; I547-A560 PolarHBondContact N-O 2.86Å; I547-A560 PolarHBondContact O-N 3.45Å
548	S	95.1	Very high	91.7	Very high	67 Å²	67	38.3 Å²	38.3	47%	0.469	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	114.7	172.7	-69.5	0	0	0	0	110.3	S457	S457-S548 PolarHBondContact N-O 3.38Å; S457-S548 PolarHBondContact O-N 3.09Å; S457-S548 PolarHBondContact OG-O 3.3Å
549	G	94.5	Very high	92.1	Very high	4 Å²	4	37.9 Å²	37.9	4%	0.041	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.3	178.1	0	0	0	0	0	112.6	T455 Y456 Q557 C558	T455-G549 CarbonylContact O-C 3.59Å; T455-G549 WeakPolarHBondContact O-CA 3.43Å; Y456-G549 VanDerWaalsContact CD1-CA 3.48Å; G549-Q557 CarbonylContact O-C 3.55Å; G549-Q557 WeakPolarHBondContact O-CA 3.37Å; G549-C558 PolarHBondContact N-O 2.99Å; G549-C558 PolarHBondContact O-N 3.31Å
550	E	94.1	Very high	92.3	Very high	83 Å²	83	38.1 Å²	38.1	39%	0.388	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	135.4	179.1	-178.7	173.9	139	0	0	110.9	W454 T455 L556 Q557	W454-E550 WeakPolarHBondContact CA-O 3.42Å; T455-E550 PolarHBondContact N-O 3.12Å; T455-E550 PolarHBondContact O-N 2.9Å; E550-L556 CarbonylContact C-O 3.6Å; E550-L556 WeakPolarHBondContact CA-O 3.43Å; E550-Q557 HydrophobicContact CB-CG 4.23Å; E550-Q557 HydrophobicContact CG-CG 4Å; E550-Q557 PolarHBondContact OE2-NE2 3.28Å
551	H	91.8	Very high	92.4	Very high	13 Å²	13	39 Å²	39	6%	0.06	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	83.3	169.6	-177	-50.6	0	0	0	109	Q452 W454 A553 R554 G555 L556	Q452-H551 PolarHBondContact O-CD2 3.5Å; Q452-H551 PolarHBondContact O-NE2 2.88Å; W454-H551 AromaticContact CD1-CD2 3.93Å; W454-H551 HydrophobicContact CD2-CB 3.84Å; W454-H551 AromaticContact CE2-CD2 3.98Å; W454-H551 HydrophobicContact CE3-CB 3.9Å; W454-H551 HydrophobicContact CG-CB 4.38Å; W454-H551 HydrophobicContact CH2-CB 4.18Å; W454-H551 HydrophobicContact CZ2-CB 4.14Å; W454-H551 HydrophobicContact CZ3-CB 4.07Å; W454-H551 AromaticContact NE1-CD2 3.73Å; H551-A553 VanDerWaalsContact C-N 3.3Å; H551-A553 PolarHBondContact O-N 2.81Å; H551-A553 VanDerWaalsContact O-N 3.14Å; H551-R554 VanDerWaalsContact CE1-CD 3.43Å; H551-R554 WeakPolarHBondContact CE1-CD 3.39Å; H551-R554 WeakPolarHBondContact CE1-CG 3.27Å; H551-R554 PolarHBondContact CE1-NE 3.36Å; H551-R554 PolarHBondContact ND1-N 2.99Å; H551-R554 PolarHBondContact NE2-NE 3.23Å; H551-R554 PolarHBondContact O-N 3.14Å; H551-G555 PolarHBondContact O-N 3.25Å; H551-G555 VanDerWaalsContact O-N 3.09Å; H551-L556 HydrophobicContact CB-CB 4.31Å; H551-L556 PolarHBondContact N-O 3.46Å; H551-L556 PolarHBondContact O-N 3.34Å
552	A	89.3	Confident	92.6	Very high	68 Å²	68	39 Å²	39	56%	0.562	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-50.9	-43.6	-170	0	0	0	0	0	113.6	R554 G555	A552-R554 PolarHBondContact O-N 2.91Å; A552-R554 VanDerWaalsContact O-N 3.07Å; A552-G555 PolarHBondContact O-N 2.98Å
553	A	87.6	Confident	92.6	Very high	96 Å²	96	39 Å²	39	79%	0.793	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-68.1	-5.5	-179.5	0	0	0	0	0	115.4	H551	H551-A553 VanDerWaalsContact C-N 3.3Å; H551-A553 PolarHBondContact O-N 2.81Å; H551-A553 VanDerWaalsContact O-N 3.14Å
554	R	86.4	Confident	92.6	Very high	83 Å²	83	39.1 Å²	39.1	31%	0.313	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-125.8	0.1	174.3	-68.5	174.3	-165	-80.1	-1.2	112.7	G288 D289 Y292 H551 A552 L556	G288-R554 PolarHBondContact O-NH2 2.91Å; D289-R554 IonicContact OD1-CZ 2.71Å; D289-R554 IonicContact OD1-NH1 2.79Å; D289-R554 PolarHBondContact OD1-NH1 2.81Å; D289-R554 IonicContact OD1-NH2 3.15Å; D289-R554 PolarHBondContact OD1-NH2 3.39Å; Y292-R554 VanDerWaalsContact CG-CZ 3.45Å; H551-R554 VanDerWaalsContact CE1-CD 3.43Å; H551-R554 WeakPolarHBondContact CE1-CD 3.39Å; H551-R554 WeakPolarHBondContact CE1-CG 3.27Å; H551-R554 PolarHBondContact CE1-NE 3.36Å; H551-R554 PolarHBondContact ND1-N 2.99Å; H551-R554 PolarHBondContact NE2-NE 3.23Å; H551-R554 PolarHBondContact O-N 3.14Å; A552-R554 PolarHBondContact O-N 2.91Å; A552-R554 VanDerWaalsContact O-N 3.07Å; R554-L556 HydrophobicContact CB-CD1 3.9Å; R554-L556 HydrophobicContact CB-CG 3.91Å; R554-L556 PolarHBondContact O-N 3.15Å
555	G	88.1	Confident	92.7	Very high	67 Å²	67	38.5 Å²	38.5	69%	0.691	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	21.2	-177.5	0	0	0	0	0	115	H551 A552	H551-G555 PolarHBondContact O-N 3.25Å; H551-G555 VanDerWaalsContact O-N 3.09Å; A552-G555 PolarHBondContact O-N 2.98Å
556	L	88.2	Confident	92.6	Very high	56 Å²	56	38.7 Å²	38.7	29%	0.293	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	139.8	-176.8	-58	170.1	0	0	0	111	Y292 W454 E550 H551 R554	Y292-L556 HydrophobicContact CE2-CD1 3.5Å; Y292-L556 WeakPolarHBondContact OH-CD1 3.47Å; W454-L556 HydrophobicContact CH2-CB 4.19Å; E550-L556 CarbonylContact C-O 3.6Å; E550-L556 WeakPolarHBondContact CA-O 3.43Å; H551-L556 HydrophobicContact CB-CB 4.31Å; H551-L556 PolarHBondContact N-O 3.46Å; H551-L556 PolarHBondContact O-N 3.34Å; R554-L556 HydrophobicContact CB-CD1 3.9Å; R554-L556 HydrophobicContact CB-CG 3.91Å; R554-L556 PolarHBondContact O-N 3.15Å
557	Q	90.1	Very high	92.5	Very high	140 Å²	140	37.2 Å²	37.2	65%	0.654	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.4	170.9	-69.6	-178.8	-21	0	0	110.3	G549 E550	G549-Q557 CarbonylContact O-C 3.55Å; G549-Q557 WeakPolarHBondContact O-CA 3.37Å; E550-Q557 HydrophobicContact CB-CG 4.23Å; E550-Q557 HydrophobicContact CG-CG 4Å; E550-Q557 PolarHBondContact OE2-NE2 3.28Å
558	C	88.7	Confident	92.3	Very high	24 Å²	24	37.1 Å²	37.1	16%	0.162	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	139.9	171	61.6	0	0	0	0	109.8	R299 W454 G549	R299-C558 PolarHBondContact NH1-SG 3.29Å; R299-C558 VanDerWaalsContact NH1-SG 3.41Å; W454-C558 VanDerWaalsContact CZ3-SG 3.52Å; G549-C558 PolarHBondContact N-O 2.99Å; G549-C558 PolarHBondContact O-N 3.31Å
559	G	87.1	Confident	91.9	Very high	38 Å²	38	34 Å²	34	39%	0.392	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	143.4	179.2	0	0	0	0	0	112.9	I547	I547-G559 CarbonylContact O-C 3.53Å; I547-G559 WeakPolarHBondContact O-CA 3.3Å
560	A	92.3	Very high	91.5	Very high	6 Å²	6	34.1 Å²	34.1	5%	0.05	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	150.5	-178.6	0	0	0	0	0	111.3	Y403 I547	Y403-A560 VanDerWaalsContact C-CB 3.42Å; Y403-A560 WeakPolarHBondContact O-CB 3.21Å; I547-A560 WeakPolarHBondContact CB-O 3.42Å; I547-A560 PolarHBondContact N-O 2.86Å; I547-A560 PolarHBondContact O-N 3.45Å
561	P	94.5	Very high	90.9	Very high	23 Å²	23	32.8 Å²	32.8	15%	0.149	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.4	169.6	33.3	-33.6	0	0	0	111.4	P404 V405 Q544 L545 S628	P404-P561 HydrophobicContact CB-CG 4.32Å; V405-P561 PolarHBondContact N-O 3.33Å; Q544-P561 HydrophobicContact CG-CB 4.35Å; L545-P561 WeakPolarHBondContact O-CA 3.3Å; P561-S628 WeakPolarHBondContact CG-OG 3.3Å
562	L	96.9	Very high	90	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.6	156.5	171.7	63.1	0	0	0	108.4	V396 A399 V405 A438 M439 L442 Q544 L545 L564	V396-L562 HydrophobicContact CG1-CD2 4.18Å; A399-L562 HydrophobicContact CB-CB 4.1Å; V405-L562 HydrophobicContact CB-CD1 3.67Å; V405-L562 HydrophobicContact CG1-CD1 3.51Å; A438-L562 HydrophobicContact CB-CD2 4.35Å; M439-L562 HydrophobicContact CE-CD2 4.19Å; L442-L562 HydrophobicContact CD1-CD2 3.75Å; Q544-L562 WeakPolarHBondContact CA-O 3.23Å; L545-L562 HydrophobicContact CB-CB 4.44Å; L545-L562 PolarHBondContact N-O 2.96Å; L545-L562 PolarHBondContact O-N 2.99Å; L562-L564 HydrophobicContact CD1-CD2 3.92Å; L562-L564 HydrophobicContact CD1-CG 4.37Å; L562-L564 HydrophobicContact CD2-CD1 4.33Å; L562-L564 HydrophobicContact CD2-CG 4.46Å; L562-L564 HydrophobicContact CG-CD2 4.24Å; L562-L564 HydrophobicContact CG-CG 4.17Å
563	N	97.7	Very high	89	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.011	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	124.7	179.6	-48.5	-98.4	0	0	0	109	V405 C406 I407 F543 V565 L625 S628	V405-N563 PolarHBondContact O-N 2.9Å; V405-N563 PolarHBondContact O-ND2 2.97Å; C406-N563 WeakPolarHBondContact CA-O 3.26Å; C406-N563 HydrophobicContact CB-CB 4.38Å; I407-N563 PolarHBondContact N-O 3.46Å; F543-N563 WeakPolarHBondContact O-CA 3.36Å; N563-V565 HydrophobicContact CB-CG2 4.4Å; N563-L625 HydrophobicContact CB-CD2 3.87Å; N563-S628 WeakPolarHBondContact ND2-CB 3.39Å; N563-S628 PolarHBondContact ND2-OG 3.4Å
564	L	97.7	Very high	87.8	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	116.1	178.8	-58.9	177.4	0	0	0	107.8	I407 M421 I435 A438 M439 F543 L562	I407-L564 HydrophobicContact CB-CD2 3.8Å; I407-L564 HydrophobicContact CD1-CD2 3.84Å; I407-L564 HydrophobicContact CG1-CD2 3.91Å; M421-L564 HydrophobicContact SD-CB 4.15Å; I435-L564 HydrophobicContact CB-CD1 4.09Å; I435-L564 HydrophobicContact CG1-CB 3.97Å; I435-L564 HydrophobicContact CG1-CD1 3.63Å; I435-L564 HydrophobicContact CG1-CG 4.44Å; I435-L564 HydrophobicContact CG2-CD1 4.27Å; A438-L564 HydrophobicContact CB-CD1 4.27Å; M439-L564 HydrophobicContact CE-CD1 4.31Å; F543-L564 HydrophobicContact CB-CB 4.42Å; F543-L564 HydrophobicContact CD1-CB 4.39Å; F543-L564 HydrophobicContact CD1-CD1 4.22Å; F543-L564 PolarHBondContact N-O 2.92Å; F543-L564 PolarHBondContact O-N 2.99Å; L562-L564 HydrophobicContact CD1-CD2 3.92Å; L562-L564 HydrophobicContact CD1-CG 4.37Å; L562-L564 HydrophobicContact CD2-CD1 4.33Å; L562-L564 HydrophobicContact CD2-CG 4.46Å; L562-L564 HydrophobicContact CG-CD2 4.24Å; L562-L564 HydrophobicContact CG-CG 4.17Å
565	V	97.1	Very high	86.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	105	-160.3	-174	0	0	0	0	111.7	I407 F408 A409 S541 V542 N563 L567 L621 L625	I407-V565 PolarHBondContact O-N 3.03Å; F408-V565 CarbonylContact C-O 3.54Å; F408-V565 WeakPolarHBondContact CA-O 3.44Å; F408-V565 HydrophobicContact CD1-CB 3.72Å; F408-V565 HydrophobicContact CD1-CG1 3.79Å; F408-V565 HydrophobicContact CD1-CG2 4.22Å; F408-V565 HydrophobicContact CE1-CB 4.09Å; F408-V565 HydrophobicContact CE1-CG1 4.03Å; F408-V565 HydrophobicContact CE1-CG2 4.13Å; A409-V565 PolarHBondContact N-O 3.4Å; S541-V565 WeakPolarHBondContact O-CA 3.47Å; V542-V565 HydrophobicContact CG1-CG2 4.33Å; V542-V565 HydrophobicContact CG2-CG1 4.09Å; V542-V565 HydrophobicContact CG2-CG2 4.28Å; N563-V565 HydrophobicContact CB-CG2 4.4Å; V565-L567 HydrophobicContact CG1-CD2 3.59Å; V565-L567 HydrophobicContact CG1-CG 4.11Å; V565-L567 PolarHBondContact O-N 2.88Å; V565-L621 HydrophobicContact CG1-CD1 4.31Å; V565-L625 HydrophobicContact CG2-CD1 4.08Å; V565-L625 HydrophobicContact CG2-CD2 4.34Å
566	D	95.6	Very high	84.5	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	103.2	168	-173.6	26.8	0	0	0	108.6	K417 T418 M421 H540 S541	K417-D566 WeakPolarHBondContact CB-OD1 3.39Å; T418-D566 WeakPolarHBondContact CA-OD2 3.35Å; T418-D566 VanDerWaalsContact CB-OD2 3.32Å; T418-D566 WeakPolarHBondContact CB-OD2 3.42Å; T418-D566 WeakPolarHBondContact CG2-OD2 3.39Å; T418-D566 PolarHBondContact N-OD1 2.93Å; T418-D566 PolarHBondContact OG1-OD2 2.82Å; M421-D566 HydrophobicContact CB-CB 4.32Å; M421-D566 HydrophobicContact CG-CB 4.16Å; H540-D566 CarbonylContact C-O 3.55Å; H540-D566 WeakPolarHBondContact CA-O 3.24Å; S541-D566 PolarHBondContact N-O 3.48Å; S541-D566 PolarHBondContact O-N 3.02Å; S541-D566 PolarHBondContact OG-O 2.7Å
567	L	94.1	Very high	83	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.016	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-75.1	160.2	-178.6	-61.9	171.2	0	0	0	111.2	F408 A409 Y410 K417 H540 V565 L597 L600 L621	F408-L567 HydrophobicContact CB-CD1 4.23Å; F408-L567 HydrophobicContact CD1-CD1 4Å; F408-L567 HydrophobicContact CD1-CD2 4.08Å; F408-L567 HydrophobicContact CD1-CG 4.17Å; F408-L567 HydrophobicContact CG-CD1 4.47Å; A409-L567 VanDerWaalsContact O-CB 3.24Å; A409-L567 WeakPolarHBondContact O-CB 3.37Å; A409-L567 WeakPolarHBondContact O-CG 3.47Å; A409-L567 PolarHBondContact O-N 3.37Å; A409-L567 VanDerWaalsContact O-N 3.15Å; Y410-L567 HydrophobicContact CD2-CD1 3.94Å; Y410-L567 HydrophobicContact CG-CD1 4.46Å; K417-L567 WeakPolarHBondContact CE-O 3.48Å; H540-L567 HydrophobicContact CB-CD2 4.49Å; H540-L567 WeakPolarHBondContact ND1-CA 3.29Å; H540-L567 WeakPolarHBondContact ND1-CD2 3.37Å; V565-L567 HydrophobicContact CG1-CD2 3.59Å; V565-L567 HydrophobicContact CG1-CG 4.11Å; V565-L567 PolarHBondContact O-N 2.88Å; L567-L597 HydrophobicContact CB-CD2 4.16Å; L567-L597 HydrophobicContact CD1-CD2 4.02Å; L567-L597 HydrophobicContact CD2-CD2 4.4Å; L567-L597 HydrophobicContact CG-CD2 4.44Å; L567-L600 HydrophobicContact CD1-CD2 4.02Å; L567-L600 HydrophobicContact CD2-CD2 4.37Å; L567-L621 HydrophobicContact CD2-CD1 4.36Å; L567-L621 HydrophobicContact CD2-CD2 3.61Å
568	A	90.7	Very high	80.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-62.9	163.7	168.4	0	0	0	0	0	112.1	H540 S570 I593	H540-A568 PolarHBondContact ND1-N 3.32Å; A568-S570 PolarHBondContact O-N 3.42Å; A568-I593 HydrophobicContact CB-CG2 3.55Å
569	G	87.6	Confident	79.4	Confident	3 Å²	3	49.6 Å²	49.6	3%	0.031	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-57	132.8	172.4	0	0	0	0	0	112.8	S537 E571	S537-G569 PolarHBondContact O-N 2.92Å; G569-E571 VanDerWaalsContact C-N 3.29Å; G569-E571 WeakPolarHBondContact CA-OE2 3.38Å
570	S	85.9	Confident	78.3	Confident	5 Å²	5	49.1 Å²	49.1	4%	0.035	27%	0.269	C	S	.	.			trans	-84.4	1.9	178.1	64.6	0	0	0	0	114.4	Y410 G411 Q412 A568 S654	Y410-S570 WeakPolarHBondContact OH-CB 3.39Å; G411-S570 WeakPolarHBondContact CA-OG 3.23Å; G411-S570 PolarHBondContact O-N 2.79Å; G411-S570 VanDerWaalsContact O-N 3.16Å; G411-S570 PolarHBondContact O-OG 3.1Å; Q412-S570 PolarHBondContact N-OG 3.1Å; A568-S570 PolarHBondContact O-N 3.42Å; S570-S654 PolarHBondContact OG-OG 3.25Å
571	E	81	Confident	76.7	Confident	56 Å²	56	54.1 Å²	54.1	26%	0.262	30%	0.301	S	S	.	.			trans	-64.4	151.5	-178.5	61.1	-88.7	-163.7	0	0	113.7	Q412 T413 G569 N594 E650	Q412-E571 VanDerWaalsContact CA-OE2 3.3Å; Q412-E571 WeakPolarHBondContact CA-OE2 3.46Å; T413-E571 WeakPolarHBondContact CB-OE1 3.47Å; T413-E571 PolarHBondContact N-OE2 3.37Å; T413-E571 PolarHBondContact OG1-OE1 3.18Å; T413-E571 PolarHBondContact OG1-OE2 2.93Å; G569-E571 VanDerWaalsContact C-N 3.29Å; G569-E571 WeakPolarHBondContact CA-OE2 3.38Å; E571-N594 PolarHBondContact O-ND2 3.06Å; E571-E650 WeakPolarHBondContact CA-OE1 3.04Å; E571-E650 HydrophobicContact CB-CG 4.37Å
572	R	72.8	Confident	75.1	Confident	176 Å²	176	55.4 Å²	55.4	66%	0.664	32%	0.318	S	S	*	.			trans	-105.9	137.7	-179.9	-59.8	-178.8	177.1	-131.4	-8.1	109.9	E650	R572-E650 PolarHBondContact N-OE1 3.15Å
573	L	68.6	Low	73.6	Confident	79 Å²	79	58.9 Å²	58.9	41%	0.414	34%	0.335	S	S	.	.			trans	-81.6	135.1	166.1	-73.7	176.5	0	0	0	109.4	P575 L587 T590	L573-P575 WeakPolarHBondContact O-CD 3.3Å; L573-L587 HydrophobicContact CB-CD1 4.33Å; L573-L587 HydrophobicContact CD1-CD1 4.44Å; L573-T590 HydrophobicContact CB-CG2 4.4Å; L573-T590 HydrophobicContact CD1-CG2 4.14Å; L573-T590 WeakPolarHBondContact CD1-OG1 3.11Å; L573-T590 HydrophobicContact CG-CG2 4Å
574	D	63.6	Low	72.3	Confident	131 Å²	131	66.6 Å²	66.6	70%	0.701	36%	0.364	S	S	*	.			trans	-65.5	120.6	172.8	-87.1	-47.7	0	0	0	111	G576 L577	D574-G576 PolarHBondContact O-N 3.41Å; D574-L577 PolarHBondContact O-N 3.3Å
575	P	52.4	Low	70.9	Confident	113 Å²	113	71.2 Å²	71.2	73%	0.734	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-4.9	-178.3	31.1	-36.1	0	0	0	113.6	L573	L573-P575 WeakPolarHBondContact O-CD 3.3Å
576	G	51.2	Low	69.6	Low	57 Å²	57	76.2 Å²	76.2	59%	0.588	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-13.9	178.1	0	0	0	0	0	115	D574 H578	D574-G576 PolarHBondContact O-N 3.41Å; G576-H578 PolarHBondContact O-N 3.47Å; G576-H578 PolarHBondContact O-ND1 2.94Å; G576-H578 VanDerWaalsContact O-ND1 3.14Å
577	L	57.4	Low	68.5	Low	113 Å²	113	78 Å²	78	59%	0.592	42%	0.416	S	S	*	.	S	Bend	trans	-62.5	134.4	175.8	-129.9	73.1	0	0	0	109.7	D574 L579	D574-L577 PolarHBondContact O-N 3.3Å; L577-L579 HydrophobicContact CB-CD2 4.05Å; L577-L579 WeakPolarHBondContact O-CD2 3.5Å; L577-L579 WeakPolarHBondContact O-CG 3.19Å; L577-L579 PolarHBondContact O-N 2.91Å
578	H	46.3	Very low	67.5	Low	184 Å²	184	85.9 Å²	85.9	85%	0.852	45%	0.446	S	S	*	.			trans	-79	87	-173.5	-74.1	21.9	0	0	0	111.5	G576 G580	G576-H578 PolarHBondContact O-N 3.47Å; G576-H578 PolarHBondContact O-ND1 2.94Å; G576-H578 VanDerWaalsContact O-ND1 3.14Å; H578-G580 PolarHBondContact O-N 3.48Å
579	L	57.6	Low	66.6	Low	47 Å²	47	86.6 Å²	86.6	25%	0.246	45%	0.45	C	S	.	.			trans	-72.2	115.3	-167.2	-50	-178.9	0	0	0	114.7	L577 E583 R584 L587	L577-L579 HydrophobicContact CB-CD2 4.05Å; L577-L579 WeakPolarHBondContact O-CD2 3.5Å; L577-L579 WeakPolarHBondContact O-CG 3.19Å; L577-L579 PolarHBondContact O-N 2.91Å; L579-E583 HydrophobicContact CB-CB 3.91Å; L579-E583 HydrophobicContact CD2-CB 3.87Å; L579-E583 HydrophobicContact CG-CB 4.41Å; L579-R584 HydrophobicContact CB-CG 4.09Å; L579-L587 HydrophobicContact CD1-CB 3.87Å; L579-L587 HydrophobicContact CD1-CD1 4.39Å; L579-L587 HydrophobicContact CD1-CD2 3.71Å; L579-L587 HydrophobicContact CD1-CG 4.19Å
580	G	63.1	Low	66	Low	27 Å²	27	87.3 Å²	87.3	28%	0.278	45%	0.453	S	S	.	.			trans	-69	176.7	160.6	0	0	0	0	0	113	H578 G582 E583 R584	H578-G580 PolarHBondContact O-N 3.48Å; G580-G582 PolarHBondContact O-N 2.97Å; G580-E583 PolarHBondContact N-OE2 3.28Å; G580-E583 WeakPolarHBondContact O-CB 3.49Å; G580-E583 PolarHBondContact O-N 3.07Å; G580-R584 PolarHBondContact O-N 3.16Å
581	P	59.9	Low	65.4	Low	112 Å²	112	92.4 Å²	92.4	73%	0.727	48%	0.477	S	S	*	.	H	α-helix	trans	-54.5	-53.5	-171.7	-28.1	35.9	0	0	0	114.4	E583 R584	P581-E583 PolarHBondContact O-N 3.35Å; P581-R584 WeakPolarHBondContact O-CB 3.3Å; P581-R584 PolarHBondContact O-N 2.82Å; P581-R584 VanDerWaalsContact O-N 3.17Å
582	G	61.3	Low	65.1	Low	49 Å²	49	90.8 Å²	90.8	51%	0.505	47%	0.473	S	S	.	.	H	α-helix	trans	-69.9	-9.8	179.4	0	0	0	0	0	114.8	G580	G580-G582 PolarHBondContact O-N 2.97Å
583	E	65.3	Low	65.3	Low	74 Å²	74	83 Å²	83	35%	0.346	44%	0.444	S	S	.	.	H	α-helix	trans	-90.3	-24.7	175.2	-60	177.3	121.1	0	0	111.6	L579 G580 P581 D585 R586 L587	L579-E583 HydrophobicContact CB-CB 3.91Å; L579-E583 HydrophobicContact CD2-CB 3.87Å; L579-E583 HydrophobicContact CG-CB 4.41Å; G580-E583 PolarHBondContact N-OE2 3.28Å; G580-E583 WeakPolarHBondContact O-CB 3.49Å; G580-E583 PolarHBondContact O-N 3.07Å; P581-E583 PolarHBondContact O-N 3.35Å; E583-D585 VanDerWaalsContact C-N 3.35Å; E583-R586 PolarHBondContact O-N 3.46Å; E583-L587 PolarHBondContact O-N 2.78Å
584	R	69.3	Low	65.8	Low	163 Å²	163	80.6 Å²	80.6	62%	0.615	43%	0.432	S	S	*	.	H	α-helix	trans	-66.1	-37.4	168.9	-63.5	178.2	180	-160.6	-3.3	112	L579 G580 P581 L587 R588	L579-R584 HydrophobicContact CB-CG 4.09Å; G580-R584 PolarHBondContact O-N 3.16Å; P581-R584 WeakPolarHBondContact O-CB 3.3Å; P581-R584 PolarHBondContact O-N 2.82Å; P581-R584 VanDerWaalsContact O-N 3.17Å; R584-L587 PolarHBondContact O-N 2.56Å; R584-R588 WeakPolarHBondContact O-CG 3.34Å; R584-R588 PolarHBondContact O-N 2.84Å
585	D	69.2	Low	66.9	Low	99 Å²	99	77.4 Å²	77.4	53%	0.529	42%	0.419	S	S	.	.	H	α-helix	trans	-68.7	-39.4	174.9	-68.3	-33.8	0	0	0	111.4	E583 L587 R588 E589	E583-D585 VanDerWaalsContact C-N 3.35Å; D585-L587 VanDerWaalsContact C-N 3.33Å; D585-L587 PolarHBondContact O-N 2.95Å; D585-R588 PolarHBondContact O-N 2.88Å; D585-E589 WeakPolarHBondContact O-CB 3.43Å; D585-E589 PolarHBondContact O-N 3.23Å
586	R	69.5	Low	68.5	Low	105 Å²	105	72.1 Å²	72.1	40%	0.396	39%	0.385	S	S	.	.	H	α-helix	trans	-62.1	-36.6	170.2	-74.3	174.2	166.1	170.4	-0.1	112.8	N533 E583 E589 T590	N533-R586 PolarHBondContact OD1-NH2 2.87Å; E583-R586 PolarHBondContact O-N 3.46Å; R586-E589 WeakPolarHBondContact O-CB 3.41Å; R586-T590 PolarHBondContact O-N 2.76Å; R586-T590 PolarHBondContact O-OG1 3.06Å
587	L	71.4	Confident	70.3	Confident	41 Å²	41	69.6 Å²	69.6	22%	0.215	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-45.4	173.9	-173	75.6	0	0	0	111.1	L573 L579 E583 R584 D585 T590 Q591	L573-L587 HydrophobicContact CB-CD1 4.33Å; L573-L587 HydrophobicContact CD1-CD1 4.44Å; L579-L587 HydrophobicContact CD1-CB 3.87Å; L579-L587 HydrophobicContact CD1-CD1 4.39Å; L579-L587 HydrophobicContact CD1-CD2 3.71Å; L579-L587 HydrophobicContact CD1-CG 4.19Å; E583-L587 PolarHBondContact O-N 2.78Å; R584-L587 PolarHBondContact O-N 2.56Å; D585-L587 VanDerWaalsContact C-N 3.33Å; D585-L587 PolarHBondContact O-N 2.95Å; L587-T590 PolarHBondContact O-N 3.02Å; L587-Q591 WeakPolarHBondContact O-CB 3.47Å; L587-Q591 VanDerWaalsContact O-CG 3.27Å; L587-Q591 WeakPolarHBondContact O-CG 3.43Å; L587-Q591 PolarHBondContact O-N 3.49Å
588	R	73.8	Confident	71.7	Confident	170 Å²	170	67.3 Å²	67.3	64%	0.642	35%	0.352	S	S	*	.	H	α-helix	trans	-61.4	-42.7	175.9	-74.8	174	166.3	-169.4	-5.8	112.3	R584 D585 Q591 A592	R584-R588 WeakPolarHBondContact O-CG 3.34Å; R584-R588 PolarHBondContact O-N 2.84Å; D585-R588 PolarHBondContact O-N 2.88Å; R588-Q591 PolarHBondContact O-N 3.4Å; R588-A592 PolarHBondContact O-N 2.89Å
589	E	71.6	Confident	73.9	Confident	15 Å²	15	59 Å²	59	7%	0.07	31%	0.314	C	S	.	.	H	α-helix	trans	-56.3	-52.8	174.1	-175.9	-169.3	166.4	0	0	110.9	Y466 R538 D585 R586 Q591 A592 I593	Y466-E589 HydrophobicContact CE2-CG 4.32Å; Y466-E589 PolarHBondContact OH-OE1 3.01Å; R538-E589 WeakPolarHBondContact CD-OE1 3.49Å; R538-E589 IonicContact CZ-OE1 2.8Å; R538-E589 IonicContact CZ-OE2 3.3Å; R538-E589 IonicContact NE-OE1 2.66Å; R538-E589 IonicContact NH1-OE1 3.54Å; R538-E589 PolarHBondContact NH1-OE1 3.16Å; R538-E589 IonicContact NH1-OE2 3.5Å; R538-E589 PolarHBondContact NH1-OE2 3.42Å; D585-E589 WeakPolarHBondContact O-CB 3.43Å; D585-E589 PolarHBondContact O-N 3.23Å; R586-E589 WeakPolarHBondContact O-CB 3.41Å; E589-Q591 VanDerWaalsContact C-N 3.34Å; E589-Q591 PolarHBondContact O-N 2.8Å; E589-A592 PolarHBondContact O-N 3.47Å; E589-I593 HydrophobicContact CG-CD1 4.17Å; E589-I593 WeakPolarHBondContact O-CD1 3.48Å; E589-I593 VanDerWaalsContact O-CG1 3.28Å; E589-I593 WeakPolarHBondContact O-CG1 3.23Å; E589-I593 PolarHBondContact O-N 2.89Å
590	T	74.3	Confident	75.6	Confident	17 Å²	17	56.9 Å²	56.9	10%	0.104	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-33.6	176.1	-68.2	0	0	0	0	113.1	L573 R586 L587 N594	L573-T590 HydrophobicContact CB-CG2 4.4Å; L573-T590 HydrophobicContact CD1-CG2 4.14Å; L573-T590 WeakPolarHBondContact CD1-OG1 3.11Å; L573-T590 HydrophobicContact CG-CG2 4Å; R586-T590 PolarHBondContact O-N 2.76Å; R586-T590 PolarHBondContact O-OG1 3.06Å; L587-T590 PolarHBondContact O-N 3.02Å; T590-N594 WeakPolarHBondContact CG2-ND2 3.25Å; T590-N594 WeakPolarHBondContact O-CB 3.25Å; T590-N594 PolarHBondContact O-N 3.45Å; T590-N594 PolarHBondContact O-ND2 2.81Å
591	Q	74.8	Confident	76.9	Confident	113 Å²	113	55.9 Å²	55.9	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-42.6	174.2	-76.9	172.2	-6.2	0	0	111.8	L587 R588 E589 S595	L587-Q591 WeakPolarHBondContact O-CB 3.47Å; L587-Q591 VanDerWaalsContact O-CG 3.27Å; L587-Q591 WeakPolarHBondContact O-CG 3.43Å; L587-Q591 PolarHBondContact O-N 3.49Å; R588-Q591 PolarHBondContact O-N 3.4Å; E589-Q591 VanDerWaalsContact C-N 3.34Å; E589-Q591 PolarHBondContact O-N 2.8Å; Q591-S595 VanDerWaalsContact O-CB 3.23Å; Q591-S595 WeakPolarHBondContact O-CB 3.13Å; Q591-S595 PolarHBondContact O-N 3.34Å
592	A	73.9	Confident	78.3	Confident	22 Å²	22	55.3 Å²	55.3	18%	0.182	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-44.1	175.7	0	0	0	0	0	111.8	N467 R588 E589 S595 S596	N467-A592 VanDerWaalsContact OD1-CB 3.28Å; N467-A592 WeakPolarHBondContact OD1-CB 3.24Å; R588-A592 PolarHBondContact O-N 2.89Å; E589-A592 PolarHBondContact O-N 3.47Å; A592-S595 WeakPolarHBondContact O-CB 3.37Å; A592-S595 PolarHBondContact O-N 2.83Å; A592-S596 PolarHBondContact O-N 3.16Å; A592-S596 VanDerWaalsContact O-N 3.15Å
593	I	76.4	Confident	79.9	Confident	11 Å²	11	53 Å²	53	6%	0.056	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-53.9	175.7	-67.2	160.1	0	0	0	110.5	R538 A568 E589 S595 S596 L597	R538-I593 HydrophobicContact CB-CD1 3.66Å; R538-I593 HydrophobicContact CG-CD1 4.09Å; R538-I593 VanDerWaalsContact O-CD1 3.3Å; R538-I593 WeakPolarHBondContact O-CD1 3.47Å; A568-I593 HydrophobicContact CB-CG2 3.55Å; E589-I593 HydrophobicContact CG-CD1 4.17Å; E589-I593 WeakPolarHBondContact O-CD1 3.48Å; E589-I593 VanDerWaalsContact O-CG1 3.28Å; E589-I593 WeakPolarHBondContact O-CG1 3.23Å; E589-I593 PolarHBondContact O-N 2.89Å; I593-S595 VanDerWaalsContact C-N 3.28Å; I593-S595 PolarHBondContact O-N 2.95Å; I593-S596 PolarHBondContact O-N 2.82Å; I593-S596 PolarHBondContact O-OG 3.16Å; I593-L597 HydrophobicContact CG2-CD1 4.48Å; I593-L597 PolarHBondContact O-N 3.37Å
594	N	80	Confident	81	Confident	30 Å²	30	49.5 Å²	49.5	16%	0.16	24%	0.243	C	C	.	.	H	α-helix	trans	-68.8	-23.6	-179.8	-81.4	-55	0	0	0	113.5	E571 T590 S598	E571-N594 PolarHBondContact O-ND2 3.06Å; T590-N594 WeakPolarHBondContact CG2-ND2 3.25Å; T590-N594 WeakPolarHBondContact O-CB 3.25Å; T590-N594 PolarHBondContact O-N 3.45Å; T590-N594 PolarHBondContact O-ND2 2.81Å; N594-S598 VanDerWaalsContact O-CB 3.3Å; N594-S598 WeakPolarHBondContact O-CB 3.37Å; N594-S598 PolarHBondContact O-N 2.92Å; N594-S598 PolarHBondContact O-OG 2.75Å
595	S	85.6	Confident	81.9	Confident	63 Å²	63	45.7 Å²	45.7	44%	0.441	23%	0.233	S	C	.	.	H	α-helix	trans	-64.3	-47	171.2	-175.8	0	0	0	0	111.8	Q591 A592 I593 L597 S598 T599	Q591-S595 VanDerWaalsContact O-CB 3.23Å; Q591-S595 WeakPolarHBondContact O-CB 3.13Å; Q591-S595 PolarHBondContact O-N 3.34Å; A592-S595 WeakPolarHBondContact O-CB 3.37Å; A592-S595 PolarHBondContact O-N 2.83Å; I593-S595 VanDerWaalsContact C-N 3.28Å; I593-S595 PolarHBondContact O-N 2.95Å; S595-L597 PolarHBondContact O-N 3.11Å; S595-S598 PolarHBondContact O-N 3.38Å; S595-T599 WeakPolarHBondContact O-CB 3.49Å; S595-T599 PolarHBondContact O-N 3.43Å; S595-T599 PolarHBondContact O-OG1 2.78Å
596	S	87.8	Confident	82.9	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-40.5	176.7	64.9	0	0	0	0	113	H540 A592 I593 T599 L600 S619	H540-S596 PolarHBondContact NE2-OG 3.24Å; A592-S596 PolarHBondContact O-N 3.16Å; A592-S596 VanDerWaalsContact O-N 3.15Å; I593-S596 PolarHBondContact O-N 2.82Å; I593-S596 PolarHBondContact O-OG 3.16Å; S596-T599 PolarHBondContact O-N 2.96Å; S596-L600 PolarHBondContact O-N 3.47Å; S596-S619 VanDerWaalsContact CB-OG 3.22Å; S596-S619 WeakPolarHBondContact CB-OG 3.37Å
597	L	87.3	Confident	83.8	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-65.5	-41.7	174	-68.6	174.1	0	0	0	112.2	Y410 L567 I593 S595 T599 L600 G601	Y410-L597 HydrophobicContact CD2-CD2 4.16Å; Y410-L597 HydrophobicContact CE2-CD1 4.3Å; Y410-L597 HydrophobicContact CE2-CD2 4.07Å; L567-L597 HydrophobicContact CB-CD2 4.16Å; L567-L597 HydrophobicContact CD1-CD2 4.02Å; L567-L597 HydrophobicContact CD2-CD2 4.4Å; L567-L597 HydrophobicContact CG-CD2 4.44Å; I593-L597 HydrophobicContact CG2-CD1 4.48Å; I593-L597 PolarHBondContact O-N 3.37Å; S595-L597 PolarHBondContact O-N 3.11Å; L597-T599 VanDerWaalsContact C-N 3.3Å; L597-T599 PolarHBondContact O-N 2.88Å; L597-L600 PolarHBondContact O-N 3.22Å; L597-G601 PolarHBondContact O-N 2.79Å; L597-G601 VanDerWaalsContact O-N 3.14Å
598	S	88.3	Confident	84.3	Confident	65 Å²	65	36.2 Å²	36.2	46%	0.455	19%	0.192	S	C	.	.	H	α-helix	trans	-64.6	-37.4	176	-58.5	0	0	0	0	111.4	N594 S595 G601 L602	N594-S598 VanDerWaalsContact O-CB 3.3Å; N594-S598 WeakPolarHBondContact O-CB 3.37Å; N594-S598 PolarHBondContact O-N 2.92Å; N594-S598 PolarHBondContact O-OG 2.75Å; S595-S598 PolarHBondContact O-N 3.38Å; S598-G601 PolarHBondContact O-N 3.38Å; S598-L602 WeakPolarHBondContact O-CG 3.29Å; S598-L602 PolarHBondContact O-N 2.94Å
599	T	92.3	Very high	84.8	Confident	10 Å²	10	32.9 Å²	32.9	6%	0.061	19%	0.187	C	C	.	.	H	α-helix	trans	-67.2	-40.3	176.9	-61.4	0	0	0	0	111.6	S595 S596 L597 G601 L602 V603 N618 T622	S595-T599 WeakPolarHBondContact O-CB 3.49Å; S595-T599 PolarHBondContact O-N 3.43Å; S595-T599 PolarHBondContact O-OG1 2.78Å; S596-T599 PolarHBondContact O-N 2.96Å; L597-T599 VanDerWaalsContact C-N 3.3Å; L597-T599 PolarHBondContact O-N 2.88Å; T599-G601 VanDerWaalsContact C-N 3.32Å; T599-G601 PolarHBondContact O-N 3.17Å; T599-L602 PolarHBondContact O-N 3.49Å; T599-V603 HydrophobicContact CG2-CG2 4.46Å; T599-V603 WeakPolarHBondContact O-CB 3.39Å; T599-V603 WeakPolarHBondContact O-CG2 3.13Å; T599-V603 PolarHBondContact O-N 3.38Å; T599-N618 HydrophobicContact CG2-CB 3.56Å; T599-T622 HydrophobicContact CG2-CG2 4.09Å
600	L	92.1	Very high	85.4	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-58.4	-44.8	172	-179.9	60.6	0	0	0	111.3	F408 L567 S596 L597 L602 V603 I604 L621 T622 L629	F408-L600 HydrophobicContact CD1-CD2 4.16Å; F408-L600 HydrophobicContact CE1-CD1 4.32Å; F408-L600 HydrophobicContact CE1-CD2 3.93Å; F408-L600 HydrophobicContact CZ-CD1 4.03Å; F408-L600 HydrophobicContact CZ-CD2 4.34Å; L567-L600 HydrophobicContact CD1-CD2 4.02Å; L567-L600 HydrophobicContact CD2-CD2 4.37Å; S596-L600 PolarHBondContact O-N 3.47Å; L597-L600 PolarHBondContact O-N 3.22Å; L600-L602 PolarHBondContact O-N 3.46Å; L600-V603 PolarHBondContact O-N 3.14Å; L600-I604 HydrophobicContact CD1-CD1 3.98Å; L600-I604 HydrophobicContact CD1-CG1 4.34Å; L600-I604 HydrophobicContact CG-CD1 3.94Å; L600-I604 VanDerWaalsContact O-CG1 3.27Å; L600-I604 WeakPolarHBondContact O-CG1 3.4Å; L600-I604 PolarHBondContact O-N 3.46Å; L600-L621 HydrophobicContact CD2-CD2 4.38Å; L600-T622 HydrophobicContact CB-CG2 4.02Å; L600-T622 HydrophobicContact CD1-CG2 4.02Å; L600-L629 HydrophobicContact CD1-CD2 3.97Å
601	G	90.1	Very high	86.1	Confident	6 Å²	6	43.2 Å²	43.2	6%	0.062	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-46.2	173.1	0	0	0	0	0	113.6	L597 S598 T599 I604 M605	L597-G601 PolarHBondContact O-N 2.79Å; L597-G601 VanDerWaalsContact O-N 3.14Å; S598-G601 PolarHBondContact O-N 3.38Å; T599-G601 VanDerWaalsContact C-N 3.32Å; T599-G601 PolarHBondContact O-N 3.17Å; G601-I604 PolarHBondContact O-N 2.74Å; G601-M605 WeakPolarHBondContact O-CG 3.4Å; G601-M605 PolarHBondContact O-N 2.8Å
602	L	91.1	Very high	86.6	Confident	99 Å²	99	44.3 Å²	44.3	52%	0.518	25%	0.252	S	S	.	.	H	α-helix	trans	-63.1	-40.9	177.2	-70.2	172.3	0	0	0	112.4	S598 T599 L600 M605 A606	S598-L602 WeakPolarHBondContact O-CG 3.29Å; S598-L602 PolarHBondContact O-N 2.94Å; T599-L602 PolarHBondContact O-N 3.49Å; L600-L602 PolarHBondContact O-N 3.46Å; L602-M605 PolarHBondContact O-N 2.9Å; L602-A606 VanDerWaalsContact O-CB 3.26Å; L602-A606 WeakPolarHBondContact O-CB 3.45Å; L602-A606 PolarHBondContact O-N 2.82Å
603	V	93.1	Very high	87.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-42.7	177.3	163.4	0	0	0	0	111.5	T599 L600 L607 V614 P615 Y616 T622 L629	T599-V603 HydrophobicContact CG2-CG2 4.46Å; T599-V603 WeakPolarHBondContact O-CB 3.39Å; T599-V603 WeakPolarHBondContact O-CG2 3.13Å; T599-V603 PolarHBondContact O-N 3.38Å; L600-V603 PolarHBondContact O-N 3.14Å; V603-L607 HydrophobicContact CG1-CD1 4.08Å; V603-L607 WeakPolarHBondContact O-CB 3.18Å; V603-L607 WeakPolarHBondContact O-CG 3.09Å; V603-L607 PolarHBondContact O-N 3.02Å; V603-V614 HydrophobicContact CB-CG1 4.16Å; V603-V614 HydrophobicContact CG1-CG1 3.72Å; V603-V614 HydrophobicContact CG2-CG1 4.1Å; V603-P615 HydrophobicContact CG2-CG 4.01Å; V603-Y616 HydrophobicContact CG1-CD1 3.7Å; V603-Y616 HydrophobicContact CG1-CE1 3.57Å; V603-Y616 HydrophobicContact CG2-CD1 4.4Å; V603-T622 HydrophobicContact CB-CG2 4.17Å; V603-T622 HydrophobicContact CG1-CG2 4.5Å; V603-T622 HydrophobicContact CG2-CG2 3.94Å; V603-L629 HydrophobicContact CG1-CD1 3.89Å
604	I	90.1	Very high	88.2	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-45.9	176.2	-70.2	167.6	0	0	0	111.3	I312 L600 G601 L607 S608 M635 V661 C664	I312-I604 HydrophobicContact CD1-CG2 3.89Å; L600-I604 HydrophobicContact CD1-CD1 3.98Å; L600-I604 HydrophobicContact CD1-CG1 4.34Å; L600-I604 HydrophobicContact CG-CD1 3.94Å; L600-I604 VanDerWaalsContact O-CG1 3.27Å; L600-I604 WeakPolarHBondContact O-CG1 3.4Å; L600-I604 PolarHBondContact O-N 3.46Å; G601-I604 PolarHBondContact O-N 2.74Å; I604-L607 PolarHBondContact O-N 3.18Å; I604-S608 PolarHBondContact O-N 3.3Å; I604-M635 HydrophobicContact CD1-SD 3.81Å; I604-M635 HydrophobicContact CG1-CE 4.07Å; I604-M635 HydrophobicContact CG1-SD 3.87Å; I604-V661 HydrophobicContact CD1-CG2 4.37Å; I604-V661 HydrophobicContact CG2-CG1 4.05Å; I604-V661 HydrophobicContact CG2-CG2 4.18Å; I604-C664 HydrophobicContact CG2-CB 4.24Å
605	M	87.6	Confident	88.9	Confident	82 Å²	82	50 Å²	50	40%	0.404	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-45.4	177.7	-72	-175.5	67.7	0	0	111.9	G601 L602 L607 S608 N609	G601-M605 WeakPolarHBondContact O-CG 3.4Å; G601-M605 PolarHBondContact O-N 2.8Å; L602-M605 PolarHBondContact O-N 2.9Å; M605-L607 VanDerWaalsContact C-N 3.3Å; M605-L607 PolarHBondContact O-N 3.18Å; M605-S608 PolarHBondContact O-N 2.8Å; M605-S608 VanDerWaalsContact O-N 3.15Å; M605-N609 WeakPolarHBondContact O-CB 3.44Å; M605-N609 PolarHBondContact O-N 2.76Å; M605-N609 PolarHBondContact O-ND2 2.75Å
606	A	89.9	Confident	89.2	Confident	3 Å²	3	48.8 Å²	48.8	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-38.3	177.9	0	0	0	0	0	112.4	L602 K610 E611 V614	L602-A606 VanDerWaalsContact O-CB 3.26Å; L602-A606 WeakPolarHBondContact O-CB 3.45Å; L602-A606 PolarHBondContact O-N 2.82Å; A606-K610 PolarHBondContact O-N 3.33Å; A606-K610 VanDerWaalsContact O-N 3.1Å; A606-E611 HydrophobicContact CB-CB 4.14Å; A606-E611 HydrophobicContact CB-CG 4.45Å; A606-E611 PolarHBondContact O-N 3.47Å; A606-V614 HydrophobicContact CB-CG1 4.38Å; A606-V614 HydrophobicContact CB-CG2 4.13Å
607	L	87.8	Confident	89.5	Confident	23 Å²	23	57.7 Å²	57.7	12%	0.12	30%	0.296	C	S	.	.	H	α-helix	trans	-63.4	-44	172.7	-85.1	164.7	0	0	0	112.8	V603 I604 M605 K610 V614 Y616 L629 I666	V603-L607 HydrophobicContact CG1-CD1 4.08Å; V603-L607 WeakPolarHBondContact O-CB 3.18Å; V603-L607 WeakPolarHBondContact O-CG 3.09Å; V603-L607 PolarHBondContact O-N 3.02Å; I604-L607 PolarHBondContact O-N 3.18Å; M605-L607 VanDerWaalsContact C-N 3.3Å; M605-L607 PolarHBondContact O-N 3.18Å; L607-K610 PolarHBondContact O-N 2.89Å; L607-V614 HydrophobicContact CD2-CG2 4.32Å; L607-V614 HydrophobicContact CG-CG1 4.18Å; L607-V614 HydrophobicContact CG-CG2 4.19Å; L607-Y616 HydrophobicContact CD1-CE1 4.4Å; L607-L629 HydrophobicContact CD1-CB 4.04Å; L607-L629 WeakPolarHBondContact CD1-O 3.36Å; L607-I666 HydrophobicContact CB-CD1 3.78Å; L607-I666 HydrophobicContact CB-CG1 4.3Å; L607-I666 HydrophobicContact CD1-CD1 4.47Å
608	S	83.4	Confident	89.7	Confident	21 Å²	21	62.5 Å²	62.5	15%	0.147	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-41.4	176.6	-169.3	0	0	0	0	112.7	I604 M605 K610 C664 V665	I604-S608 PolarHBondContact O-N 3.3Å; M605-S608 PolarHBondContact O-N 2.8Å; M605-S608 VanDerWaalsContact O-N 3.15Å; S608-K610 PolarHBondContact O-N 2.88Å; S608-C664 VanDerWaalsContact OG-C 3.24Å; S608-C664 WeakPolarHBondContact OG-CA 3.46Å; S608-V665 PolarHBondContact OG-N 2.81Å; S608-V665 VanDerWaalsContact OG-N 3.11Å
609	N	84	Confident	90	Very high	99 Å²	99	59.5 Å²	59.5	53%	0.529	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-10.3	176	-68.1	-15.7	0	0	0	112.7	M605 E611	M605-N609 WeakPolarHBondContact O-CB 3.44Å; M605-N609 PolarHBondContact O-N 2.76Å; M605-N609 PolarHBondContact O-ND2 2.75Å; N609-E611 HydrophobicContact CB-CG 3.81Å; N609-E611 WeakPolarHBondContact CB-OE1 3.04Å; N609-E611 PolarHBondContact ND2-OE1 2.87Å; N609-E611 PolarHBondContact O-N 2.79Å
610	K	84.1	Confident	90.1	Very high	155 Å²	155	62.8 Å²	62.8	67%	0.674	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	38.6	-173.5	-56.7	172	-174.7	170.5	0	112.1	A606 L607 S608	A606-K610 PolarHBondContact O-N 3.33Å; A606-K610 VanDerWaalsContact O-N 3.1Å; L607-K610 PolarHBondContact O-N 2.89Å; S608-K610 PolarHBondContact O-N 2.88Å
611	E	87.8	Confident	90.2	Very high	94 Å²	94	62.7 Å²	62.7	44%	0.439	31%	0.313	S	S	.	.			trans	-63.4	139.7	177.7	-74.1	168.9	-140.5	0	0	111.2	A606 N609 H613	A606-E611 HydrophobicContact CB-CB 4.14Å; A606-E611 HydrophobicContact CB-CG 4.45Å; A606-E611 PolarHBondContact O-N 3.47Å; N609-E611 HydrophobicContact CB-CG 3.81Å; N609-E611 WeakPolarHBondContact CB-OE1 3.04Å; N609-E611 PolarHBondContact ND2-OE1 2.87Å; N609-E611 PolarHBondContact O-N 2.79Å; E611-H613 PolarHBondContact O-N 3.01Å
612	S	86.9	Confident	90.4	Very high	137 Å²	137	62.4 Å²	62.4	96%	0.958	31%	0.311	S	S	*	.	S	Bend	trans	-69.2	-16.9	-175.6	55.9	0	0	0	0	114.3
613	H	91.4	Very high	90.5	Very high	136 Å²	136	59.8 Å²	59.8	63%	0.63	29%	0.294	S	S	*	.			trans	-132.7	105.5	176.3	172	-80.5	0	0	0	110.3	E611	E611-H613 PolarHBondContact O-N 3.01Å
614	V	92.3	Very high	90.6	Very high	24 Å²	24	60.2 Å²	60.2	15%	0.145	30%	0.296	C	S	.	.			trans	-94.2	125.3	175.9	179.1	0	0	0	0	109.6	V603 A606 L607 Y616	V603-V614 HydrophobicContact CB-CG1 4.16Å; V603-V614 HydrophobicContact CG1-CG1 3.72Å; V603-V614 HydrophobicContact CG2-CG1 4.1Å; A606-V614 HydrophobicContact CB-CG1 4.38Å; A606-V614 HydrophobicContact CB-CG2 4.13Å; L607-V614 HydrophobicContact CD2-CG2 4.32Å; L607-V614 HydrophobicContact CG-CG1 4.18Å; L607-V614 HydrophobicContact CG-CG2 4.19Å; V614-Y616 HydrophobicContact CB-CD2 4Å; V614-Y616 HydrophobicContact CB-CE2 3.56Å; V614-Y616 HydrophobicContact CG1-CD1 4.14Å; V614-Y616 HydrophobicContact CG1-CD2 3.9Å; V614-Y616 HydrophobicContact CG1-CE1 3.78Å; V614-Y616 HydrophobicContact CG1-CE2 3.55Å; V614-Y616 HydrophobicContact CG1-CG 4.2Å; V614-Y616 VanDerWaalsContact CG1-CZ 3.48Å; V614-Y616 HydrophobicContact CG2-CE2 4.5Å; V614-Y616 WeakPolarHBondContact O-CD2 3.38Å; V614-Y616 PolarHBondContact O-N 2.73Å
615	P	93.7	Very high	90.8	Very high	21 Å²	21	60.1 Å²	60.1	14%	0.136	30%	0.296	C	S	.	.			trans	-81.4	46	-166.7	33.7	-37.8	0	0	0	114.7	V603 R617 N618	V603-P615 HydrophobicContact CG2-CG 4.01Å; P615-R617 PolarHBondContact O-N 3.39Å; P615-N618 WeakPolarHBondContact O-CB 3.38Å; P615-N618 PolarHBondContact O-N 3.4Å; P615-N618 VanDerWaalsContact O-N 3.08Å
616	Y	93.3	Very high	91	Very high	38 Å²	38	58.7 Å²	58.7	15%	0.149	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-50.2	-36.3	-176.2	-63.7	-73	0	0	0	114.4	V603 L607 V614 N618 T622 Y623 Q626 L629	V603-Y616 HydrophobicContact CG1-CD1 3.7Å; V603-Y616 HydrophobicContact CG1-CE1 3.57Å; V603-Y616 HydrophobicContact CG2-CD1 4.4Å; L607-Y616 HydrophobicContact CD1-CE1 4.4Å; V614-Y616 HydrophobicContact CB-CD2 4Å; V614-Y616 HydrophobicContact CB-CE2 3.56Å; V614-Y616 HydrophobicContact CG1-CD1 4.14Å; V614-Y616 HydrophobicContact CG1-CD2 3.9Å; V614-Y616 HydrophobicContact CG1-CE1 3.78Å; V614-Y616 HydrophobicContact CG1-CE2 3.55Å; V614-Y616 HydrophobicContact CG1-CG 4.2Å; V614-Y616 VanDerWaalsContact CG1-CZ 3.48Å; V614-Y616 HydrophobicContact CG2-CE2 4.5Å; V614-Y616 WeakPolarHBondContact O-CD2 3.38Å; V614-Y616 PolarHBondContact O-N 2.73Å; Y616-N618 VanDerWaalsContact C-N 3.26Å; Y616-N618 PolarHBondContact O-N 3.03Å; Y616-T622 CarbonylContact O-C 3.52Å; Y616-T622 VanDerWaalsContact O-C 3.31Å; Y616-T622 WeakPolarHBondContact O-CB 3.44Å; Y616-T622 PolarHBondContact O-OG1 3.33Å; Y616-Y623 WeakPolarHBondContact O-CA 3.43Å; Y616-Y623 PolarHBondContact O-N 2.97Å; Y616-Q626 HydrophobicContact CD1-CB 3.98Å; Y616-Q626 HydrophobicContact CD1-CG 3.91Å; Y616-Q626 HydrophobicContact CD2-CG 3.76Å; Y616-Q626 HydrophobicContact CE1-CB 4.39Å; Y616-Q626 HydrophobicContact CE1-CG 4.09Å; Y616-Q626 HydrophobicContact CE2-CG 3.92Å; Y616-Q626 HydrophobicContact CG-CB 4.1Å; Y616-Q626 HydrophobicContact CG-CG 3.73Å; Y616-L629 HydrophobicContact CD1-CD1 4.1Å; Y616-L629 HydrophobicContact CE1-CB 4.09Å; Y616-L629 HydrophobicContact CE1-CD1 4.03Å
617	R	92.8	Very high	90.8	Very high	190 Å²	190	61.1 Å²	61.1	72%	0.717	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-74.4	-7.7	-175.5	-71.2	-177.9	173.5	176.6	-1.5	115.1	P615 S619 Y623	P615-R617 PolarHBondContact O-N 3.39Å; R617-S619 PolarHBondContact O-N 2.92Å; R617-Y623 HydrophobicContact CG-CD2 4Å; R617-Y623 HydrophobicContact CG-CE2 4.28Å; R617-Y623 HydrophobicContact CG-CG 4.42Å
618	N	92.4	Very high	91	Very high	105 Å²	105	60.2 Å²	60.2	56%	0.561	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-72.2	-13.3	-177.5	-71.9	16.8	0	0	0	113.3	T599 P615 Y616	T599-N618 HydrophobicContact CG2-CB 3.56Å; P615-N618 WeakPolarHBondContact O-CB 3.38Å; P615-N618 PolarHBondContact O-N 3.4Å; P615-N618 VanDerWaalsContact O-N 3.08Å; Y616-N618 VanDerWaalsContact C-N 3.26Å; Y616-N618 PolarHBondContact O-N 3.03Å
619	S	94	Very high	91.2	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.014	29%	0.29	C	S	.	.	S	Bend	trans	-145.3	149.5	165.2	172	0	0	0	0	110.8	E468 S596 R617 L621 T622 Y623	E468-S619 WeakPolarHBondContact OE1-CB 3.07Å; E468-S619 PolarHBondContact OE1-OG 3.42Å; E468-S619 VanDerWaalsContact OE2-CA 3.27Å; E468-S619 WeakPolarHBondContact OE2-CA 3.49Å; E468-S619 PolarHBondContact OE2-OG 2.93Å; S596-S619 VanDerWaalsContact CB-OG 3.22Å; S596-S619 WeakPolarHBondContact CB-OG 3.37Å; R617-S619 PolarHBondContact O-N 2.92Å; S619-L621 PolarHBondContact O-N 3.14Å; S619-L621 PolarHBondContact OG-N 3.19Å; S619-T622 PolarHBondContact O-N 3.2Å; S619-T622 PolarHBondContact O-OG1 3.16Å; S619-T622 VanDerWaalsContact O-OG1 3.08Å; S619-Y623 WeakPolarHBondContact O-CB 3.49Å; S619-Y623 PolarHBondContact O-N 3.32Å
620	K	93.5	Very high	91.1	Very high	79 Å²	79	55.1 Å²	55.1	34%	0.343	27%	0.271	S	S	.	.	H	α-helix	trans	-55.3	-34	170.9	-61.5	-64.6	177.9	167.1	0	112	I465 E468 V470 I488 Y623 L624	I465-K620 HydrophobicContact CD1-CB 4.35Å; I465-K620 HydrophobicContact CG2-CB 4.13Å; E468-K620 HydrophobicContact CB-CG 4.4Å; E468-K620 WeakPolarHBondContact O-CE 3.49Å; E468-K620 VanDerWaalsContact O-CG 3.26Å; E468-K620 WeakPolarHBondContact O-CG 3.32Å; E468-K620 WeakPolarHBondContact OE2-CG 3.46Å; E468-K620 PolarHBondContact OE2-N 3.2Å; V470-K620 HydrophobicContact CG2-CB 4.35Å; V470-K620 HydrophobicContact CG2-CG 4.42Å; I488-K620 HydrophobicContact CD1-CB 3.8Å; I488-K620 HydrophobicContact CD1-CD 3.97Å; I488-K620 HydrophobicContact CD1-CG 4.42Å; I488-K620 WeakPolarHBondContact CD1-O 3.37Å; K620-Y623 PolarHBondContact O-N 3.17Å; K620-L624 VanDerWaalsContact O-CB 3.31Å; K620-L624 WeakPolarHBondContact O-CB 3.35Å; K620-L624 PolarHBondContact O-N 3.42Å
621	L	94.3	Very high	91	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-54.4	179.9	176.7	66.4	0	0	0	111.2	I465 H540 V542 V565 L567 L600 S619 Y623 L624 L625	I465-L621 HydrophobicContact CD1-CB 4.18Å; I465-L621 HydrophobicContact CD1-CD1 4.26Å; H540-L621 HydrophobicContact CB-CD1 4.27Å; V542-L621 HydrophobicContact CG2-CD1 4.02Å; V565-L621 HydrophobicContact CG1-CD1 4.31Å; L567-L621 HydrophobicContact CD2-CD1 4.36Å; L567-L621 HydrophobicContact CD2-CD2 3.61Å; L600-L621 HydrophobicContact CD2-CD2 4.38Å; S619-L621 PolarHBondContact O-N 3.14Å; S619-L621 PolarHBondContact OG-N 3.19Å; L621-Y623 VanDerWaalsContact C-N 3.27Å; L621-Y623 PolarHBondContact O-N 3.35Å; L621-L624 PolarHBondContact O-N 3.36Å; L621-L625 HydrophobicContact CD1-CD1 3.75Å; L621-L625 HydrophobicContact CG-CD1 4.3Å; L621-L625 WeakPolarHBondContact O-CB 3.48Å; L621-L625 WeakPolarHBondContact O-CG 3.35Å; L621-L625 PolarHBondContact O-N 2.85Å; L621-L625 VanDerWaalsContact O-N 3.14Å
622	T	94.6	Very high	90.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.9	-26.2	178.1	44.9	0	0	0	0	112.8	T599 L600 V603 Y616 S619 Q626	T599-T622 HydrophobicContact CG2-CG2 4.09Å; L600-T622 HydrophobicContact CB-CG2 4.02Å; L600-T622 HydrophobicContact CD1-CG2 4.02Å; V603-T622 HydrophobicContact CB-CG2 4.17Å; V603-T622 HydrophobicContact CG1-CG2 4.5Å; V603-T622 HydrophobicContact CG2-CG2 3.94Å; Y616-T622 CarbonylContact O-C 3.52Å; Y616-T622 VanDerWaalsContact O-C 3.31Å; Y616-T622 WeakPolarHBondContact O-CB 3.44Å; Y616-T622 PolarHBondContact O-OG1 3.33Å; S619-T622 PolarHBondContact O-N 3.2Å; S619-T622 PolarHBondContact O-OG1 3.16Å; S619-T622 VanDerWaalsContact O-OG1 3.08Å; T622-Q626 PolarHBondContact O-N 3.29Å
623	Y	94.4	Very high	90.9	Very high	44 Å²	44	39.9 Å²	39.9	17%	0.173	20%	0.202	C	C	.	.	H	α-helix	trans	-74.5	-46	175.1	-175.3	-137.9	0	0	0	111.8	I488 L498 Y616 R617 S619 K620 L621 L625 Q626	I488-Y623 HydrophobicContact CB-CD1 3.83Å; I488-Y623 HydrophobicContact CB-CE1 3.84Å; I488-Y623 HydrophobicContact CD1-CD1 4Å; I488-Y623 HydrophobicContact CG2-CD1 3.68Å; I488-Y623 HydrophobicContact CG2-CE1 3.61Å; I488-Y623 HydrophobicContact CG2-CG 4.38Å; L498-Y623 HydrophobicContact CD1-CD2 4.03Å; L498-Y623 HydrophobicContact CD1-CE2 3.81Å; L498-Y623 WeakPolarHBondContact CD1-O 3.14Å; L498-Y623 HydrophobicContact CD2-CE2 4.38Å; Y616-Y623 WeakPolarHBondContact O-CA 3.43Å; Y616-Y623 PolarHBondContact O-N 2.97Å; R617-Y623 HydrophobicContact CG-CD2 4Å; R617-Y623 HydrophobicContact CG-CE2 4.28Å; R617-Y623 HydrophobicContact CG-CG 4.42Å; S619-Y623 WeakPolarHBondContact O-CB 3.49Å; S619-Y623 PolarHBondContact O-N 3.32Å; K620-Y623 PolarHBondContact O-N 3.17Å; L621-Y623 VanDerWaalsContact C-N 3.27Å; L621-Y623 PolarHBondContact O-N 3.35Å; Y623-L625 VanDerWaalsContact C-N 3.31Å; Y623-L625 PolarHBondContact O-N 3.5Å; Y623-Q626 VanDerWaalsContact O-CB 3.25Å; Y623-Q626 WeakPolarHBondContact O-CB 3.42Å; Y623-Q626 PolarHBondContact O-N 3.4Å
624	L	94.3	Very high	90.9	Very high	9 Å²	9	33.4 Å²	33.4	5%	0.047	17%	0.172	C	C	.	.	H	α-helix	trans	-57.9	-45.6	176	178.2	59.8	0	0	0	111.2	V463 I465 I488 V500 V542 K620 L621 Q626	V463-L624 HydrophobicContact CG2-CD2 3.97Å; I465-L624 HydrophobicContact CD1-CD2 4.29Å; I488-L624 HydrophobicContact CD1-CB 3.79Å; I488-L624 HydrophobicContact CG1-CB 4.32Å; I488-L624 HydrophobicContact CG1-CD1 4.43Å; I488-L624 HydrophobicContact CG2-CD1 4.49Å; V500-L624 HydrophobicContact CG2-CD1 3.89Å; V542-L624 HydrophobicContact CB-CD2 4.28Å; V542-L624 HydrophobicContact CG1-CD2 4.04Å; V542-L624 HydrophobicContact CG2-CD2 4.31Å; K620-L624 VanDerWaalsContact O-CB 3.31Å; K620-L624 WeakPolarHBondContact O-CB 3.35Å; K620-L624 PolarHBondContact O-N 3.42Å; L621-L624 PolarHBondContact O-N 3.36Å; L624-Q626 VanDerWaalsContact C-N 3.3Å; L624-Q626 PolarHBondContact O-N 2.83Å
625	L	93.8	Very high	91	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	2.2	-176.2	-61	173.5	0	0	0	113.9	F408 V542 N563 V565 L621 Y623 N627 S628 L629	F408-L625 HydrophobicContact CE1-CD1 3.61Å; F408-L625 HydrophobicContact CZ-CD1 3.84Å; V542-L625 HydrophobicContact CG1-CD2 4.09Å; N563-L625 HydrophobicContact CB-CD2 3.87Å; V565-L625 HydrophobicContact CG2-CD1 4.08Å; V565-L625 HydrophobicContact CG2-CD2 4.34Å; L621-L625 HydrophobicContact CD1-CD1 3.75Å; L621-L625 HydrophobicContact CG-CD1 4.3Å; L621-L625 WeakPolarHBondContact O-CB 3.48Å; L621-L625 WeakPolarHBondContact O-CG 3.35Å; L621-L625 PolarHBondContact O-N 2.85Å; L621-L625 VanDerWaalsContact O-N 3.14Å; Y623-L625 VanDerWaalsContact C-N 3.31Å; Y623-L625 PolarHBondContact O-N 3.5Å; L625-N627 VanDerWaalsContact C-N 3.27Å; L625-N627 PolarHBondContact O-N 3.08Å; L625-S628 CarbonylContact O-C 3.55Å; L625-S628 WeakPolarHBondContact O-CA 3.24Å; L625-S628 PolarHBondContact O-N 3.29Å; L625-L629 HydrophobicContact CB-CD1 3.92Å; L625-L629 HydrophobicContact CB-CG 3.99Å; L625-L629 WeakPolarHBondContact O-CG 3.45Å; L625-L629 PolarHBondContact O-N 2.68Å; L625-L629 VanDerWaalsContact O-N 3.14Å
626	Q	91.8	Very high	91.1	Very high	53 Å²	53	31.6 Å²	31.6	25%	0.248	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-43.9	-49	-173.8	175.3	179.5	-43.5	0	0	113.3	L498 Y616 T622 Y623 L624 S628 L629	L498-Q626 HydrophobicContact CD1-CB 4.1Å; Y616-Q626 HydrophobicContact CD1-CB 3.98Å; Y616-Q626 HydrophobicContact CD1-CG 3.91Å; Y616-Q626 HydrophobicContact CD2-CG 3.76Å; Y616-Q626 HydrophobicContact CE1-CB 4.39Å; Y616-Q626 HydrophobicContact CE1-CG 4.09Å; Y616-Q626 HydrophobicContact CE2-CG 3.92Å; Y616-Q626 HydrophobicContact CG-CB 4.1Å; Y616-Q626 HydrophobicContact CG-CG 3.73Å; T622-Q626 PolarHBondContact O-N 3.29Å; Y623-Q626 VanDerWaalsContact O-CB 3.25Å; Y623-Q626 WeakPolarHBondContact O-CB 3.42Å; Y623-Q626 PolarHBondContact O-N 3.4Å; L624-Q626 VanDerWaalsContact C-N 3.3Å; L624-Q626 PolarHBondContact O-N 2.83Å; Q626-S628 PolarHBondContact O-N 3.36Å; Q626-L629 PolarHBondContact O-N 3.3Å
627	N	87.6	Confident	91.2	Very high	53 Å²	53	29.9 Å²	29.9	28%	0.283	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-79.2	-2.2	-175.3	-57	-6.6	0	0	0	113.9	E496 E497 L625	E496-N627 PolarHBondContact O-ND2 2.7Å; E497-N627 WeakPolarHBondContact CA-ND2 3.5Å; L625-N627 VanDerWaalsContact C-N 3.27Å; L625-N627 PolarHBondContact O-N 3.08Å
628	S	90.7	Very high	91.4	Very high	4 Å²	4	20.9 Å²	20.9	3%	0.028	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-122.5	9.2	-179.7	-50	0	0	0	0	112.5	C406 P561 N563 L625 Q626 A633	C406-S628 VanDerWaalsContact CB-O 3.22Å; C406-S628 WeakPolarHBondContact CB-O 3.22Å; P561-S628 WeakPolarHBondContact CG-OG 3.3Å; N563-S628 WeakPolarHBondContact ND2-CB 3.39Å; N563-S628 PolarHBondContact ND2-OG 3.4Å; L625-S628 CarbonylContact O-C 3.55Å; L625-S628 WeakPolarHBondContact O-CA 3.24Å; L625-S628 PolarHBondContact O-N 3.29Å; Q626-S628 PolarHBondContact O-N 3.36Å; S628-A633 WeakPolarHBondContact O-CB 3.24Å
629	L	88.1	Confident	91.7	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-27.6	176	-73.8	168.7	0	0	0	113	F408 L600 V603 L607 Y616 L625 Q626 M635	F408-L629 HydrophobicContact CE2-CD2 4.07Å; F408-L629 HydrophobicContact CZ-CD2 3.76Å; L600-L629 HydrophobicContact CD1-CD2 3.97Å; V603-L629 HydrophobicContact CG1-CD1 3.89Å; L607-L629 HydrophobicContact CD1-CB 4.04Å; L607-L629 WeakPolarHBondContact CD1-O 3.36Å; Y616-L629 HydrophobicContact CD1-CD1 4.1Å; Y616-L629 HydrophobicContact CE1-CB 4.09Å; Y616-L629 HydrophobicContact CE1-CD1 4.03Å; L625-L629 HydrophobicContact CB-CD1 3.92Å; L625-L629 HydrophobicContact CB-CG 3.99Å; L625-L629 WeakPolarHBondContact O-CG 3.45Å; L625-L629 PolarHBondContact O-N 2.68Å; L625-L629 VanDerWaalsContact O-N 3.14Å; Q626-L629 PolarHBondContact O-N 3.3Å; L629-M635 HydrophobicContact CB-CE 4.24Å; L629-M635 HydrophobicContact CD2-CE 3.56Å; L629-M635 HydrophobicContact CD2-SD 4.46Å; L629-M635 WeakPolarHBondContact O-CE 3.3Å
630	G	81.4	Confident	91.8	Very high	13 Å²	13	15.9 Å²	15.9	13%	0.134	9%	0.093	C	C	.	.	S	Bend	trans	-139.2	177	-174.3	0	0	0	0	0	115.1	S632 A633	G630-S632 PolarHBondContact O-N 2.98Å; G630-S632 VanDerWaalsContact O-N 3.16Å; G630-A633 WeakPolarHBondContact O-CB 3.36Å; G630-A633 PolarHBondContact O-N 3.3Å
631	G	82.1	Confident	92	Very high	52 Å²	52	12.1 Å²	12.1	54%	0.536	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	-109.4	177.1	0	0	0	0	0	112.8	A633 A669	G631-A633 PolarHBondContact O-N 2.95Å; G631-A669 VanDerWaalsContact O-CB 3.29Å; G631-A669 WeakPolarHBondContact O-CB 3.22Å
632	S	82.6	Confident	91.9	Very high	8 Å²	8	12.2 Å²	12.2	6%	0.056	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-30.9	170.1	104.8	0	0	0	0	116	G630 Q670 A671	G630-S632 PolarHBondContact O-N 2.98Å; G630-S632 VanDerWaalsContact O-N 3.16Å; S632-Q670 WeakPolarHBondContact CB-O 3.38Å; S632-Q670 PolarHBondContact OG-O 3.44Å; S632-A671 WeakPolarHBondContact OG-CA 3.17Å
633	A	89.5	Confident	91.8	Very high	5 Å²	5	12.3 Å²	12.3	4%	0.041	8%	0.078	C	C	.	.			trans	-77.3	143.4	-153.5	0	0	0	0	0	114.4	P404 S628 G630 G631	P404-A633 HydrophobicContact CB-CB 4.09Å; P404-A633 VanDerWaalsContact O-CA 3.3Å; P404-A633 WeakPolarHBondContact O-CA 3.33Å; S628-A633 WeakPolarHBondContact O-CB 3.24Å; G630-A633 WeakPolarHBondContact O-CB 3.36Å; G630-A633 PolarHBondContact O-N 3.3Å; G631-A633 PolarHBondContact O-N 2.95Å
634	K	92.1	Very high	91.7	Very high	1 Å²	1	10.8 Å²	10.8	0%	0.004	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.6	171.1	-64.3	166.5	178.2	58.5	0	109.1	N303 Q306 L395 Y403 P404 V405 C406	N303-K634 WeakPolarHBondContact OD1-CE 3.43Å; N303-K634 PolarHBondContact OD1-NZ 3.04Å; Q306-K634 HydrophobicContact CB-CD 3.97Å; Q306-K634 VanDerWaalsContact CB-CE 3.43Å; Q306-K634 HydrophobicContact CG-CD 4.28Å; L395-K634 HydrophobicContact CD1-CB 3.45Å; L395-K634 VanDerWaalsContact CD1-CB 3.45Å; L395-K634 HydrophobicContact CD1-CD 4.15Å; L395-K634 HydrophobicContact CD1-CG 4.38Å; Y403-K634 VanDerWaalsContact CD1-NZ 3.3Å; Y403-K634 VanDerWaalsContact CG-NZ 3.32Å; P404-K634 PolarHBondContact O-N 3.1Å; V405-K634 WeakPolarHBondContact CA-O 3.31Å; C406-K634 PolarHBondContact N-O 3.37Å
635	M	93.9	Very high	91.4	Very high	4 Å²	4	13.7 Å²	13.7	2%	0.02	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.4	-174.3	-173.2	-177	-48.1	0	0	110.6	N311 I312 R313 C406 F408 I604 L629	N311-M635 PolarHBondContact O-N 2.81Å; I312-M635 CarbonylContact C-O 3.45Å; I312-M635 WeakPolarHBondContact CA-O 3.32Å; I312-M635 HydrophobicContact CD1-SD 4.49Å; I312-M635 HydrophobicContact CG1-CB 4.19Å; I312-M635 HydrophobicContact CG1-CE 4.45Å; I312-M635 HydrophobicContact CG1-SD 4.29Å; R313-M635 PolarHBondContact N-O 2.93Å; C406-M635 WeakPolarHBondContact O-CA 3.39Å; F408-M635 HydrophobicContact CD2-CG 4.18Å; F408-M635 HydrophobicContact CE2-CG 3.88Å; F408-M635 HydrophobicContact CE2-SD 4.06Å; I604-M635 HydrophobicContact CD1-SD 3.81Å; I604-M635 HydrophobicContact CG1-CE 4.07Å; I604-M635 HydrophobicContact CG1-SD 3.87Å; L629-M635 HydrophobicContact CB-CE 4.24Å; L629-M635 HydrophobicContact CD2-CE 3.56Å; L629-M635 HydrophobicContact CD2-SD 4.46Å; L629-M635 WeakPolarHBondContact O-CE 3.3Å
636	L	95.6	Very high	91	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.8	169.4	173.6	62.5	0	0	0	109.7	R313 F315 I392 L395 C406 I407 F408 F638	R313-L636 HydrophobicContact CB-CD1 3.74Å; R313-L636 WeakPolarHBondContact O-CA 3.12Å; F315-L636 HydrophobicContact CB-CD1 4.18Å; F315-L636 HydrophobicContact CD1-CD1 3.73Å; F315-L636 HydrophobicContact CD2-CD1 3.89Å; F315-L636 HydrophobicContact CD2-CD2 4.02Å; F315-L636 HydrophobicContact CE1-CD1 4.08Å; F315-L636 HydrophobicContact CE2-CD1 4.25Å; F315-L636 HydrophobicContact CE2-CD2 4.09Å; F315-L636 HydrophobicContact CG-CD1 3.65Å; F315-L636 HydrophobicContact CZ-CD1 4.34Å; I392-L636 HydrophobicContact CB-CD2 4.25Å; I392-L636 HydrophobicContact CG2-CD2 3.35Å; L395-L636 HydrophobicContact CD2-CB 3.54Å; L395-L636 HydrophobicContact CD2-CD2 3.78Å; L395-L636 HydrophobicContact CD2-CG 4.3Å; C406-L636 PolarHBondContact O-N 2.91Å; I407-L636 CarbonylContact C-O 3.54Å; I407-L636 VanDerWaalsContact CA-O 3.3Å; I407-L636 WeakPolarHBondContact CA-O 3.31Å; I407-L636 HydrophobicContact CG1-CB 4.41Å; I407-L636 HydrophobicContact CG2-CB 4.21Å; I407-L636 HydrophobicContact CG2-CD2 4.09Å; I407-L636 HydrophobicContact CG2-CG 4.18Å; F408-L636 PolarHBondContact N-O 3.26Å; L636-F638 HydrophobicContact CD2-CD2 4.32Å; L636-F638 HydrophobicContact CD2-CE2 3.63Å; L636-F638 HydrophobicContact CD2-CZ 4.14Å; L636-F638 HydrophobicContact CG-CD2 4.4Å; L636-F638 HydrophobicContact CG-CE2 4.19Å
637	M	96.1	Very high	90.9	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.015	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.2	171.4	-177.6	172.8	66.1	0	0	111	R313 V314 F315 F408 Y410 F657 A658 V661	R313-M637 PolarHBondContact O-N 3.44Å; V314-M637 CarbonylContact C-O 3.48Å; V314-M637 WeakPolarHBondContact CA-O 3.3Å; V314-M637 HydrophobicContact CG1-CE 4.14Å; V314-M637 HydrophobicContact CG2-CE 4.16Å; F315-M637 PolarHBondContact N-O 3.29Å; F408-M637 HydrophobicContact CB-CB 4.38Å; F408-M637 HydrophobicContact CB-CG 4.17Å; Y410-M637 HydrophobicContact CD1-SD 4.29Å; Y410-M637 HydrophobicContact CG-SD 4.19Å; M637-F657 HydrophobicContact CE-CD1 4.1Å; M637-F657 HydrophobicContact CE-CE1 4.05Å; M637-F657 HydrophobicContact SD-CD1 4.23Å; M637-F657 HydrophobicContact SD-CE1 3.78Å; M637-A658 HydrophobicContact CE-CB 4.02Å; M637-V661 HydrophobicContact CE-CB 3.63Å; M637-V661 HydrophobicContact CE-CG1 3.82Å; M637-V661 HydrophobicContact CE-CG2 3.76Å
638	F	97.9	Very high	91	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	119.3	160.8	-74.8	-85.8	0	0	0	109.5	F315 R317 F379 V388 I392 I407 F408 Y410 T420 L434 L636	F315-F638 HydrophobicContact CB-CD1 3.82Å; F315-F638 HydrophobicContact CB-CE1 3.82Å; F315-F638 HydrophobicContact CB-CG 4.47Å; F315-F638 HydrophobicContact CB-CZ 4.47Å; F315-F638 AromaticContact CD2-CE1 3.72Å; F315-F638 HydrophobicContact CD2-CE1 3.72Å; F315-F638 HydrophobicContact CD2-CE2 4.49Å; F315-F638 AromaticContact CD2-CZ 3.72Å; F315-F638 HydrophobicContact CD2-CZ 3.72Å; F315-F638 HydrophobicContact CG-CE1 4.3Å; F315-F638 CarbonylContact O-C 3.55Å; F315-F638 VanDerWaalsContact O-CA 3.25Å; F315-F638 WeakPolarHBondContact O-CA 3.34Å; R317-F638 HydrophobicContact CB-CD1 4.47Å; F379-F638 HydrophobicContact CD2-CE1 4.37Å; F379-F638 AromaticContact CE2-CE1 3.95Å; F379-F638 HydrophobicContact CE2-CE1 3.95Å; V388-F638 HydrophobicContact CG1-CE1 3.62Å; V388-F638 HydrophobicContact CG1-CZ 3.79Å; I392-F638 HydrophobicContact CG2-CE2 4.24Å; I392-F638 HydrophobicContact CG2-CZ 3.93Å; I407-F638 HydrophobicContact CG2-CD2 3.88Å; I407-F638 HydrophobicContact CG2-CE2 3.89Å; F408-F638 WeakPolarHBondContact O-CB 3.49Å; F408-F638 PolarHBondContact O-N 3.06Å; Y410-F638 PolarHBondContact N-O 3.42Å; T420-F638 HydrophobicContact CG2-CD1 4.38Å; T420-F638 HydrophobicContact CG2-CD2 4.47Å; T420-F638 HydrophobicContact CG2-CG 4.26Å; L434-F638 HydrophobicContact CD1-CD2 3.98Å; L434-F638 HydrophobicContact CD1-CE2 3.43Å; L434-F638 VanDerWaalsContact CD1-CE2 3.43Å; L434-F638 HydrophobicContact CD1-CZ 3.99Å; L636-F638 HydrophobicContact CD2-CD2 4.32Å; L636-F638 HydrophobicContact CD2-CE2 3.63Å; L636-F638 HydrophobicContact CD2-CZ 4.14Å; L636-F638 HydrophobicContact CG-CD2 4.4Å; L636-F638 HydrophobicContact CG-CE2 4.19Å
639	V	97.3	Very high	90.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	106.4	162.8	60.8	0	0	0	0	108.8	V314 F315 C316 R317 F375 Y410 I641 L655 A658	V314-V639 HydrophobicContact CG1-CG1 4.32Å; F315-V639 PolarHBondContact O-N 3.12Å; C316-V639 HydrophobicContact CB-CG1 3.74Å; R317-V639 PolarHBondContact N-O 2.9Å; F375-V639 HydrophobicContact CE1-CG1 4.48Å; F375-V639 HydrophobicContact CZ-CG1 4.4Å; Y410-V639 HydrophobicContact CD1-CG2 4.22Å; V639-I641 HydrophobicContact CG2-CD1 3.87Å; V639-I641 HydrophobicContact CG2-CG1 4.29Å; V639-L655 HydrophobicContact CG1-CD2 4.45Å; V639-A658 HydrophobicContact CB-CB 3.74Å; V639-A658 HydrophobicContact CG1-CB 3.63Å; V639-A658 HydrophobicContact CG2-CB 3.93Å
640	N	97.4	Very high	91	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.011	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	125.9	179.4	-72.6	105.1	0	0	0	110.3	R317 Y410 S415 K417 T420	R317-N640 WeakPolarHBondContact O-CA 3.48Å; Y410-N640 PolarHBondContact O-N 3.26Å; S415-N640 WeakPolarHBondContact CB-O 3.4Å; S415-N640 VanDerWaalsContact OG-CB 3.3Å; S415-N640 WeakPolarHBondContact OG-CB 3.47Å; S415-N640 PolarHBondContact OG-O 3.49Å; K417-N640 WeakPolarHBondContact CA-OD1 3.35Å; K417-N640 HydrophobicContact CG-CB 3.95Å; T420-N640 PolarHBondContact OG1-ND2 3.26Å
641	I	96	Very high	91.6	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.1	-172	-63	-61	0	0	0	111.5	R317 V318 R319 V639 L655	R317-I641 PolarHBondContact O-N 2.88Å; V318-I641 HydrophobicContact CG2-CB 4.26Å; V318-I641 HydrophobicContact CG2-CG2 4.37Å; R319-I641 PolarHBondContact N-O 3.39Å; V639-I641 HydrophobicContact CG2-CD1 3.87Å; V639-I641 HydrophobicContact CG2-CG1 4.29Å; I641-L655 HydrophobicContact CD1-CD1 4.35Å; I641-L655 HydrophobicContact CD1-CD2 4.02Å; I641-L655 HydrophobicContact CD1-CG 3.76Å; I641-L655 HydrophobicContact CG1-CD2 4Å; I641-L655 HydrophobicContact CG1-CG 4.22Å
642	S	93.4	Very high	92.1	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.007	10%	0.102	C	C	.	.			trans	-80.9	135.8	173.9	-169.7	0	0	0	0	110.1	L644 N647	S642-L644 PolarHBondContact O-N 3.48Å; S642-N647 PolarHBondContact OG-ND2 2.86Å
643	P	92.3	Very high	92.5	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.019	11%	0.113	C	C	.	.			trans	-76.2	-2	178.7	31.9	-37.2	0	0	0	113.9	V318 R319 V321 P328 F332 L333	V318-P643 HydrophobicContact CG1-CB 4.13Å; R319-P643 HydrophobicContact CG-CG 4.37Å; V321-P643 HydrophobicContact CB-CG 4.45Å; V321-P643 HydrophobicContact CG2-CB 3.92Å; V321-P643 HydrophobicContact CG2-CG 3.73Å; P328-P643 WeakPolarHBondContact CB-O 3.35Å; P328-P643 WeakPolarHBondContact CG-O 3.35Å; F332-P643 WeakPolarHBondContact CE1-O 3.1Å; L333-P643 HydrophobicContact CD1-CB 4.25Å
644	L	91.1	Very high	92.7	Very high	11 Å²	11	21.4 Å²	21.4	6%	0.058	11%	0.111	C	C	.	.			trans	-94.5	141.8	-168.9	-47	-179.7	0	0	0	113	V321 E325 S326 S642 E646 N647	V321-L644 HydrophobicContact CG1-CD2 4.32Å; E325-L644 HydrophobicContact CB-CD1 4.24Å; E325-L644 HydrophobicContact CB-CD2 3.91Å; E325-L644 HydrophobicContact CG-CD1 4.16Å; S326-L644 WeakPolarHBondContact O-CD2 3.36Å; S642-L644 PolarHBondContact O-N 3.48Å; L644-E646 HydrophobicContact CB-CG 3.76Å; L644-E646 HydrophobicContact CD1-CG 4.37Å; L644-E646 PolarHBondContact O-N 2.84Å; L644-N647 WeakPolarHBondContact O-CB 3.26Å; L644-N647 PolarHBondContact O-N 2.94Å
645	E	87.9	Confident	92.8	Very high	71 Å²	71	21.3 Å²	21.3	33%	0.332	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	-66.4	-36.2	-176.8	-55.3	-168.5	166	0	0	113.4	P328 S329 F332 N647 V648	P328-E645 HydrophobicContact CB-CG 4.11Å; S329-E645 WeakPolarHBondContact CA-OE1 3.41Å; S329-E645 WeakPolarHBondContact CB-OE1 3.44Å; S329-E645 PolarHBondContact N-OE1 3.38Å; S329-E645 PolarHBondContact OG-OE1 2.97Å; F332-E645 HydrophobicContact CB-CG 4.49Å; F332-E645 HydrophobicContact CD1-CG 4.01Å; F332-E645 HydrophobicContact CD2-CG 3.8Å; F332-E645 HydrophobicContact CE1-CG 4.19Å; F332-E645 HydrophobicContact CE2-CB 4.26Å; F332-E645 HydrophobicContact CE2-CG 4Å; F332-E645 HydrophobicContact CG-CG 3.83Å; F332-E645 HydrophobicContact CZ-CB 4.39Å; F332-E645 HydrophobicContact CZ-CG 4.19Å; E645-N647 PolarHBondContact O-N 3.43Å; E645-N647 VanDerWaalsContact O-N 3.1Å; E645-V648 WeakPolarHBondContact O-CB 3.18Å; E645-V648 WeakPolarHBondContact O-CG1 3.38Å; E645-V648 PolarHBondContact O-N 2.8Å
646	E	87.3	Confident	92.8	Very high	151 Å²	151	26.6 Å²	26.6	71%	0.706	13%	0.131	S	C	*	.	G	3₁₀ helix	trans	-52.4	-31.5	170.5	45.1	157.8	-124.8	0	0	113	L644	L644-E646 HydrophobicContact CB-CG 3.76Å; L644-E646 HydrophobicContact CD1-CG 4.37Å; L644-E646 PolarHBondContact O-N 2.84Å
647	N	88.9	Confident	92.6	Very high	31 Å²	31	28.4 Å²	28.4	17%	0.166	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-92.6	8.6	-178.3	-69.1	-64.2	0	0	0	112.9	Q412 S642 L644 E645 S649 E650 S651	Q412-N647 PolarHBondContact NE2-OD1 2.98Å; S642-N647 PolarHBondContact OG-ND2 2.86Å; L644-N647 WeakPolarHBondContact O-CB 3.26Å; L644-N647 PolarHBondContact O-N 2.94Å; E645-N647 PolarHBondContact O-N 3.43Å; E645-N647 VanDerWaalsContact O-N 3.1Å; N647-S649 VanDerWaalsContact C-N 3.3Å; N647-S649 PolarHBondContact O-N 3.44Å; N647-E650 PolarHBondContact O-N 2.96Å; N647-S651 VanDerWaalsContact O-CB 3.24Å; N647-S651 WeakPolarHBondContact O-CB 3.41Å; N647-S651 PolarHBondContact O-N 3.11Å; N647-S651 PolarHBondContact O-OG 2.78Å
648	V	89.5	Confident	92.4	Very high	19 Å²	19	28.3 Å²	28.3	12%	0.115	14%	0.138	C	C	.	.	H	α-helix	trans	-54.6	-43.1	-179	65	0	0	0	0	112.6	F332 L351 R353 E645 S651 L652	F332-V648 HydrophobicContact CE2-CB 4.1Å; F332-V648 HydrophobicContact CE2-CG2 4.03Å; F332-V648 HydrophobicContact CZ-CB 4.16Å; F332-V648 HydrophobicContact CZ-CG2 4.39Å; L351-V648 HydrophobicContact CD2-CG2 3.69Å; R353-V648 HydrophobicContact CB-CG2 4.18Å; R353-V648 HydrophobicContact CG-CG2 4.39Å; E645-V648 WeakPolarHBondContact O-CB 3.18Å; E645-V648 WeakPolarHBondContact O-CG1 3.38Å; E645-V648 PolarHBondContact O-N 2.8Å; V648-S651 PolarHBondContact O-N 2.91Å; V648-L652 HydrophobicContact CG2-CD1 3.85Å; V648-L652 HydrophobicContact CG2-CG 4.29Å; V648-L652 WeakPolarHBondContact O-CB 3.32Å; V648-L652 WeakPolarHBondContact O-CG 3.43Å; V648-L652 PolarHBondContact O-N 2.99Å
649	S	89.1	Confident	92.1	Very high	58 Å²	58	29.7 Å²	29.7	41%	0.406	15%	0.148	S	C	.	.	H	α-helix	trans	-68.2	-42.2	-172.9	-61.9	0	0	0	0	112.2	R353 N647 N653	R353-S649 PolarHBondContact NH1-OG 2.99Å; R353-S649 VanDerWaalsContact NH1-OG 3.11Å; N647-S649 VanDerWaalsContact C-N 3.3Å; N647-S649 PolarHBondContact O-N 3.44Å; S649-N653 VanDerWaalsContact O-CG 3.31Å; S649-N653 PolarHBondContact O-N 2.88Å; S649-N653 VanDerWaalsContact O-N 3.12Å; S649-N653 PolarHBondContact O-ND2 3.08Å
650	E	90.1	Very high	91.8	Very high	32 Å²	32	35.5 Å²	35.5	15%	0.15	17%	0.173	C	C	.	.	H	α-helix	trans	-82	-27.4	177.7	-68.2	-68.1	-164.9	0	0	113.2	Q412 E571 R572 N647 N653 S654	Q412-E650 HydrophobicContact CB-CB 4.32Å; E571-E650 WeakPolarHBondContact CA-OE1 3.04Å; E571-E650 HydrophobicContact CB-CG 4.37Å; R572-E650 PolarHBondContact N-OE1 3.15Å; N647-E650 PolarHBondContact O-N 2.96Å; E650-N653 PolarHBondContact O-N 3.14Å; E650-N653 PolarHBondContact OE2-ND2 2.82Å; E650-S654 WeakPolarHBondContact O-CB 3.2Å; E650-S654 PolarHBondContact O-N 2.9Å; E650-S654 PolarHBondContact O-OG 2.85Å
651	S	92.6	Very high	91.4	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-44.7	168	-62.1	0	0	0	0	110.9	N647 V648 N653 S654 L655	N647-S651 VanDerWaalsContact O-CB 3.24Å; N647-S651 WeakPolarHBondContact O-CB 3.41Å; N647-S651 PolarHBondContact O-N 3.11Å; N647-S651 PolarHBondContact O-OG 2.78Å; V648-S651 PolarHBondContact O-N 2.91Å; S651-N653 PolarHBondContact O-N 3.11Å; S651-S654 PolarHBondContact O-N 2.8Å; S651-L655 WeakPolarHBondContact O-CB 3.44Å; S651-L655 VanDerWaalsContact O-CG 3.24Å; S651-L655 WeakPolarHBondContact O-CG 3.35Å; S651-L655 PolarHBondContact O-N 2.57Å
652	L	92.7	Very high	91	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-64.7	-36.9	173.9	-71.2	171.8	0	0	0	112.9	L351 H371 F373 V648 R656	L351-L652 HydrophobicContact CB-CD2 4.46Å; L351-L652 HydrophobicContact CD1-CD2 4.48Å; L351-L652 HydrophobicContact CD2-CD2 4.41Å; H371-L652 HydrophobicContact CB-CD2 3.77Å; H371-L652 VanDerWaalsContact CD2-CD2 3.43Å; H371-L652 WeakPolarHBondContact CD2-CD2 3.34Å; F373-L652 HydrophobicContact CE2-CD2 3.83Å; F373-L652 HydrophobicContact CZ-CD2 3.94Å; V648-L652 HydrophobicContact CG2-CD1 3.85Å; V648-L652 HydrophobicContact CG2-CG 4.29Å; V648-L652 WeakPolarHBondContact O-CB 3.32Å; V648-L652 WeakPolarHBondContact O-CG 3.43Å; V648-L652 PolarHBondContact O-N 2.99Å; L652-R656 VanDerWaalsContact O-CB 3.31Å; L652-R656 WeakPolarHBondContact O-CB 3.13Å; L652-R656 VanDerWaalsContact O-CD 3.3Å; L652-R656 WeakPolarHBondContact O-CD 3.23Å; L652-R656 WeakPolarHBondContact O-CG 3.5Å; L652-R656 PolarHBondContact O-N 2.89Å
653	N	91.7	Very high	90.6	Very high	55 Å²	55	44.6 Å²	44.6	29%	0.294	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-45.2	172.6	-71.4	-22.9	0	0	0	111.4	S649 E650 S651 R656 F657	S649-N653 VanDerWaalsContact O-CG 3.31Å; S649-N653 PolarHBondContact O-N 2.88Å; S649-N653 VanDerWaalsContact O-N 3.12Å; S649-N653 PolarHBondContact O-ND2 3.08Å; E650-N653 PolarHBondContact O-N 3.14Å; E650-N653 PolarHBondContact OE2-ND2 2.82Å; S651-N653 PolarHBondContact O-N 3.11Å; N653-R656 PolarHBondContact O-N 3.09Å; N653-F657 PolarHBondContact O-N 3.36Å
654	S	93.6	Very high	89.7	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-46.1	179.4	-55.4	0	0	0	0	111.6	S570 E650 S651 F657 A658	S570-S654 PolarHBondContact OG-OG 3.25Å; E650-S654 WeakPolarHBondContact O-CB 3.2Å; E650-S654 PolarHBondContact O-N 2.9Å; E650-S654 PolarHBondContact O-OG 2.85Å; S651-S654 PolarHBondContact O-N 2.8Å; S654-F657 PolarHBondContact O-N 2.85Å; S654-A658 WeakPolarHBondContact O-CB 3.37Å; S654-A658 PolarHBondContact O-N 2.83Å
655	L	94.8	Very high	88.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-65.9	-37.7	177.4	-69.6	167.8	0	0	0	112.7	L349 L351 F373 F375 V639 I641 S651 A658 S659	L349-L655 HydrophobicContact CD2-CD1 3.96Å; L349-L655 HydrophobicContact CD2-CD2 3.88Å; L351-L655 HydrophobicContact CD1-CD1 3.65Å; F373-L655 HydrophobicContact CD1-CB 3.85Å; F373-L655 HydrophobicContact CD2-CB 4.05Å; F373-L655 HydrophobicContact CD2-CD1 3.87Å; F373-L655 HydrophobicContact CD2-CG 4.4Å; F373-L655 HydrophobicContact CE1-CB 3.61Å; F373-L655 HydrophobicContact CE2-CB 3.82Å; F373-L655 HydrophobicContact CE2-CD1 3.74Å; F373-L655 HydrophobicContact CE2-CG 4.37Å; F373-L655 HydrophobicContact CG-CB 4.05Å; F373-L655 HydrophobicContact CZ-CB 3.59Å; F373-L655 HydrophobicContact CZ-CD1 4.33Å; F375-L655 HydrophobicContact CE2-CD2 3.66Å; F375-L655 HydrophobicContact CZ-CD2 3.73Å; V639-L655 HydrophobicContact CG1-CD2 4.45Å; I641-L655 HydrophobicContact CD1-CD1 4.35Å; I641-L655 HydrophobicContact CD1-CD2 4.02Å; I641-L655 HydrophobicContact CD1-CG 3.76Å; I641-L655 HydrophobicContact CG1-CD2 4Å; I641-L655 HydrophobicContact CG1-CG 4.22Å; S651-L655 WeakPolarHBondContact O-CB 3.44Å; S651-L655 VanDerWaalsContact O-CG 3.24Å; S651-L655 WeakPolarHBondContact O-CG 3.35Å; S651-L655 PolarHBondContact O-N 2.57Å; L655-A658 PolarHBondContact O-N 2.85Å; L655-S659 VanDerWaalsContact O-CB 3.3Å; L655-S659 WeakPolarHBondContact O-CB 3.43Å; L655-S659 PolarHBondContact O-N 2.77Å
656	R	93.1	Very high	86.7	Confident	114 Å²	114	47.6 Å²	47.6	43%	0.43	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-36.3	174.6	-73.7	165.7	-176	162.3	1.1	112.6	F373 L652 N653 K660	F373-R656 HydrophobicContact CE1-CG 4.02Å; F373-R656 HydrophobicContact CZ-CG 4.26Å; L652-R656 VanDerWaalsContact O-CB 3.31Å; L652-R656 WeakPolarHBondContact O-CB 3.13Å; L652-R656 VanDerWaalsContact O-CD 3.3Å; L652-R656 WeakPolarHBondContact O-CD 3.23Å; L652-R656 WeakPolarHBondContact O-CG 3.5Å; L652-R656 PolarHBondContact O-N 2.89Å; N653-R656 PolarHBondContact O-N 3.09Å; R656-K660 WeakPolarHBondContact O-CG 3.36Å; R656-K660 PolarHBondContact O-N 2.83Å
657	F	91	Very high	84.9	Confident	41 Å²	41	41.8 Å²	41.8	18%	0.18	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-48.9	171.7	179.2	-96.8	0	0	0	110.8	Y410 M637 N653 S654 S659 K660 V661	Y410-F657 AromaticContact CD1-CD1 3.85Å; Y410-F657 HydrophobicContact CD1-CD1 3.85Å; Y410-F657 HydrophobicContact CD1-CE1 4.35Å; Y410-F657 HydrophobicContact CE1-CB 3.98Å; Y410-F657 AromaticContact CE1-CD1 3.35Å; Y410-F657 HydrophobicContact CE1-CD1 3.35Å; Y410-F657 HydrophobicContact CE1-CE1 4.12Å; Y410-F657 AromaticContact CE1-CG 3.92Å; Y410-F657 HydrophobicContact CE1-CG 3.92Å; Y410-F657 HydrophobicContact CE2-CD1 4.26Å; Y410-F657 HydrophobicContact CE2-CE1 4.34Å; Y410-F657 HydrophobicContact CG-CD1 4.48Å; Y410-F657 AromaticContact CZ-CD1 3.59Å; Y410-F657 AromaticContact CZ-CG 3.95Å; M637-F657 HydrophobicContact CE-CD1 4.1Å; M637-F657 HydrophobicContact CE-CE1 4.05Å; M637-F657 HydrophobicContact SD-CD1 4.23Å; M637-F657 HydrophobicContact SD-CE1 3.78Å; N653-F657 PolarHBondContact O-N 3.36Å; S654-F657 PolarHBondContact O-N 2.85Å; F657-S659 VanDerWaalsContact C-N 3.32Å; F657-S659 PolarHBondContact O-N 3.47Å; F657-K660 WeakPolarHBondContact O-CB 3.15Å; F657-K660 PolarHBondContact O-N 2.81Å; F657-K660 VanDerWaalsContact O-N 3.14Å; F657-V661 HydrophobicContact CD1-CG2 4.41Å; F657-V661 HydrophobicContact CE1-CG2 3.99Å; F657-V661 HydrophobicContact CZ-CG2 4.18Å; F657-V661 PolarHBondContact O-N 3.42Å; F657-V661 VanDerWaalsContact O-N 3.17Å
658	A	93.2	Very high	82.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.5	-41.1	178.8	0	0	0	0	0	112.8	V314 F375 M637 V639 S654 L655 K660 V661 N662	V314-A658 HydrophobicContact CG1-CB 3.87Å; F375-A658 HydrophobicContact CE1-CB 3.64Å; F375-A658 HydrophobicContact CZ-CB 4.02Å; M637-A658 HydrophobicContact CE-CB 4.02Å; V639-A658 HydrophobicContact CB-CB 3.74Å; V639-A658 HydrophobicContact CG1-CB 3.63Å; V639-A658 HydrophobicContact CG2-CB 3.93Å; S654-A658 WeakPolarHBondContact O-CB 3.37Å; S654-A658 PolarHBondContact O-N 2.83Å; L655-A658 PolarHBondContact O-N 2.85Å; A658-K660 VanDerWaalsContact C-N 3.34Å; A658-K660 PolarHBondContact O-N 3.49Å; A658-V661 PolarHBondContact O-N 2.91Å; A658-N662 PolarHBondContact O-N 3.49Å
659	S	92.1	Very high	80.6	Confident	29 Å²	29	45.9 Å²	45.9	20%	0.203	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-35.5	177.1	-179.5	0	0	0	0	113	L655 F657 N662 Q663	L655-S659 VanDerWaalsContact O-CB 3.3Å; L655-S659 WeakPolarHBondContact O-CB 3.43Å; L655-S659 PolarHBondContact O-N 2.77Å; F657-S659 VanDerWaalsContact C-N 3.32Å; F657-S659 PolarHBondContact O-N 3.47Å; S659-N662 PolarHBondContact O-N 2.79Å; S659-Q663 WeakPolarHBondContact O-CG 3.48Å; S659-Q663 PolarHBondContact O-N 2.51Å
660	K	89.2	Confident	78.4	Confident	123 Å²	123	51.4 Å²	51.4	54%	0.535	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-40.6	172.8	-70.1	179.3	178.3	-170.6	0	112.2	R656 F657 A658 N662 Q663 C664	R656-K660 WeakPolarHBondContact O-CG 3.36Å; R656-K660 PolarHBondContact O-N 2.83Å; F657-K660 WeakPolarHBondContact O-CB 3.15Å; F657-K660 PolarHBondContact O-N 2.81Å; F657-K660 VanDerWaalsContact O-N 3.14Å; A658-K660 VanDerWaalsContact C-N 3.34Å; A658-K660 PolarHBondContact O-N 3.49Å; K660-N662 VanDerWaalsContact C-N 3.32Å; K660-Q663 PolarHBondContact O-N 2.98Å; K660-C664 PolarHBondContact O-SG 2.94Å
661	V	89.4	Confident	76	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.024	28%	0.275	C	S	.	.	H	α-helix	trans	-67.1	-34.5	174.6	176.5	0	0	0	0	111	I312 V314 I604 M637 F657 A658 Q663 C664	I312-V661 HydrophobicContact CG2-CG1 3.77Å; V314-V661 HydrophobicContact CG2-CB 3.97Å; V314-V661 HydrophobicContact CG2-CG1 3.63Å; I604-V661 HydrophobicContact CD1-CG2 4.37Å; I604-V661 HydrophobicContact CG2-CG1 4.05Å; I604-V661 HydrophobicContact CG2-CG2 4.18Å; M637-V661 HydrophobicContact CE-CB 3.63Å; M637-V661 HydrophobicContact CE-CG1 3.82Å; M637-V661 HydrophobicContact CE-CG2 3.76Å; F657-V661 HydrophobicContact CD1-CG2 4.41Å; F657-V661 HydrophobicContact CE1-CG2 3.99Å; F657-V661 HydrophobicContact CZ-CG2 4.18Å; F657-V661 PolarHBondContact O-N 3.42Å; F657-V661 VanDerWaalsContact O-N 3.17Å; A658-V661 PolarHBondContact O-N 2.91Å; V661-Q663 PolarHBondContact O-N 3.41Å; V661-C664 VanDerWaalsContact O-CB 3.23Å; V661-C664 WeakPolarHBondContact O-CB 3.47Å; V661-C664 PolarHBondContact O-N 3.18Å
662	N	88.1	Confident	73.6	Confident	45 Å²	45	56.9 Å²	56.9	24%	0.241	30%	0.303	C	S	.	.	H	α-helix	trans	-68.4	-24.3	176.8	-158.9	45	0	0	0	113.1	V314 S374 F375 D376 A658 S659 K660 C664	V314-N662 HydrophobicContact CB-CB 4.05Å; V314-N662 HydrophobicContact CG2-CB 3.88Å; S374-N662 PolarHBondContact O-ND2 3.1Å; F375-N662 WeakPolarHBondContact CA-ND2 3.36Å; F375-N662 HydrophobicContact CD1-CB 4.37Å; D376-N662 PolarHBondContact OD2-OD1 2.9Å; A658-N662 PolarHBondContact O-N 3.49Å; S659-N662 PolarHBondContact O-N 2.79Å; K660-N662 VanDerWaalsContact C-N 3.32Å; N662-C664 VanDerWaalsContact C-N 3.26Å; N662-C664 PolarHBondContact O-N 3.27Å
663	Q	83.9	Confident	71.1	Confident	145 Å²	145	64.6 Å²	64.6	68%	0.678	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.7	173.2	-69.1	165	4.4	0	0	113	S659 K660 V661 V665	S659-Q663 WeakPolarHBondContact O-CG 3.48Å; S659-Q663 PolarHBondContact O-N 2.51Å; K660-Q663 PolarHBondContact O-N 2.98Å; V661-Q663 PolarHBondContact O-N 3.41Å; Q663-V665 PolarHBondContact O-N 3.28Å
664	C	74.1	Confident	68.5	Low	12 Å²	12	74.6 Å²	74.6	8%	0.081	38%	0.377	C	S	.	.			trans	-90.3	91.5	-174.4	-71.2	0	0	0	0	112.8	I312 I604 S608 K660 V661 N662 I666	I312-C664 HydrophobicContact CD1-CB 3.92Å; I312-C664 WeakPolarHBondContact CD1-O 3.31Å; I604-C664 HydrophobicContact CG2-CB 4.24Å; S608-C664 VanDerWaalsContact OG-C 3.24Å; S608-C664 WeakPolarHBondContact OG-CA 3.46Å; K660-C664 PolarHBondContact O-SG 2.94Å; V661-C664 VanDerWaalsContact O-CB 3.23Å; V661-C664 WeakPolarHBondContact O-CB 3.47Å; V661-C664 PolarHBondContact O-N 3.18Å; N662-C664 VanDerWaalsContact C-N 3.26Å; N662-C664 PolarHBondContact O-N 3.27Å; C664-I666 PolarHBondContact O-N 3.2Å
665	V	59.8	Low	67.2	Low	113 Å²	113	78.4 Å²	78.4	69%	0.685	40%	0.396	S	S	*	.			trans	-89.3	95.5	176.9	-173.3	0	0	0	0	111.6	S608 Q663	S608-V665 PolarHBondContact OG-N 2.81Å; S608-V665 VanDerWaalsContact OG-N 3.11Å; Q663-V665 PolarHBondContact O-N 3.28Å
666	I	55.9	Low	65.8	Low	24 Å²	24	82.5 Å²	82.5	12%	0.123	42%	0.417	C	S	.	.			trans	-67.7	139.9	163.8	-64.9	178.8	0	0	0	109.4	I312 L607 C664	I312-I666 HydrophobicContact CD1-CD1 3.54Å; I312-I666 HydrophobicContact CD1-CG1 3.71Å; I312-I666 HydrophobicContact CG1-CD1 3.84Å; I312-I666 HydrophobicContact CG1-CG1 4.13Å; L607-I666 HydrophobicContact CB-CD1 3.78Å; L607-I666 HydrophobicContact CB-CG1 4.3Å; L607-I666 HydrophobicContact CD1-CD1 4.47Å; C664-I666 PolarHBondContact O-N 3.2Å
667	G	50.8	Low	64.3	Low	28 Å²	28	80.7 Å²	80.7	29%	0.289	42%	0.416	S	S	.	.			trans	-68.3	179.4	179.7	0	0	0	0	0	115	N311	N311-G667 PolarHBondContact ND2-O 3.42Å
668	T	43.2	Very low	62.7	Low	124 Å²	124	83.1 Å²	83.1	76%	0.761	43%	0.43	S	S	*	.			trans	-58.7	147	178.6	41.2	0	0	0	0	112.8
669	A	44.5	Very low	60.8	Low	13 Å²	13	88.3 Å²	88.3	11%	0.107	46%	0.457	C	S	.	.			trans	-110.3	138.4	-163.7	0	0	0	0	0	111.6	E307 G631	E307-A669 WeakPolarHBondContact OE1-CA 3.41Å; E307-A669 WeakPolarHBondContact OE1-CB 3.44Å; E307-A669 PolarHBondContact OE1-N 2.92Å; E307-A669 VanDerWaalsContact OE1-O 3.12Å; G631-A669 VanDerWaalsContact O-CB 3.29Å; G631-A669 WeakPolarHBondContact O-CB 3.22Å
670	Q	42.3	Very low	58.7	Low	173 Å²	173	92.2 Å²	92.2	81%	0.808	47%	0.474	S	S	*	.			trans	-100.4	117.1	178	-68.1	-169.7	-6.6	0	0	110.8	S632	S632-Q670 WeakPolarHBondContact CB-O 3.38Å; S632-Q670 PolarHBondContact OG-O 3.44Å
671	A	39.5	Very low	56.5	Low	39 Å²	39	90 Å²	90	32%	0.322	47%	0.47	S	S	.	.			trans	-57	135.8	-175	0	0	0	0	0	113.3	Y403 S632 K673	Y403-A671 HydrophobicContact CE1-CB 3.62Å; S632-A671 WeakPolarHBondContact OG-CA 3.17Å; A671-K673 VanDerWaalsContact C-N 3.25Å; A671-K673 HydrophobicContact CB-CG 4.41Å; A671-K673 PolarHBondContact O-N 2.9Å
672	N	43.2	Very low	54	Low	109 Å²	109	96.6 Å²	96.6	58%	0.583	50%	0.504	S	S	*	.			trans	-72.1	74.8	174.5	-78.3	-18	0	0	0	111.7
673	K	39.4	Very low	51.2	Low	166 Å²	166	100.9 Å²	100.9	72%	0.722	53%	0.526	S	S	*	.			trans	-88.4	138.7	169.1	-63.6	-175.4	178.7	-176.6	0	110.3	A671	A671-K673 VanDerWaalsContact C-N 3.25Å; A671-K673 HydrophobicContact CB-CG 4.41Å; A671-K673 PolarHBondContact O-N 2.9Å
674	K	37.5	Very low	48.2	Very low	265 Å²	265	96.9 Å²	96.9	100%	1.152	51%	0.512	S	S	*	.			trans	-129.7	0	165.8	-79	-172.8	174.6	178.5	0	108.8

Retrieved 674 of 674 residues in 655.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).