A0A3Q0KEB9_SCHMA Loading...

Cytohesin-related guanine nucleotide-exchange protein

AlphaFold DB , UniProt , Accession A0A3Q0KEB9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 681 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	36.3	Very low	243 Å²	243	159.2 Å²	159.2	100%	1.197	76%	0.76	S	S	*	*				0	124.5	0	-84	-178.2	172.6	0	0	108.9
2	R	34.1	Very low	36.2	Very low	215 Å²	215	153.3 Å²	153.3	81%	0.811	75%	0.748	S	S	*	*			trans	27.4	114.5	152	-72	179.4	175	175.2	-0.1	119.1
3	K	37.1	Very low	36.2	Very low	139 Å²	139	152.5 Å²	152.5	60%	0.604	74%	0.742	S	S	*	*				97.3	143.2	96.6	-79.9	-177.7	175	-176.9	0	109.7
4	R	38	Very low	36.2	Very low	188 Å²	188	152.7 Å²	152.7	71%	0.709	74%	0.741	S	S	*	*			cis	-178.3	135.7	11.4	-115.5	174.6	-170.2	-174.3	-4.3	106.4
5	T	37.8	Very low	36.1	Very low	119 Å²	119	148.3 Å²	148.3	73%	0.73	73%	0.732	S	S	*	*				51.5	138.8	114.5	54.2	0	0	0	0	116.2
6	C	36.8	Very low	36	Very low	92 Å²	92	147.6 Å²	147.6	62%	0.622	73%	0.732	S	S	*	*			cis	-174	139.7	40.1	-121.9	0	0	0	0	108.4
7	E	36.4	Very low	36.2	Very low	146 Å²	146	146.6 Å²	146.6	68%	0.682	74%	0.736	S	S	*	*				89.6	115.4	108.2	-84.1	-177.6	144	0	0	116.1
8	R	34.7	Very low	36.5	Very low	209 Å²	209	145.6 Å²	145.6	79%	0.789	74%	0.742	S	S	*	*				74.3	135.7	98.6	-82.5	-174.3	165.6	173.2	-6.8	112
9	T	37.5	Very low	36.6	Very low	114 Å²	114	141.5 Å²	141.5	70%	0.699	74%	0.739	S	S	*	*			cis	-179.5	153.1	31.7	4.8	0	0	0	0	109.6
10	S	36	Very low	36.7	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	74%	0.741	S	S	*	*			trans	63.8	142.8	145.3	53.7	0	0	0	0	119.7
11	K	37.5	Very low	36.7	Very low	184 Å²	184	143.5 Å²	143.5	80%	0.8	74%	0.736	S	S	*	*			cis	-175.7	139.2	31	-126.4	164.1	-173.3	-173.6	0	109.1
12	S	34.9	Very low	36.8	Very low	89 Å²	89	138.8 Å²	138.8	62%	0.622	72%	0.715	S	S	*	*			trans	39.3	144.4	133.2	61.9	0	0	0	0	121.1
13	Q	37.2	Very low	36.7	Very low	142 Å²	142	132 Å²	132	66%	0.664	70%	0.701	S	S	*	*			cis	178.7	153.4	36.9	-134.7	171.3	-38.6	0	0	108.6
14	E	35.2	Very low	36.8	Very low	156 Å²	156	133.1 Å²	133.1	73%	0.729	71%	0.708	S	S	*	*			trans	58.1	150	142.8	-77	159.4	-163	0	0	120.9
15	S	34.5	Very low	36.6	Very low	87 Å²	87	130.5 Å²	130.5	61%	0.608	71%	0.708	S	S	*	*			cis	-178.2	167.7	-6	51.2	0	0	0	0	108.1
16	N	35.6	Very low	36.7	Very low	137 Å²	137	131 Å²	131	73%	0.733	71%	0.711	S	S	*	*			trans	95.5	92	150.1	-62	-18.4	0	0	0	122.6
17	T	38.3	Very low	36.4	Very low	130 Å²	130	133.3 Å²	133.3	80%	0.798	72%	0.717	S	S	*	*				53.4	157.5	110	40.4	0	0	0	0	124.7
18	P	43	Very low	36.4	Very low	129 Å²	129	134.3 Å²	134.3	84%	0.838	72%	0.721	S	S	*	*			trans	-126.2	-174.2	-142.9	45.3	-30.1	0	0	0	116
19	G	38.6	Very low	36.2	Very low	68 Å²	68	129.9 Å²	129.9	70%	0.701	72%	0.717	S	S	*	*			trans	165	157.5	164.8	0	0	0	0	0	111.1
20	K	38.3	Very low	36.1	Very low	176 Å²	176	130.2 Å²	130.2	77%	0.765	72%	0.724	S	S	*	*			cis	174.2	160.1	3.6	-140	166.9	169.7	-172.2	0	107.6
21	F	35.2	Very low	35.8	Very low	148 Å²	148	130 Å²	130	65%	0.649	72%	0.723	S	S	*	*			trans	82.9	110.4	153.6	-73.5	-70.8	0	0	0	119.9
22	L	35.5	Very low	35.5	Very low	144 Å²	144	126.3 Å²	126.3	75%	0.754	72%	0.719	S	S	*	*				81.4	149.8	87.3	-107.4	75	0	0	0	112.5
23	S	32.4	Very low	35.3	Very low	74 Å²	74	128.2 Å²	128.2	52%	0.517	72%	0.723	S	S	.	*			cis	176	173.1	-19.6	45.7	0	0	0	0	106
24	H	38.5	Very low	35.3	Very low	162 Å²	162	129.5 Å²	129.5	75%	0.75	73%	0.728	S	S	*	*			trans	89.3	144.6	168.9	-60.8	-61.2	0	0	0	117.1
25	D	35.7	Very low	35	Very low	132 Å²	132	132.3 Å²	132.3	71%	0.706	73%	0.732	S	S	*	*			cis	174.1	160.1	-30.6	-109.8	-34.7	0	0	0	105.1
26	V	39.1	Very low	35	Very low	129 Å²	129	135.9 Å²	135.9	78%	0.782	74%	0.744	S	S	*	*			trans	86.9	119	156.2	-150.4	0	0	0	0	120.4
27	N	29.9	Very low	34.9	Very low	142 Å²	142	135 Å²	135	76%	0.759	75%	0.749	S	S	*	*			trans	-59.8	157.6	166.8	-63.2	-50.9	0	0	0	114.7
28	H	37.2	Very low	34.6	Very low	167 Å²	167	137.6 Å²	137.6	77%	0.773	75%	0.752	S	S	*	*				175.1	111.2	122.6	-95.5	-66.4	0	0	0	112.9
29	T	30	Very low	34.1	Very low	115 Å²	115	139.1 Å²	139.1	71%	0.706	75%	0.753	S	S	*	*				36.7	138.7	130	50.3	0	0	0	0	123.8
30	S	34.7	Very low	33.7	Very low	121 Å²	121	144 Å²	144	85%	0.846	76%	0.757	S	S	*	*			trans	83.6	143.1	154.2	88.8	0	0	0	0	115.4
31	S	31	Very low	33.6	Very low	98 Å²	98	141.4 Å²	141.4	69%	0.685	76%	0.757	S	S	*	*			cis	178	151.4	-2.6	171.1	0	0	0	0	106
32	C	31.8	Very low	33.1	Very low	107 Å²	107	141.4 Å²	141.4	72%	0.723	76%	0.764	S	S	*	*			trans	68.6	149.4	162.7	-64.7	0	0	0	0	117.4
33	D	30.2	Very low	32.9	Very low	129 Å²	129	143 Å²	143	69%	0.69	77%	0.767	S	S	*	*			cis	178.4	166.2	-23.2	-110.9	-45	0	0	0	104.1
34	H	36.2	Very low	32.5	Very low	169 Å²	169	148.6 Å²	148.6	78%	0.782	78%	0.782	S	S	*	*			trans	104.5	90.5	-179.7	-65.8	-62.4	0	0	0	113.5
35	R	29.4	Very low	32	Very low	215 Å²	215	148 Å²	148	81%	0.811	79%	0.789	S	S	*	*				74.3	119.7	66.6	-70.6	-169.1	-177.2	-173.9	0.3	112.8
36	D	34.7	Very low	31.6	Very low	161 Å²	161	147.9 Å²	147.9	86%	0.861	79%	0.788	S	S	*	*			trans	147.9	123.6	150.2	-73.5	-13.4	0	0	0	106.4
37	S	34.1	Very low	31	Very low	118 Å²	118	147 Å²	147	83%	0.825	78%	0.782	S	S	*	*			cis	-163.6	144.5	8.1	44.8	0	0	0	0	109.6
38	E	31.7	Very low	31	Very low	186 Å²	186	148.5 Å²	148.5	87%	0.869	79%	0.789	S	S	*	*			trans	-55.5	149.9	179.4	-67.8	158.4	175.5	0	0	115.2
39	D	32.1	Very low	30.6	Very low	161 Å²	161	148.8 Å²	148.8	86%	0.861	79%	0.788	S	S	*	*			trans	-153.1	88.9	132.8	-111	-16.8	0	0	0	109.8
40	E	30.6	Very low	30.7	Very low	169 Å²	169	150.2 Å²	150.2	79%	0.79	79%	0.792	S	S	*	*			trans	-74.1	128.7	155.5	-83.5	-173.2	145.8	0	0	108.6
41	T	34.8	Very low	30.6	Very low	123 Å²	123	149.8 Å²	149.8	76%	0.755	78%	0.78	S	S	*	*			trans	-118.6	95.2	160.4	38.7	0	0	0	0	110	E43	T41-E43 PolarHBondContact O-N 3.29Å
42	N	26.2	Very low	30.6	Very low	148 Å²	148	152.2 Å²	152.2	79%	0.791	79%	0.785	S	S	*	*			trans	-62.4	113	149.7	-80.6	-55	0	0	0	108.6
43	E	30.2	Very low	30.5	Very low	176 Å²	176	154 Å²	154	82%	0.822	79%	0.786	S	S	*	*			trans	-131.5	118.3	164.1	-86.2	-166.7	150.8	0	0	113	T41	T41-E43 PolarHBondContact O-N 3.29Å
44	K	25.3	Very low	30.6	Very low	193 Å²	193	157.2 Å²	157.2	84%	0.839	80%	0.797	S	S	*	*			trans	-61.3	135.9	166.6	-68.7	166.9	174.1	171.6	0	110
45	V	28.1	Very low	30.2	Very low	148 Å²	148	155.3 Å²	155.3	90%	0.897	79%	0.792	S	S	*	*			trans	-131	133	154.2	-177.2	0	0	0	0	110.2
46	I	27.2	Very low	30.2	Very low	131 Å²	131	156.7 Å²	156.7	67%	0.672	80%	0.799	S	S	*	*			trans	-113.2	128.8	-162.4	-77.4	170.8	0	0	0	108
47	V	26.4	Very low	29.8	Very low	111 Å²	111	157.6 Å²	157.6	67%	0.673	80%	0.796	S	S	*	*			trans	63	127.7	140.4	-173.6	0	0	0	0	117.8
48	L	30.1	Very low	29.7	Very low	173 Å²	173	160.2 Å²	160.2	91%	0.906	80%	0.799	S	S	*	*				-158.7	142.1	89	-84.9	163.5	0	0	0	114
49	K	28.5	Very low	29.7	Very low	172 Å²	172	158.1 Å²	158.1	75%	0.748	79%	0.794	S	S	*	*			trans	-70.8	150.1	-173.6	-71.7	172.6	170.2	174.9	0	115.3
50	N	31.7	Very low	29.4	Very low	145 Å²	145	159.5 Å²	159.5	78%	0.775	80%	0.795	S	S	*	*				175.3	138.8	109.9	-90	-11.2	0	0	0	108.9
51	N	32	Very low	29.5	Very low	112 Å²	112	158.4 Å²	158.4	60%	0.599	80%	0.799	S	S	*	*			cis	-171.5	150.5	-24	-103.5	-11.4	0	0	0	104.7
52	N	32.3	Very low	29.2	Very low	150 Å²	150	162 Å²	162	80%	0.802	80%	0.804	S	S	*	*			trans	83.3	86.9	170.3	-46.7	-16.5	0	0	0	114.8
53	I	29.7	Very low	29.3	Very low	145 Å²	145	159.6 Å²	159.6	74%	0.744	81%	0.805	S	S	*	*				54.5	109.4	56.3	-52.8	-179.9	0	0	0	113.9
54	E	32.4	Very low	29.3	Very low	195 Å²	195	158.2 Å²	158.2	91%	0.911	81%	0.809	S	S	*	*				-156.6	126.9	113.7	-99.5	179.1	-162.5	0	0	110.6
55	D	26.4	Very low	29.4	Very low	129 Å²	129	156.1 Å²	156.1	69%	0.69	81%	0.807	S	S	*	*			trans	-84.7	150.2	-169.7	-77.6	-48.9	0	0	0	113.8
56	Y	30.6	Very low	29.7	Very low	244 Å²	244	159.3 Å²	159.3	96%	0.957	81%	0.808	S	S	*	*			trans	-142	120	141.3	-82.9	-81.3	0	0	0	110.2
57	K	26.6	Very low	29.9	Very low	181 Å²	181	160.4 Å²	160.4	79%	0.787	82%	0.816	S	S	*	*			trans	-94.5	139.1	173.9	-82.4	177.7	172.3	176.6	0	110.3
58	I	32	Very low	30.3	Very low	172 Å²	172	159.8 Å²	159.8	88%	0.882	81%	0.814	S	S	*	*			trans	-144.6	145.1	142.4	-59.8	-172.3	0	0	0	110
59	N	30.2	Very low	30.3	Very low	143 Å²	143	161.7 Å²	161.7	77%	0.765	82%	0.815	S	S	*	*			trans	-84	156.6	-161.8	-59	-50.6	0	0	0	116.2
60	E	26.3	Very low	30.4	Very low	190 Å²	190	156.7 Å²	156.7	89%	0.888	81%	0.812	S	S	*	*			trans	-66.1	141.7	165.4	-72	178.3	134.3	0	0	113.6
61	V	31.7	Very low	30.3	Very low	146 Å²	146	155 Å²	155	89%	0.885	81%	0.812	S	S	*	*			trans	-135.7	136.2	153.8	179.8	0	0	0	0	110.3
62	K	29.8	Very low	30.2	Very low	197 Å²	197	157.2 Å²	157.2	86%	0.857	82%	0.819	S	S	*	*			trans	-75.4	153.8	-173.4	-67.8	172.9	176.7	174.3	0	114.2
63	A	27.6	Very low	29.9	Very low	98 Å²	98	158.2 Å²	158.2	81%	0.81	82%	0.816	S	S	*	*			trans	-66.1	149.2	-177.7	0	0	0	0	0	116.9
64	V	30.4	Very low	29.7	Very low	148 Å²	148	156.6 Å²	156.6	90%	0.897	82%	0.817	S	S	*	*			trans	-145.2	130.2	149.6	179.6	0	0	0	0	110.7
65	N	28.4	Very low	29.4	Very low	149 Å²	149	153.4 Å²	153.4	80%	0.797	81%	0.81	S	S	*	*			trans	-59.6	143.8	173.8	-87.7	-35.1	0	0	0	114.9
66	K	33.4	Very low	29.4	Very low	214 Å²	214	151.8 Å²	151.8	93%	0.93	81%	0.809	S	S	*	*				178.4	145.8	123.2	-95.6	165.6	-175.6	-178.4	0	112.7
67	N	31	Very low	29.2	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	81%	0.806	S	S	*	*			trans	-94	-176.6	-169.3	-129.5	12.6	0	0	0	111.2
68	P	36.1	Very low	29.2	Very low	97 Å²	97	144 Å²	144	63%	0.63	80%	0.803	S	S	*	*				-125.9	-171.2	-81	35	-13.3	0	0	0	113.2
69	F	30.4	Very low	29.1	Very low	213 Å²	213	143.9 Å²	143.9	93%	0.934	80%	0.804	S	S	*	*			trans	114.1	128.2	166.9	-83.6	-90.4	0	0	0	117.4
70	G	30	Very low	29	Very low	67 Å²	67	145.7 Å²	145.7	69%	0.691	81%	0.808	S	S	*	*			trans	115.3	95.7	144.2	0	0	0	0	0	118.8
71	S	29.8	Very low	29	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	79%	0.79	S	S	*	*			trans	50.4	120.5	139.6	59.3	0	0	0	0	122.9
72	E	29.5	Very low	28.8	Very low	158 Å²	158	144.4 Å²	144.4	74%	0.738	79%	0.79	S	S	*	*			trans	64.5	114	137	-71.4	-164.3	118.2	0	0	122.6
73	K	26.2	Very low	28.7	Very low	170 Å²	170	143.1 Å²	143.1	74%	0.739	79%	0.785	S	S	*	*			trans	76.7	119	132.8	-77.3	175.2	-177.4	137.9	0	120.4
74	C	24.4	Very low	28.8	Very low	112 Å²	112	145.1 Å²	145.1	76%	0.757	78%	0.781	S	S	*	*			trans	103.3	109.3	135.1	-74	0	0	0	0	119.1
75	V	27.4	Very low	28.7	Very low	127 Å²	127	144.4 Å²	144.4	77%	0.77	77%	0.77	S	S	*	*			trans	103.6	103.3	132.4	-179.5	0	0	0	0	118.2
76	S	25.7	Very low	28.5	Very low	96 Å²	96	141.9 Å²	141.9	67%	0.671	76%	0.762	S	S	*	*			trans	50	120.4	141.1	69.1	0	0	0	0	122
77	E	27.2	Very low	28.4	Very low	192 Å²	192	137 Å²	137	90%	0.897	75%	0.752	S	S	*	*				170.3	138.8	99.8	-93.2	-178.5	159.6	0	0	111.6
78	G	26.4	Very low	28.2	Very low	69 Å²	69	135.2 Å²	135.2	71%	0.711	75%	0.747	S	S	*	*			trans	79.1	96.3	151.3	0	0	0	0	0	119.3
79	D	30	Very low	27.8	Very low	169 Å²	169	134.1 Å²	134.1	90%	0.904	75%	0.753	S	S	*	*			trans	-158.1	134.9	143.2	-101.9	-22.6	0	0	0	111.8	S81	D79-S81 PolarHBondContact O-N 3.45Å
80	E	26.7	Very low	27.7	Very low	182 Å²	182	132 Å²	132	85%	0.85	75%	0.75	S	S	*	*			trans	-63.2	110.2	-166.7	-64.7	-177.1	144.3	0	0	114
81	S	27.2	Very low	27.6	Very low	75 Å²	75	136.8 Å²	136.8	52%	0.524	76%	0.76	S	S	.	*			trans	-88.1	105.3	171.7	54.8	0	0	0	0	111.3	D79 F83	D79-S81 PolarHBondContact O-N 3.45Å; S81-F83 VanDerWaalsContact O-CD2 3.28Å; S81-F83 WeakPolarHBondContact O-CD2 3.44Å; S81-F83 PolarHBondContact O-N 3.4Å; S81-F83 WeakPolarHBondContact OG-CE2 3.37Å
82	W	27.7	Very low	27.3	Very low	234 Å²	234	134.8 Å²	134.8	89%	0.886	76%	0.757	S	S	*	*			trans	-70.3	97.6	160.9	-81.5	41.5	0	0	0	108.7	I84	W82-I84 PolarHBondContact O-N 3Å
83	F	27.6	Very low	27.2	Very low	169 Å²	169	133.4 Å²	133.4	74%	0.741	76%	0.762	S	S	*	*			trans	-64.5	110.7	176.7	-76.2	-87.2	0	0	0	110.9	S81 I85	S81-F83 VanDerWaalsContact O-CD2 3.28Å; S81-F83 WeakPolarHBondContact O-CD2 3.44Å; S81-F83 PolarHBondContact O-N 3.4Å; S81-F83 WeakPolarHBondContact OG-CE2 3.37Å; F83-I85 PolarHBondContact O-N 3.09Å
84	I	29.6	Very low	27.1	Very low	140 Å²	140	131.9 Å²	131.9	72%	0.718	77%	0.771	S	S	*	*			trans	-68.5	106.3	155.2	-62.5	175.6	0	0	0	105.7	W82 P86	W82-I84 PolarHBondContact O-N 3Å; I84-P86 WeakPolarHBondContact O-CD 3.49Å
85	I	27.6	Very low	27.4	Very low	133 Å²	133	131.9 Å²	131.9	68%	0.682	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-63.5	118.9	178.8	-59.1	170.2	0	0	0	107.8	F83	F83-I85 PolarHBondContact O-N 3.09Å
86	P	24.2	Very low	27.3	Very low	96 Å²	96	134.5 Å²	134.5	62%	0.623	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-70	143.2	177.5	29.3	-32.2	0	0	0	109.7	I84 T88	I84-P86 WeakPolarHBondContact O-CD 3.49Å; P86-T88 PolarHBondContact O-N 2.92Å
87	P	32.5	Very low	27.4	Very low	111 Å²	111	135.8 Å²	135.8	72%	0.721	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.5	126.7	166.4	27.7	-29.5	0	0	0	108.8
88	T	27.1	Very low	27.4	Very low	118 Å²	118	133.8 Å²	133.8	72%	0.724	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67	130.8	178	39.6	0	0	0	0	112.2	P86	P86-T88 PolarHBondContact O-N 2.92Å
89	G	27.3	Very low	27.5	Very low	74 Å²	74	138.1 Å²	138.1	76%	0.763	77%	0.773	S	S	*	*			trans	85	137	155.5	0	0	0	0	0	117.7
90	I	27.8	Very low	27.4	Very low	168 Å²	168	134.2 Å²	134.2	86%	0.862	76%	0.759	S	S	*	*			cis	-156.4	135.3	5.3	-76.7	170	0	0	0	106.3
91	D	27.1	Very low	27.6	Very low	169 Å²	169	129 Å²	129	90%	0.904	74%	0.74	S	S	*	*			trans	-82	142	166.5	-73	-53	0	0	0	111.7
92	G	24.6	Very low	27.8	Very low	69 Å²	69	133.8 Å²	133.8	71%	0.711	75%	0.747	S	S	*	*			trans	-176.2	146.2	170.8	0	0	0	0	0	112.1
93	P	26.5	Very low	28.3	Very low	129 Å²	129	123.5 Å²	123.5	84%	0.838	71%	0.711	S	S	*	*			trans	-88.2	159.3	-131.9	33.4	-36.4	0	0	0	117
94	C	25.5	Very low	29.2	Very low	137 Å²	137	118 Å²	118	93%	0.926	69%	0.694	S	S	*	*			trans	-25.2	124.3	165.2	-92.6	0	0	0	0	116
95	S	29	Very low	30.2	Very low	113 Å²	113	111.8 Å²	111.8	79%	0.79	66%	0.662	S	S	*	*			trans	-125.6	120.8	151.1	66.5	0	0	0	0	109.6	N97	S95-N97 PolarHBondContact O-N 3.25Å
96	Q	25.5	Very low	31.1	Very low	182 Å²	182	105.6 Å²	105.6	85%	0.85	63%	0.63	S	S	*	*			trans	-55.1	117.1	175.9	-65.8	168.2	-18.3	0	0	110.2
97	N	29.4	Very low	32.2	Very low	123 Å²	123	103.8 Å²	103.8	66%	0.658	62%	0.62	S	S	*	*			trans	-127.3	92.8	155.9	-146.5	-5.3	0	0	0	108.2	S95 N99	S95-N97 PolarHBondContact O-N 3.25Å; N97-N99 PolarHBondContact O-N 3.23Å
98	Q	26.4	Very low	33	Very low	150 Å²	150	99.2 Å²	99.2	70%	0.701	59%	0.59	S	S	*	*			trans	-72	113.8	169.7	-60.9	-173.9	9.1	0	0	106.5
99	N	27.4	Very low	34	Very low	159 Å²	159	93.7 Å²	93.7	85%	0.85	56%	0.556	S	S	*	*	S	Bend	trans	145	59.8	157.1	-70.5	-20.7	0	0	0	112.9	N97	N97-N99 PolarHBondContact O-N 3.23Å
100	S	28.9	Very low	34.7	Very low	88 Å²	88	91.1 Å²	91.1	62%	0.615	53%	0.526	S	S	*	.			trans	-157.2	0.1	158.9	71.3	0	0	0	0	116	Y102	S100-Y102 PolarHBondContact O-N 3.25Å; S100-Y102 VanDerWaalsContact O-N 3.09Å
101	T	30.5	Very low	35.2	Very low	73 Å²	73	88.1 Å²	88.1	45%	0.448	51%	0.511	S	S	.	.			trans	-82.1	27.3	178.4	14.4	0	0	0	0	113.6	S103 K423	T101-S103 PolarHBondContact O-N 3.35Å; T101-K423 HydrophobicContact CG2-CD 4.43Å; T101-K423 PolarHBondContact OG1-NZ 3.13Å
102	Y	31.3	Very low	35.7	Very low	174 Å²	174	82.5 Å²	82.5	68%	0.682	48%	0.479	S	S	*	.			trans	-66.2	101	-177.3	-149.1	-101.6	0	0	0	111	S100 P378	S100-Y102 PolarHBondContact O-N 3.25Å; S100-Y102 VanDerWaalsContact O-N 3.09Å; Y102-P378 HydrophobicContact CE1-CB 4.38Å; Y102-P378 HydrophobicContact CE1-CG 3.61Å; Y102-P378 WeakPolarHBondContact OH-CB 3.43Å; Y102-P378 WeakPolarHBondContact OH-CG 3.17Å
103	S	39.7	Very low	36.3	Very low	18 Å²	18	82.2 Å²	82.2	13%	0.126	46%	0.464	C	S	.	.			trans	78.5	32.6	140.7	-62.6	0	0	0	0	119.8	T101 S106 S107	T101-S103 PolarHBondContact O-N 3.35Å; S103-S106 WeakPolarHBondContact CA-OG 3.32Å; S103-S106 WeakPolarHBondContact CB-OG 2.95Å; S103-S106 PolarHBondContact O-OG 2.84Å; S103-S106 PolarHBondContact OG-OG 3.35Å; S103-S107 WeakPolarHBondContact O-CB 3.42Å; S103-S107 PolarHBondContact O-N 3.26Å; S103-S107 PolarHBondContact O-OG 2.97Å
104	S	45.6	Very low	36.9	Very low	54 Å²	54	79.7 Å²	79.7	38%	0.378	45%	0.449	S	S	.	.	H	α-helix	trans	-66.7	-44.4	174.2	-43	0	0	0	0	111.5	S107 I108 H324	S104-S107 PolarHBondContact O-OG 3.43Å; S104-I108 VanDerWaalsContact O-CD1 3.27Å; S104-I108 WeakPolarHBondContact O-CD1 3.36Å; S104-I108 VanDerWaalsContact O-CG1 3.22Å; S104-I108 WeakPolarHBondContact O-CG1 3.39Å; S104-I108 PolarHBondContact O-N 3.42Å; S104-H324 WeakPolarHBondContact CB-CE1 3.47Å; S104-H324 WeakPolarHBondContact CB-NE2 3.41Å; S104-H324 PolarHBondContact O-CE1 2.88Å
105	I	49.8	Very low	37.2	Very low	10 Å²	10	80 Å²	80	5%	0.051	44%	0.439	C	S	.	.	H	α-helix	trans	-79.3	-36.8	-179.3	-63	163.3	0	0	0	111.2	S107 I108 V109 I320 L369 F422	I105-S107 VanDerWaalsContact C-N 3.35Å; I105-S107 PolarHBondContact O-N 2.91Å; I105-I108 WeakPolarHBondContact O-CB 3.1Å; I105-I108 PolarHBondContact O-N 2.93Å; I105-V109 PolarHBondContact O-N 3.46Å; I105-I320 HydrophobicContact CD1-CG2 3.32Å; I105-I320 HydrophobicContact CG1-CG2 4.44Å; I105-L369 HydrophobicContact CG2-CD1 4.12Å; I105-F422 HydrophobicContact CD1-CB 3.87Å
106	S	46.3	Very low	37.3	Very low	2 Å²	2	78.3 Å²	78.3	1%	0.014	43%	0.427	C	S	.	.	H	α-helix	trans	-68.8	-32.2	177.2	53.8	0	0	0	0	112	S103 S110	S103-S106 WeakPolarHBondContact CA-OG 3.32Å; S103-S106 WeakPolarHBondContact CB-OG 2.95Å; S103-S106 PolarHBondContact O-OG 2.84Å; S103-S106 PolarHBondContact OG-OG 3.35Å; S106-S110 PolarHBondContact O-N 3.43Å; S106-S110 VanDerWaalsContact O-N 3.1Å; S106-S110 PolarHBondContact O-OG 3.5Å
107	S	48.1	Very low	37.5	Very low	59 Å²	59	77 Å²	77	41%	0.413	42%	0.42	S	S	.	.	H	α-helix	trans	-67	-42	171	65.3	0	0	0	0	112.3	S103 S104 I105 V109 S110 D111	S103-S107 WeakPolarHBondContact O-CB 3.42Å; S103-S107 PolarHBondContact O-N 3.26Å; S103-S107 PolarHBondContact O-OG 2.97Å; S104-S107 PolarHBondContact O-OG 3.43Å; I105-S107 VanDerWaalsContact C-N 3.35Å; I105-S107 PolarHBondContact O-N 2.91Å; S107-V109 VanDerWaalsContact C-N 3.34Å; S107-V109 PolarHBondContact O-N 3.14Å; S107-S110 VanDerWaalsContact O-CB 3.26Å; S107-S110 WeakPolarHBondContact O-CB 3.23Å; S107-S110 PolarHBondContact O-N 2.84Å; S107-S110 VanDerWaalsContact O-N 3.16Å; S107-D111 PolarHBondContact O-N 3.46Å
108	I	48.3	Very low	37.4	Very low	15 Å²	15	75.8 Å²	75.8	8%	0.077	42%	0.422	C	S	.	.	H	α-helix	trans	-53.3	-49.1	178	-84.2	167.1	0	0	0	112.3	S104 I105 H324 P325 I332	S104-I108 VanDerWaalsContact O-CD1 3.27Å; S104-I108 WeakPolarHBondContact O-CD1 3.36Å; S104-I108 VanDerWaalsContact O-CG1 3.22Å; S104-I108 WeakPolarHBondContact O-CG1 3.39Å; S104-I108 PolarHBondContact O-N 3.42Å; I105-I108 WeakPolarHBondContact O-CB 3.1Å; I105-I108 PolarHBondContact O-N 2.93Å; I108-H324 WeakPolarHBondContact CD1-CE1 3.43Å; I108-H324 WeakPolarHBondContact CD1-NE2 3.19Å; I108-P325 WeakPolarHBondContact CD1-O 3.47Å; I108-I332 HydrophobicContact CG2-CD1 4.11Å
109	V	48.3	Very low	37.7	Very low	2 Å²	2	76 Å²	76	1%	0.012	43%	0.433	C	S	.	.	H	α-helix	trans	-88	-12.4	-175.3	-170.7	0	0	0	0	110.9	I105 S107 F112 T113 I332 L369 L370 T373	I105-V109 PolarHBondContact O-N 3.46Å; S107-V109 VanDerWaalsContact C-N 3.34Å; S107-V109 PolarHBondContact O-N 3.14Å; V109-F112 HydrophobicContact CG1-CB 4.34Å; V109-F112 VanDerWaalsContact O-CB 3.32Å; V109-F112 WeakPolarHBondContact O-CB 3.36Å; V109-F112 PolarHBondContact O-N 3.17Å; V109-T113 PolarHBondContact O-N 3.32Å; V109-I332 HydrophobicContact CG2-CD1 4.49Å; V109-L369 HydrophobicContact CG2-CD1 4.19Å; V109-L369 HydrophobicContact CG2-CD2 4.26Å; V109-L369 HydrophobicContact CG2-CG 4.01Å; V109-L370 HydrophobicContact CG1-CD2 4.1Å; V109-T373 HydrophobicContact CB-CG2 3.6Å; V109-T373 WeakPolarHBondContact CB-OG1 3.46Å; V109-T373 HydrophobicContact CG1-CG2 3.79Å; V109-T373 WeakPolarHBondContact CG1-OG1 3.45Å; V109-T373 WeakPolarHBondContact CG2-OG1 3.42Å
110	S	43	Very low	37.8	Very low	19 Å²	19	71.8 Å²	71.8	13%	0.133	43%	0.426	C	S	.	.	H	α-helix	trans	-60.4	-47.8	167.6	-57.3	0	0	0	0	110.9	S106 S107 F112 T113 S114 N377	S106-S110 PolarHBondContact O-N 3.43Å; S106-S110 VanDerWaalsContact O-N 3.1Å; S106-S110 PolarHBondContact O-OG 3.5Å; S107-S110 VanDerWaalsContact O-CB 3.26Å; S107-S110 WeakPolarHBondContact O-CB 3.23Å; S107-S110 PolarHBondContact O-N 2.84Å; S107-S110 VanDerWaalsContact O-N 3.16Å; S110-F112 PolarHBondContact O-N 3.37Å; S110-T113 PolarHBondContact O-N 2.7Å; S110-T113 VanDerWaalsContact O-N 3.08Å; S110-T113 PolarHBondContact O-OG1 2.89Å; S110-S114 PolarHBondContact O-N 2.97Å; S110-N377 PolarHBondContact OG-ND2 3.4Å
111	D	38.7	Very low	37.8	Very low	105 Å²	105	77.6 Å²	77.6	56%	0.561	44%	0.441	S	S	*	.	H	α-helix	trans	-62.9	-34.6	-177.3	-68.9	-15.9	0	0	0	110.9	S107 T113 S114 M115	S107-D111 PolarHBondContact O-N 3.46Å; D111-T113 VanDerWaalsContact C-N 3.33Å; D111-T113 PolarHBondContact O-N 3.4Å; D111-S114 PolarHBondContact O-N 3.42Å; D111-S114 VanDerWaalsContact O-N 3.12Å; D111-S114 PolarHBondContact O-OG 2.83Å; D111-M115 PolarHBondContact O-N 3.1Å
112	F	37.1	Very low	37.9	Very low	51 Å²	51	78.7 Å²	78.7	22%	0.224	45%	0.451	C	S	.	.	H	α-helix	trans	-54.2	-44.4	172.7	-178.7	-88.9	0	0	0	113	V109 S110 S114 Y366 L370	V109-F112 HydrophobicContact CG1-CB 4.34Å; V109-F112 VanDerWaalsContact O-CB 3.32Å; V109-F112 WeakPolarHBondContact O-CB 3.36Å; V109-F112 PolarHBondContact O-N 3.17Å; S110-F112 PolarHBondContact O-N 3.37Å; F112-S114 VanDerWaalsContact C-N 3.27Å; F112-S114 PolarHBondContact O-N 2.69Å; F112-Y366 HydrophobicContact CE1-CE1 4.48Å; F112-Y366 VanDerWaalsContact CE1-OH 3.31Å; F112-Y366 WeakPolarHBondContact CE1-OH 3.23Å; F112-Y366 WeakPolarHBondContact CE2-OH 3.42Å; F112-Y366 HydrophobicContact CZ-CE1 4.32Å; F112-Y366 AromaticContact CZ-CZ 3.87Å; F112-Y366 WeakPolarHBondContact CZ-OH 3.2Å; F112-L370 HydrophobicContact CD1-CD2 4.16Å; F112-L370 HydrophobicContact CE1-CD2 4.22Å
113	T	38.1	Very low	37.8	Very low	63 Å²	63	77.2 Å²	77.2	39%	0.387	46%	0.46	S	S	.	.	H	α-helix	trans	-72.9	-19.5	-178.8	63.7	0	0	0	0	113.7	V109 S110 D111 S116	V109-T113 PolarHBondContact O-N 3.32Å; S110-T113 PolarHBondContact O-N 2.7Å; S110-T113 VanDerWaalsContact O-N 3.08Å; S110-T113 PolarHBondContact O-OG1 2.89Å; D111-T113 VanDerWaalsContact C-N 3.33Å; D111-T113 PolarHBondContact O-N 3.4Å; T113-S116 PolarHBondContact O-OG 3.07Å
114	S	37.4	Very low	37.2	Very low	77 Å²	77	79 Å²	79	54%	0.538	48%	0.482	S	S	.	.	H	α-helix	trans	-88.6	-22.1	-178.3	75.7	0	0	0	0	114	S110 D111 F112	S110-S114 PolarHBondContact O-N 2.97Å; D111-S114 PolarHBondContact O-N 3.42Å; D111-S114 VanDerWaalsContact O-N 3.12Å; D111-S114 PolarHBondContact O-OG 2.83Å; F112-S114 VanDerWaalsContact C-N 3.27Å; F112-S114 PolarHBondContact O-N 2.69Å
115	M	32.2	Very low	36.3	Very low	144 Å²	144	82.1 Å²	82.1	71%	0.709	50%	0.504	S	S	*	.			trans	-95.3	4	-174.6	-72.2	-151.5	74	0	0	115.2	D111 H117	D111-M115 PolarHBondContact O-N 3.1Å; M115-H117 PolarHBondContact O-N 3.47Å
116	S	31.9	Very low	35.4	Very low	76 Å²	76	90.9 Å²	90.9	53%	0.531	54%	0.544	S	S	.	.			trans	-70.9	18.5	178.5	46.7	0	0	0	0	115	T113	T113-S116 PolarHBondContact O-OG 3.07Å
117	H	28.7	Very low	34.5	Very low	155 Å²	155	98.7 Å²	98.7	72%	0.718	58%	0.578	S	S	*	*	S	Bend	trans	-121.9	40.9	-175.8	-69.8	-45.6	0	0	0	114.9	M115	M115-H117 PolarHBondContact O-N 3.47Å
118	S	27.2	Very low	33.6	Very low	98 Å²	98	100.7 Å²	100.7	69%	0.685	59%	0.592	S	S	*	*			trans	-176.7	88	161.6	52.6	0	0	0	0	114.8
119	V	33.1	Very low	33	Very low	155 Å²	155	103.9 Å²	103.9	94%	0.939	61%	0.609	S	S	*	*			trans	-150.5	129.7	147.5	-172.4	0	0	0	0	110.5
120	G	30	Very low	32.4	Very low	69 Å²	69	110.2 Å²	110.2	71%	0.711	64%	0.64	S	S	*	*			trans	-79.8	171.4	-174.8	0	0	0	0	0	116
121	K	28.3	Very low	32	Very low	210 Å²	210	116.9 Å²	116.9	91%	0.913	67%	0.674	S	S	*	*			trans	-62.8	128.9	-173	-60.4	168.8	178.7	176.2	0	113.3
122	S	32.1	Very low	31.7	Very low	96 Å²	96	116.9 Å²	116.9	67%	0.671	68%	0.678	S	S	*	*			trans	-158.5	169.5	144.7	62.5	0	0	0	0	111.2	K127	S122-K127 PolarHBondContact O-NZ 2.96Å
123	T	29.4	Very low	31.5	Very low	143 Å²	143	117 Å²	117	88%	0.877	68%	0.678	S	S	*	*			trans	-94.1	141.9	-147.6	46.5	0	0	0	0	113.4
124	G	27.7	Very low	31.3	Very low	56 Å²	56	118.5 Å²	118.5	58%	0.577	68%	0.678	S	S	*	*			trans	153.9	119.1	174.2	0	0	0	0	0	110.8	H126	G124-H126 PolarHBondContact O-N 3.22Å
125	S	27.4	Very low	31	Very low	120 Å²	120	120.5 Å²	120.5	84%	0.839	69%	0.687	S	S	*	*	S	Bend	trans	-58	110.2	-178.9	-170.7	0	0	0	0	110.6
126	H	30.2	Very low	30.8	Very low	194 Å²	194	117.9 Å²	117.9	90%	0.898	68%	0.681	S	S	*	*			trans	166.4	57.1	163.2	-87.2	-70.1	0	0	0	108.3	G124	G124-H126 PolarHBondContact O-N 3.22Å
127	K	27.8	Very low	30.6	Very low	165 Å²	165	121 Å²	121	72%	0.717	70%	0.696	S	S	*	*			trans	-122.5	91.3	-174.6	-72.7	-173.7	-176.7	176.2	0	112.4	S122	S122-K127 PolarHBondContact O-NZ 2.96Å
128	S	29.2	Very low	30.5	Very low	101 Å²	101	121.1 Å²	121.1	71%	0.706	70%	0.699	S	S	*	*	S	Bend	trans	-175.9	102.5	151.4	-162.3	0	0	0	0	104.6
129	L	35.1	Very low	30.6	Very low	83 Å²	83	126.4 Å²	126.4	44%	0.435	71%	0.71	S	S	.	*	S	Bend		-169.1	-3.4	110	-86.7	161.3	0	0	0	112.1	N131 F133	L129-N131 VanDerWaalsContact C-N 3.34Å; L129-N131 PolarHBondContact O-N 3.33Å; L129-F133 WeakPolarHBondContact O-CD2 3.23Å; L129-F133 WeakPolarHBondContact O-CE2 3.01Å
130	M	36.1	Very low	30.3	Very low	134 Å²	134	130 Å²	130	66%	0.66	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-12.8	-176.4	-81.9	-82.6	171	0	0	114.6
131	N	33.7	Very low	30.3	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-3.1	-178.9	-97.6	18.4	0	0	0	114.4	L129	L129-N131 VanDerWaalsContact C-N 3.34Å; L129-N131 PolarHBondContact O-N 3.33Å
132	T	34	Very low	30.5	Very low	105 Å²	105	136.1 Å²	136.1	64%	0.644	71%	0.714	S	S	*	*	S	Bend	trans	-99.4	-10.6	-171.7	-26.3	0	0	0	0	113.1
133	F	32.4	Very low	30.2	Very low	53 Å²	53	143 Å²	143	23%	0.232	73%	0.726	C	S	.	*	S	Bend	trans	-95.9	104.3	178.1	-61.3	-80	0	0	0	109.3	L129 L370 N395	L129-F133 WeakPolarHBondContact O-CD2 3.23Å; L129-F133 WeakPolarHBondContact O-CE2 3.01Å; F133-L370 HydrophobicContact CB-CD1 4.23Å; F133-N395 HydrophobicContact CE1-CB 4.39Å; F133-N395 VanDerWaalsContact CE1-O 3.29Å; F133-N395 WeakPolarHBondContact CE1-O 3.44Å
134	Y	34.4	Very low	30.2	Very low	96 Å²	96	144.3 Å²	144.3	38%	0.376	73%	0.726	S	S	.	*			trans	76.7	85.6	177.1	-67.3	-93.3	0	0	0	117.8	D374 M387	Y134-D374 PolarHBondContact OH-OD1 2.99Å; Y134-M387 HydrophobicContact CE2-CE 4.4Å; Y134-M387 VanDerWaalsContact OH-CE 3.26Å; Y134-M387 WeakPolarHBondContact OH-CE 3.35Å
135	T	29.6	Very low	30.3	Very low	119 Å²	119	147.1 Å²	147.1	73%	0.73	73%	0.734	S	S	*	*			trans	-93.8	112.8	144.2	55.2	0	0	0	0	109.1	T137	T135-T137 PolarHBondContact O-N 2.94Å
136	P	28.5	Very low	30.2	Very low	89 Å²	89	149.2 Å²	149.2	58%	0.578	74%	0.735	S	S	*	*			trans	-73.5	113.2	169.3	-3.2	19.4	0	0	0	108.1	M138	P136-M138 VanDerWaalsContact C-N 3.33Å; P136-M138 PolarHBondContact O-N 3.17Å
137	T	27.2	Very low	30.2	Very low	140 Å²	140	145.7 Å²	145.7	86%	0.859	73%	0.729	S	S	*	*			trans	-69	90.1	168	50.1	0	0	0	0	109.3	T135	T135-T137 PolarHBondContact O-N 2.94Å
138	M	27.1	Very low	30.2	Very low	158 Å²	158	142.6 Å²	142.6	78%	0.778	73%	0.728	S	S	*	*			trans	-88.5	113.8	169.7	-75.9	-162.4	80.9	0	0	111.2	P136	P136-M138 VanDerWaalsContact C-N 3.33Å; P136-M138 PolarHBondContact O-N 3.17Å
139	K	29.7	Very low	30.3	Very low	210 Å²	210	147.4 Å²	147.4	91%	0.913	74%	0.739	S	S	*	*			trans	-83.4	104.5	149.7	-80.5	-177.4	178.2	175.2	0	108	R141	K139-R141 PolarHBondContact O-N 3.35Å
140	R	26.4	Very low	29.9	Very low	229 Å²	229	152.5 Å²	152.5	86%	0.864	76%	0.758	S	S	*	*			trans	-57.7	122.9	168	-81.8	-178.6	170.8	-177.4	-2.2	110.3
141	R	29.7	Very low	29.5	Very low	248 Å²	248	152.5 Å²	152.5	94%	0.936	76%	0.76	S	S	*	*			trans	-138.1	147.7	147.6	-88.9	-171.8	174.8	158.8	-2.7	110.1	K139	K139-R141 PolarHBondContact O-N 3.35Å
142	N	32.6	Very low	29.1	Very low	161 Å²	161	151.5 Å²	151.5	86%	0.861	76%	0.755	S	S	*	*			trans	-62.8	150.6	-151	-69.2	-27.6	0	0	0	117.3
143	R	25.8	Very low	28.9	Very low	241 Å²	241	152.3 Å²	152.3	91%	0.909	77%	0.765	S	S	*	*			trans	-57.1	140.8	160.1	-86.3	-171	175.6	-153.3	0.3	111.5
144	L	30	Very low	28.6	Very low	169 Å²	169	156.5 Å²	156.5	89%	0.885	80%	0.795	S	S	*	*			trans	-139.8	152.8	144	-78.7	175.4	0	0	0	109.6
145	P	29.1	Very low	28.5	Very low	115 Å²	115	157.7 Å²	157.7	75%	0.747	82%	0.817	S	S	*	*			trans	-88.9	164.5	-165.1	35.4	-33.1	0	0	0	114.5
146	I	26.3	Very low	28.6	Very low	165 Å²	165	157.5 Å²	157.5	85%	0.846	82%	0.821	S	S	*	*			trans	-54.7	144.6	-179.7	-57.6	159.6	0	0	0	112.2
147	P	29.2	Very low	28.7	Very low	119 Å²	119	156.6 Å²	156.6	77%	0.773	83%	0.828	S	S	*	*				-134.4	150	123.8	11.2	11.4	0	0	0	115
148	S	27.4	Very low	28.9	Very low	101 Å²	101	156 Å²	156	71%	0.706	83%	0.826	S	S	*	*			trans	-59.9	136	168.6	41.4	0	0	0	0	113.8
149	E	33.2	Very low	29.2	Very low	202 Å²	202	155 Å²	155	94%	0.944	83%	0.829	S	S	*	*			trans	-158	153.1	151.8	-113.6	168.4	-142.3	0	0	113
150	F	25.7	Very low	29.2	Very low	189 Å²	189	152 Å²	152	83%	0.829	82%	0.821	S	S	*	*			trans	-98	159.3	-157.9	-106	-96.3	0	0	0	111.9
151	L	27.3	Very low	29.5	Very low	135 Å²	135	151.7 Å²	151.7	71%	0.707	82%	0.821	S	S	*	*			trans	83.4	120.7	149.7	-65.1	158.9	0	0	0	120.9
152	N	26.1	Very low	29.6	Very low	137 Å²	137	148.7 Å²	148.7	73%	0.733	82%	0.815	S	S	*	*			trans	63.8	118.6	134.9	-61.6	-11.3	0	0	0	119.3
153	S	29.2	Very low	29.5	Very low	123 Å²	123	147 Å²	147	86%	0.86	81%	0.813	S	S	*	*				178.8	149.6	90.3	41.6	0	0	0	0	113
154	T	26.7	Very low	29.8	Very low	141 Å²	141	141.4 Å²	141.4	87%	0.865	81%	0.806	S	S	*	*			trans	-67.3	144.7	-172.2	-28.3	0	0	0	0	113.8
155	S	32.4	Very low	29.9	Very low	120 Å²	120	139.1 Å²	139.1	84%	0.839	80%	0.799	S	S	*	*			trans	-161.9	128.6	147.9	175.7	0	0	0	0	111.1
156	S	30.9	Very low	29.8	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	81%	0.805	S	S	*	*			trans	-87.4	154.4	-168.3	45.9	0	0	0	0	115.2
157	G	30.7	Very low	30.1	Very low	70 Å²	70	142.6 Å²	142.6	72%	0.722	81%	0.806	S	S	*	*			trans	-174.1	117.4	158	0	0	0	0	0	111.5
158	P	31.4	Very low	30.1	Very low	128 Å²	128	141.2 Å²	141.2	83%	0.831	80%	0.799	S	S	*	*			trans	-93.7	142.1	-176.7	34.9	-29.2	0	0	0	111.7
159	V	33.3	Very low	30.2	Very low	137 Å²	137	145.5 Å²	145.5	83%	0.83	81%	0.81	S	S	*	*			trans	-122.6	128.6	167.3	-179.2	0	0	0	0	110
160	I	30.5	Very low	30.2	Very low	146 Å²	146	142 Å²	142	75%	0.749	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74.1	133.7	-172.5	-66.7	159.8	0	0	0	110.8
161	Y	31.7	Very low	30.3	Very low	223 Å²	223	140.4 Å²	140.4	88%	0.875	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-102	127.4	162.2	-83.2	-87.9	0	0	0	109.9
162	K	31.9	Very low	30.4	Very low	185 Å²	185	141.4 Å²	141.4	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-92.8	139.5	166.6	-77	-178.3	174.9	179.5	0	109.6
163	P	30.8	Very low	30.5	Very low	127 Å²	127	145 Å²	145	83%	0.825	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-100.9	138.1	167.5	35.1	-25.5	0	0	0	110.9
164	T	32	Very low	30.6	Very low	122 Å²	122	143.6 Å²	143.6	75%	0.748	80%	0.801	S	S	*	*			trans	-130.1	104	177.3	-51.9	0	0	0	0	110.8
165	T	33	Very low	30.5	Very low	122 Å²	122	145.5 Å²	145.5	75%	0.748	80%	0.8	S	S	*	*			trans	51.8	102.4	139.2	60.5	0	0	0	0	121.9
166	R	27.1	Very low	30.4	Very low	227 Å²	227	147.3 Å²	147.3	86%	0.857	80%	0.8	S	S	*	*				2.5	128.4	126.5	-154	175.2	-174.8	-175.1	1.9	117.7
167	S	31.7	Very low	30.3	Very low	125 Å²	125	148.4 Å²	148.4	87%	0.874	80%	0.797	S	S	*	*			trans	-136.9	121.5	150.8	-68.9	0	0	0	0	108.7
168	S	28.4	Very low	30.1	Very low	91 Å²	91	155.3 Å²	155.3	64%	0.636	81%	0.807	S	S	*	*			trans	-73.5	139.3	178.8	-57.2	0	0	0	0	111.1
169	M	30.5	Very low	30.1	Very low	190 Å²	190	153.9 Å²	153.9	94%	0.936	80%	0.8	S	S	*	*			trans	-129.6	131.9	145.9	-75.7	-160	78.5	0	0	109.3
170	T	33.6	Very low	29.9	Very low	130 Å²	130	151.9 Å²	151.9	80%	0.798	79%	0.792	S	S	*	*			trans	-83	149.9	-167.2	28.6	0	0	0	0	113.6
171	N	27.8	Very low	29.9	Very low	154 Å²	154	152.2 Å²	152.2	82%	0.824	80%	0.795	S	S	*	*			trans	-10.5	134.8	157.6	-69.1	-13.1	0	0	0	118.4
172	M	29.5	Very low	29.8	Very low	156 Å²	156	149.8 Å²	149.8	77%	0.768	79%	0.792	S	S	*	*				-175.3	121.9	121.6	-73.8	-127.4	-88.5	0	0	104.1
173	Y	28.1	Very low	29.6	Very low	212 Å²	212	148.2 Å²	148.2	83%	0.831	79%	0.792	S	S	*	*				-160.2	141.1	72	-84.7	-88.4	0	0	0	111
174	S	29.7	Very low	29.7	Very low	95 Å²	95	143.8 Å²	143.8	66%	0.664	77%	0.765	S	S	*	*			trans	-72.7	152.4	171.5	45.2	0	0	0	0	113.3
175	E	26.5	Very low	29.8	Very low	181 Å²	181	140 Å²	140	85%	0.846	75%	0.75	S	S	*	*			trans	55.4	108.5	144	-67	177.4	167.6	0	0	118.4
176	L	29.9	Very low	30	Very low	157 Å²	157	139.9 Å²	139.9	82%	0.822	74%	0.744	S	S	*	*			trans	-162	119.2	136.9	-98.2	151.9	0	0	0	110.4
177	N	28.1	Very low	30.4	Very low	139 Å²	139	132.2 Å²	132.2	74%	0.743	73%	0.725	S	S	*	*			trans	81.9	97.8	146.2	-63.4	-12.7	0	0	0	121.6
178	K	26.6	Very low	30.8	Very low	214 Å²	214	129 Å²	129	93%	0.93	70%	0.702	S	S	*	*			trans	-38.3	125.6	132.3	-70.2	171.2	174.2	174	0	111.9
179	S	31.1	Very low	31.2	Very low	99 Å²	99	130 Å²	130	69%	0.692	70%	0.697	S	S	*	*			trans	-149	100.7	152.7	56.8	0	0	0	0	106.7
180	S	30.3	Very low	31.4	Very low	95 Å²	95	125.2 Å²	125.2	66%	0.664	68%	0.675	S	S	*	*				47.3	96.1	102.4	72.1	0	0	0	0	111.7
181	D	29.5	Very low	31.6	Very low	152 Å²	152	122.1 Å²	122.1	81%	0.813	66%	0.658	S	S	*	*				76.2	129.2	89	-72	-42.3	0	0	0	113.5
182	Q	28.9	Very low	32.1	Very low	172 Å²	172	118.3 Å²	118.3	80%	0.804	64%	0.644	S	S	*	*			trans	85.5	74.9	163.5	-46.9	-157.6	7.3	0	0	118.7
183	D	29.4	Very low	32.6	Very low	152 Å²	152	115.2 Å²	115.2	81%	0.813	63%	0.634	S	S	*	*			trans	-96.2	87.9	145.9	-107.2	-24.8	0	0	0	109.1	G185	D183-G185 PolarHBondContact O-N 3.42Å
184	S	32.7	Very low	33.2	Very low	35 Å²	35	113.4 Å²	113.4	25%	0.245	63%	0.631	C	S	.	*			trans	-75	98.9	-177.9	49.4	0	0	0	0	111	S188 Q189	S184-S188 WeakPolarHBondContact CA-OG 3.37Å; S184-S188 WeakPolarHBondContact CB-OG 3.12Å; S184-Q189 WeakPolarHBondContact OG-CG 3.4Å; S184-Q189 PolarHBondContact OG-NE2 2.86Å
185	G	33.4	Very low	33.5	Very low	42 Å²	42	119.5 Å²	119.5	43%	0.433	64%	0.639	S	S	.	*			trans	-51.4	149	159.1	0	0	0	0	0	110.5	D183 S187 S188	D183-G185 PolarHBondContact O-N 3.42Å; G185-S187 PolarHBondContact O-N 2.86Å; G185-S188 PolarHBondContact O-N 3.06Å; G185-S188 PolarHBondContact O-OG 2.93Å
186	L	37.4	Very low	33.9	Very low	119 Å²	119	115.6 Å²	115.6	62%	0.623	63%	0.632	S	S	*	*	H	α-helix	trans	-45.8	-21.3	-170	-69.2	163	0	0	0	115.4	L190	L186-L190 VanDerWaalsContact O-CD1 3.32Å; L186-L190 WeakPolarHBondContact O-CD1 3.11Å; L186-L190 WeakPolarHBondContact O-CG 3.33Å
187	S	35.1	Very low	34.1	Very low	66 Å²	66	113.6 Å²	113.6	46%	0.462	63%	0.626	S	S	.	*	H	α-helix	trans	-76.4	-28.7	174.7	-69.3	0	0	0	0	115.2	G185 S191	G185-S187 PolarHBondContact O-N 2.86Å; S187-S191 VanDerWaalsContact O-CB 3.32Å; S187-S191 WeakPolarHBondContact O-CB 3.48Å; S187-S191 PolarHBondContact O-N 2.82Å; S187-S191 VanDerWaalsContact O-N 3.07Å; S187-S191 PolarHBondContact O-OG 3.02Å
188	S	39.6	Very low	34.4	Very low	57 Å²	57	114.9 Å²	114.9	40%	0.399	63%	0.633	S	S	.	*	H	α-helix	trans	-85.3	-33.1	-170.3	53	0	0	0	0	114.1	S184 G185 L190 S191 S192	S184-S188 WeakPolarHBondContact CA-OG 3.37Å; S184-S188 WeakPolarHBondContact CB-OG 3.12Å; G185-S188 PolarHBondContact O-N 3.06Å; G185-S188 PolarHBondContact O-OG 2.93Å; S188-L190 VanDerWaalsContact C-N 3.34Å; S188-S191 PolarHBondContact O-N 3.08Å; S188-S192 PolarHBondContact O-N 2.07Å; S188-S192 VanDerWaalsContact O-N 3.17Å; S188-S192 PolarHBondContact O-OG 3.06Å
189	Q	37.5	Very low	35.1	Very low	113 Å²	113	111 Å²	111	53%	0.528	63%	0.627	S	S	.	*	H	α-helix	trans	-71.2	-31.3	171.4	-62.4	-166.7	-14.3	0	0	112.5	S184 S192 T193	S184-Q189 WeakPolarHBondContact OG-CG 3.4Å; S184-Q189 PolarHBondContact OG-NE2 2.86Å; Q189-S192 PolarHBondContact O-OG 3.06Å; Q189-T193 PolarHBondContact O-OG1 2.99Å; Q189-T193 VanDerWaalsContact O-OG1 3.1Å
190	L	34.9	Very low	35.4	Very low	89 Å²	89	115.6 Å²	115.6	47%	0.466	64%	0.638	S	S	.	*	H	α-helix	trans	-71.8	-37.2	172.6	-67.9	172.8	0	0	0	110.9	L186 S188 F194	L186-L190 VanDerWaalsContact O-CD1 3.32Å; L186-L190 WeakPolarHBondContact O-CD1 3.11Å; L186-L190 WeakPolarHBondContact O-CG 3.33Å; S188-L190 VanDerWaalsContact C-N 3.34Å; L190-F194 WeakPolarHBondContact O-CD2 3.39Å
191	S	37.9	Very low	35.7	Very low	65 Å²	65	117.1 Å²	117.1	46%	0.455	64%	0.643	S	S	.	*	H	α-helix	trans	-76.2	-30.3	-176.6	-60.9	0	0	0	0	114.9	S187 S188	S187-S191 VanDerWaalsContact O-CB 3.32Å; S187-S191 WeakPolarHBondContact O-CB 3.48Å; S187-S191 PolarHBondContact O-N 2.82Å; S187-S191 VanDerWaalsContact O-N 3.07Å; S187-S191 PolarHBondContact O-OG 3.02Å; S188-S191 PolarHBondContact O-N 3.08Å
192	S	38.5	Very low	36.2	Very low	75 Å²	75	118.4 Å²	118.4	52%	0.524	64%	0.644	S	S	.	*	H	α-helix	trans	-72.5	-30.9	177.7	56.2	0	0	0	0	112.6	S188 Q189	S188-S192 PolarHBondContact O-N 2.07Å; S188-S192 VanDerWaalsContact O-N 3.17Å; S188-S192 PolarHBondContact O-OG 3.06Å; Q189-S192 PolarHBondContact O-OG 3.06Å
193	T	38.8	Very low	36.7	Very low	91 Å²	91	115.4 Å²	115.4	56%	0.558	64%	0.642	S	S	*	*	H	α-helix	trans	-74.1	-30.3	178.3	-48.8	0	0	0	0	112	Q189 R195	Q189-T193 PolarHBondContact O-OG1 2.99Å; Q189-T193 VanDerWaalsContact O-OG1 3.1Å; T193-R195 VanDerWaalsContact C-N 3.31Å; T193-R195 PolarHBondContact O-N 2.84Å
194	F	40.7	Very low	37.2	Very low	173 Å²	173	119.1 Å²	119.1	76%	0.759	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-2.4	177.6	-90.7	-78.3	0	0	0	115	L190	L190-F194 WeakPolarHBondContact O-CD2 3.39Å
195	R	37.4	Very low	37.7	Very low	224 Å²	224	124.5 Å²	124.5	85%	0.845	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	8.8	179.7	-74.5	-169	177.3	-148	-0.1	114.8	T193	T193-R195 VanDerWaalsContact C-N 3.31Å; T193-R195 PolarHBondContact O-N 2.84Å
196	S	34.5	Very low	38.1	Very low	99 Å²	99	131.3 Å²	131.3	69%	0.692	69%	0.694	S	S	*	*	S	Bend	trans	-115.1	50.4	-178.6	-60.2	0	0	0	0	112.7
197	T	34	Very low	38.6	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	71%	0.707	S	S	*	*			trans	-163.7	106.1	160.4	42.9	0	0	0	0	106.3
198	D	35.5	Very low	39	Very low	165 Å²	165	141.3 Å²	141.3	88%	0.882	72%	0.719	S	S	*	*			trans	166.9	72.6	154.9	-80.8	-16.1	0	0	0	108.5
199	V	41.2	Very low	39.3	Very low	132 Å²	132	146.4 Å²	146.4	80%	0.8	74%	0.737	S	S	*	*			trans	-139.9	105.5	154.9	-177.4	0	0	0	0	107.3	T201	V199-T201 PolarHBondContact O-N 2.8Å
200	E	35.7	Very low	39.7	Very low	197 Å²	197	152 Å²	152	92%	0.921	75%	0.753	S	S	*	*			trans	-60.8	115.7	164.5	-71.1	177	141.5	0	0	108.9
201	T	36.4	Very low	40.3	Very low	126 Å²	126	154.2 Å²	154.2	77%	0.773	77%	0.765	S	S	*	*			trans	-145.5	123.8	153	-46.8	0	0	0	0	108.8	V199	V199-T201 PolarHBondContact O-N 2.8Å
202	Q	40.8	Very low	40.7	Very low	180 Å²	180	157.2 Å²	157.2	84%	0.841	78%	0.775	S	S	*	*			trans	-62.7	151.2	-174.9	-68	169.3	-1.1	0	0	112.5
203	S	40.2	Very low	41.3	Very low	109 Å²	109	158.9 Å²	158.9	76%	0.762	78%	0.782	S	S	*	*			trans	91.7	118.5	152.4	77.2	0	0	0	0	119.3
204	R	40.3	Very low	42.1	Very low	230 Å²	230	157 Å²	157	87%	0.868	78%	0.781	S	S	*	*			trans	106.8	125.2	150.8	-65.5	179.5	164.1	156.1	-3.7	118.6
205	D	41.4	Very low	43.1	Very low	148 Å²	148	152.8 Å²	152.8	79%	0.791	77%	0.773	S	S	*	*			trans	87.4	93.6	155.4	-61	-18.8	0	0	0	121.5	R207	D205-R207 VanDerWaalsContact C-N 3.34Å; D205-R207 PolarHBondContact O-N 3.2Å
206	M	43.1	Very low	44.6	Very low	185 Å²	185	145.8 Å²	145.8	91%	0.911	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	69	164.7	-80.7	-83.2	-69	0	0	113.3
207	R	47.7	Very low	46.6	Very low	240 Å²	240	143.9 Å²	143.9	91%	0.906	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	0.2	170.7	-81.8	-168.8	-179.2	179	1.3	117.9	D205	D205-R207 VanDerWaalsContact C-N 3.34Å; D205-R207 PolarHBondContact O-N 3.2Å
208	E	44.2	Very low	48.8	Very low	154 Å²	154	141.9 Å²	141.9	72%	0.72	74%	0.739	S	S	*	*			trans	-101.3	6.1	-172.1	-69.4	-165	148.9	0	0	117.4	R210 N211	E208-R210 PolarHBondContact O-N 3.11Å; E208-N211 PolarHBondContact O-N 2.76Å
209	H	45.2	Very low	50.8	Low	165 Å²	165	140.3 Å²	140.3	76%	0.764	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	9.2	-173.9	-88	19.1	0	0	0	117.6
210	R	46.6	Very low	52.9	Low	231 Å²	231	135.3 Å²	135.3	87%	0.872	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-16.2	172.7	-86.5	-176.6	173.3	172.1	-1.7	115	E208	E208-R210 PolarHBondContact O-N 3.11Å
211	N	46.9	Very low	55.3	Low	134 Å²	134	129.1 Å²	129.1	72%	0.717	67%	0.669	S	S	*	*	S	Bend	trans	-91.4	-14.9	-175.5	-72.9	-15.7	0	0	0	114.7	E208	E208-N211 PolarHBondContact O-N 2.76Å
212	L	45.1	Very low	57.7	Low	128 Å²	128	126.7 Å²	126.7	67%	0.67	65%	0.654	S	S	*	*	H	α-helix	trans	-70.7	-30.3	179.1	-98.6	85.7	0	0	0	113.8	S215 S216	L212-S215 PolarHBondContact O-N 3.41Å; L212-S216 PolarHBondContact O-N 3.45Å
213	V	50.9	Low	59.8	Low	111 Å²	111	120.5 Å²	120.5	67%	0.673	63%	0.627	S	S	*	*	H	α-helix	trans	-70.7	-34.2	-176.6	-177.2	0	0	0	0	111.7	S215 S216 A217	V213-S215 PolarHBondContact O-N 3.49Å; V213-S216 PolarHBondContact O-N 3.19Å; V213-A217 PolarHBondContact O-N 2.92Å
214	G	55.7	Low	62.1	Low	52 Å²	52	123.9 Å²	123.9	54%	0.536	62%	0.623	S	S	.	*	H	α-helix	trans	-67.2	-32.9	176.3	0	0	0	0	0	113.7	S218	G214-S218 WeakPolarHBondContact O-CB 3.32Å; G214-S218 PolarHBondContact O-N 3.4Å
215	S	62.3	Low	64.4	Low	83 Å²	83	117.4 Å²	117.4	58%	0.58	60%	0.603	S	S	*	*	H	α-helix	trans	-67.4	-39.3	177.5	-171.7	0	0	0	0	112.2	L212 V213 S218 W219	L212-S215 PolarHBondContact O-N 3.41Å; V213-S215 PolarHBondContact O-N 3.49Å; S215-S218 PolarHBondContact O-N 3.5Å; S215-W219 WeakPolarHBondContact O-CB 3.4Å; S215-W219 PolarHBondContact O-N 2.95Å
216	S	69.2	Low	66.5	Low	77 Å²	77	112.4 Å²	112.4	54%	0.538	58%	0.579	S	S	.	*	H	α-helix	trans	-67.2	-42.4	178.7	-173.9	0	0	0	0	112.9	L212 V213 W219 A220	L212-S216 PolarHBondContact O-N 3.45Å; V213-S216 PolarHBondContact O-N 3.19Å; S216-W219 PolarHBondContact O-N 2.94Å; S216-A220 WeakPolarHBondContact O-CB 3.33Å; S216-A220 PolarHBondContact O-N 3.21Å
217	A	76.4	Confident	68.6	Low	59 Å²	59	108.9 Å²	108.9	49%	0.488	56%	0.562	S	S	.	*	H	α-helix	trans	-65.8	-40	177.5	0	0	0	0	0	112.4	V213 T221	V213-A217 PolarHBondContact O-N 2.92Å; A217-T221 PolarHBondContact O-N 2.77Å; A217-T221 VanDerWaalsContact O-N 3.08Å; A217-T221 PolarHBondContact O-OG1 2.97Å
218	S	80.5	Confident	70.6	Confident	73 Å²	73	104.2 Å²	104.2	51%	0.51	55%	0.548	S	S	.	.	H	α-helix	trans	-62.2	-49.2	173.4	177.5	0	0	0	0	111.4	G214 S215 A220 T221 T222	G214-S218 WeakPolarHBondContact O-CB 3.32Å; G214-S218 PolarHBondContact O-N 3.4Å; S215-S218 PolarHBondContact O-N 3.5Å; S218-A220 PolarHBondContact O-N 2.91Å; S218-T221 PolarHBondContact O-N 3.4Å; S218-T222 PolarHBondContact O-N 3.41Å; S218-T222 PolarHBondContact O-OG1 2.82Å
219	W	77	Confident	72.8	Confident	133 Å²	133	104.7 Å²	104.7	50%	0.504	54%	0.543	S	S	.	.	H	α-helix	trans	-59.4	-45	177.6	176.7	84.1	0	0	0	112.5	S215 S216 T221 T222 L223	S215-W219 WeakPolarHBondContact O-CB 3.4Å; S215-W219 PolarHBondContact O-N 2.95Å; S216-W219 PolarHBondContact O-N 2.94Å; W219-T221 VanDerWaalsContact C-N 3.29Å; W219-T221 PolarHBondContact O-N 3.41Å; W219-T222 PolarHBondContact O-N 2.77Å; W219-L223 HydrophobicContact CH2-CD2 3.62Å; W219-L223 HydrophobicContact CZ2-CD2 3.87Å; W219-L223 HydrophobicContact CZ3-CD2 4.07Å; W219-L223 WeakPolarHBondContact O-CB 3.46Å; W219-L223 PolarHBondContact O-N 3.17Å
220	A	85.1	Confident	74.9	Confident	27 Å²	27	99.4 Å²	99.4	22%	0.223	53%	0.528	C	S	.	.	H	α-helix	trans	-61.4	-38.4	177.9	0	0	0	0	0	112	S216 S218 R224	S216-A220 WeakPolarHBondContact O-CB 3.33Å; S216-A220 PolarHBondContact O-N 3.21Å; S218-A220 PolarHBondContact O-N 2.91Å; A220-R224 WeakPolarHBondContact O-CB 3.45Å; A220-R224 VanDerWaalsContact O-CG 3.23Å; A220-R224 WeakPolarHBondContact O-CG 3.37Å; A220-R224 PolarHBondContact O-N 2.96Å
221	T	86.3	Confident	77.1	Confident	67 Å²	67	92.3 Å²	92.3	41%	0.411	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-47.8	176.4	-58.3	0	0	0	0	111.2	A217 S218 W219 L223 R224 Q225	A217-T221 PolarHBondContact O-N 2.77Å; A217-T221 VanDerWaalsContact O-N 3.08Å; A217-T221 PolarHBondContact O-OG1 2.97Å; S218-T221 PolarHBondContact O-N 3.4Å; W219-T221 VanDerWaalsContact C-N 3.29Å; W219-T221 PolarHBondContact O-N 3.41Å; T221-L223 VanDerWaalsContact C-N 3.33Å; T221-L223 PolarHBondContact O-N 3.04Å; T221-R224 PolarHBondContact O-N 2.78Å; T221-Q225 WeakPolarHBondContact O-CG 3.16Å; T221-Q225 PolarHBondContact O-N 2.81Å
222	T	86.2	Confident	79.3	Confident	74 Å²	74	89.2 Å²	89.2	45%	0.454	49%	0.491	S	S	.	.	H	α-helix	trans	-59	-43.9	175.9	-60.4	0	0	0	0	111.8	S218 W219 Q225 S226	S218-T222 PolarHBondContact O-N 3.41Å; S218-T222 PolarHBondContact O-OG1 2.82Å; W219-T222 PolarHBondContact O-N 2.77Å; T222-Q225 PolarHBondContact O-N 2.91Å; T222-S226 WeakPolarHBondContact O-CB 3.42Å; T222-S226 PolarHBondContact O-N 2.9Å
223	L	85.8	Confident	81.6	Confident	51 Å²	51	89.6 Å²	89.6	27%	0.267	49%	0.487	S	S	.	.	H	α-helix	trans	-62.4	-46.6	177.5	-174.7	65.1	0	0	0	111.6	W219 T221 Q225 S226 M227	W219-L223 HydrophobicContact CH2-CD2 3.62Å; W219-L223 HydrophobicContact CZ2-CD2 3.87Å; W219-L223 HydrophobicContact CZ3-CD2 4.07Å; W219-L223 WeakPolarHBondContact O-CB 3.46Å; W219-L223 PolarHBondContact O-N 3.17Å; T221-L223 VanDerWaalsContact C-N 3.33Å; T221-L223 PolarHBondContact O-N 3.04Å; L223-Q225 PolarHBondContact O-N 2.77Å; L223-S226 PolarHBondContact O-N 2.88Å; L223-M227 HydrophobicContact CD1-CE 3.71Å; L223-M227 HydrophobicContact CD2-CE 3.72Å; L223-M227 HydrophobicContact CG-CE 3.54Å; L223-M227 HydrophobicContact CG-SD 4.16Å; L223-M227 WeakPolarHBondContact O-CB 3.47Å; L223-M227 WeakPolarHBondContact O-CG 3.44Å; L223-M227 PolarHBondContact O-N 2.79Å
224	R	88.2	Confident	83.7	Confident	180 Å²	180	87.2 Å²	87.2	68%	0.679	47%	0.466	S	S	*	.	H	α-helix	trans	-60.1	-43.6	176.4	-75.5	172.5	-175.6	170.1	2	112	A220 T221 M227 K228	A220-R224 WeakPolarHBondContact O-CB 3.45Å; A220-R224 VanDerWaalsContact O-CG 3.23Å; A220-R224 WeakPolarHBondContact O-CG 3.37Å; A220-R224 PolarHBondContact O-N 2.96Å; T221-R224 PolarHBondContact O-N 2.78Å; R224-M227 PolarHBondContact O-N 3.32Å; R224-K228 VanDerWaalsContact O-CB 3.3Å; R224-K228 WeakPolarHBondContact O-CB 3.43Å; R224-K228 PolarHBondContact O-N 2.87Å
225	Q	88.5	Confident	85.6	Confident	94 Å²	94	85 Å²	85	44%	0.439	44%	0.442	S	S	.	.	H	α-helix	trans	-64.4	-41.9	176.8	-71.3	178.5	9.5	0	0	111.7	T221 T222 L223 K228 R229	T221-Q225 WeakPolarHBondContact O-CG 3.16Å; T221-Q225 PolarHBondContact O-N 2.81Å; T222-Q225 PolarHBondContact O-N 2.91Å; L223-Q225 PolarHBondContact O-N 2.77Å; Q225-K228 PolarHBondContact O-N 2.88Å; Q225-R229 VanDerWaalsContact O-CG 3.31Å; Q225-R229 WeakPolarHBondContact O-CG 3.35Å; Q225-R229 PolarHBondContact O-N 2.89Å
226	S	85.2	Confident	87.2	Confident	42 Å²	42	82.9 Å²	82.9	29%	0.294	42%	0.424	S	S	.	.	H	α-helix	trans	-62.8	-47.8	176.5	-176.6	0	0	0	0	111.8	T222 L223 K228 R229 A230	T222-S226 WeakPolarHBondContact O-CB 3.42Å; T222-S226 PolarHBondContact O-N 2.9Å; L223-S226 PolarHBondContact O-N 2.88Å; S226-K228 VanDerWaalsContact C-N 3.33Å; S226-K228 PolarHBondContact O-N 3.08Å; S226-R229 PolarHBondContact O-N 2.83Å; S226-A230 PolarHBondContact O-N 3.37Å
227	M	88.2	Confident	88.6	Confident	112 Å²	112	80.7 Å²	80.7	55%	0.552	41%	0.406	S	S	*	.	H	α-helix	trans	-59.6	-43	174.6	-71.7	174.3	178.7	0	0	111.7	L223 R224 R229 A230 N231	L223-M227 HydrophobicContact CD1-CE 3.71Å; L223-M227 HydrophobicContact CD2-CE 3.72Å; L223-M227 HydrophobicContact CG-CE 3.54Å; L223-M227 HydrophobicContact CG-SD 4.16Å; L223-M227 WeakPolarHBondContact O-CB 3.47Å; L223-M227 WeakPolarHBondContact O-CG 3.44Å; L223-M227 PolarHBondContact O-N 2.79Å; R224-M227 PolarHBondContact O-N 3.32Å; M227-R229 PolarHBondContact O-N 2.76Å; M227-A230 PolarHBondContact O-N 2.98Å; M227-N231 WeakPolarHBondContact O-CB 3.32Å; M227-N231 PolarHBondContact O-N 3.45Å
228	K	89.7	Confident	89.6	Confident	142 Å²	142	77.9 Å²	77.9	62%	0.617	38%	0.383	S	S	*	.	H	α-helix	trans	-61.3	-43.8	176.4	-174.1	177.3	-179.6	179.7	0	111.6	R224 Q225 S226 N231 N232	R224-K228 VanDerWaalsContact O-CB 3.3Å; R224-K228 WeakPolarHBondContact O-CB 3.43Å; R224-K228 PolarHBondContact O-N 2.87Å; Q225-K228 PolarHBondContact O-N 2.88Å; S226-K228 VanDerWaalsContact C-N 3.33Å; S226-K228 PolarHBondContact O-N 3.08Å; K228-N231 PolarHBondContact O-N 3.18Å; K228-N232 WeakPolarHBondContact O-CB 3.5Å; K228-N232 PolarHBondContact O-N 2.96Å; K228-N232 PolarHBondContact O-OD1 3.3Å
229	R	90.3	Very high	90.4	Very high	164 Å²	164	74.4 Å²	74.4	62%	0.619	36%	0.358	S	S	*	.	H	α-helix	trans	-62.7	-44.9	175.9	-71.7	172.5	-173.2	167	4.3	111.7	Q225 S226 M227 N232 K233	Q225-R229 VanDerWaalsContact O-CG 3.31Å; Q225-R229 WeakPolarHBondContact O-CG 3.35Å; Q225-R229 PolarHBondContact O-N 2.89Å; S226-R229 PolarHBondContact O-N 2.83Å; M227-R229 PolarHBondContact O-N 2.76Å; R229-N232 PolarHBondContact O-N 3.19Å; R229-K233 WeakPolarHBondContact O-CB 3.37Å; R229-K233 PolarHBondContact O-N 3.43Å
230	A	89.2	Confident	91.4	Very high	54 Å²	54	68.1 Å²	68.1	45%	0.446	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-42.4	177.2	0	0	0	0	0	111.9	S226 M227 K233 R234	S226-A230 PolarHBondContact O-N 3.37Å; M227-A230 PolarHBondContact O-N 2.98Å; A230-K233 PolarHBondContact O-N 3.37Å; A230-R234 PolarHBondContact O-N 3.31Å
231	N	91.8	Very high	92	Very high	82 Å²	82	66.9 Å²	66.9	44%	0.439	33%	0.325	S	S	.	.	H	α-helix	trans	-64.7	-49	176.5	-166.4	64.7	0	0	0	111.6	M227 K228 K233 R234 T235	M227-N231 WeakPolarHBondContact O-CB 3.32Å; M227-N231 PolarHBondContact O-N 3.45Å; K228-N231 PolarHBondContact O-N 3.18Å; N231-K233 VanDerWaalsContact C-N 3.26Å; N231-K233 PolarHBondContact O-N 3.01Å; N231-R234 WeakPolarHBondContact O-CB 3.28Å; N231-R234 PolarHBondContact O-N 3.44Å; N231-R234 VanDerWaalsContact O-N 3.07Å; N231-T235 PolarHBondContact O-N 2.86Å; N231-T235 PolarHBondContact O-OG1 2.9Å; N231-T235 VanDerWaalsContact O-OG1 3.06Å
232	N	93.6	Very high	92.5	Very high	68 Å²	68	64 Å²	64	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-58.9	-39.3	177.1	-73.3	8.2	0	0	0	111.8	K228 R229 L236 I259	K228-N232 WeakPolarHBondContact O-CB 3.5Å; K228-N232 PolarHBondContact O-N 2.96Å; K228-N232 PolarHBondContact O-OD1 3.3Å; R229-N232 PolarHBondContact O-N 3.19Å; N232-L236 VanDerWaalsContact O-CB 3.23Å; N232-L236 WeakPolarHBondContact O-CB 3.5Å; N232-L236 PolarHBondContact O-N 2.85Å; N232-I259 HydrophobicContact CB-CD1 4.04Å
233	K	93.5	Very high	93.1	Very high	137 Å²	137	60.4 Å²	60.4	60%	0.596	29%	0.285	S	S	*	.	H	α-helix	trans	-63.7	-45.1	174.4	-176.2	175.7	-179.3	176.1	0	111.6	R229 A230 N231 L236 L237	R229-K233 WeakPolarHBondContact O-CB 3.37Å; R229-K233 PolarHBondContact O-N 3.43Å; A230-K233 PolarHBondContact O-N 3.37Å; N231-K233 VanDerWaalsContact C-N 3.26Å; N231-K233 PolarHBondContact O-N 3.01Å; K233-L236 PolarHBondContact O-N 3.44Å; K233-L237 HydrophobicContact CG-CD1 4.11Å; K233-L237 HydrophobicContact CG-CG 4.46Å; K233-L237 VanDerWaalsContact O-CG 3.25Å; K233-L237 WeakPolarHBondContact O-CG 3.39Å; K233-L237 PolarHBondContact O-N 2.85Å
234	R	94.6	Very high	93.6	Very high	60 Å²	60	58.4 Å²	58.4	23%	0.226	27%	0.274	C	S	.	.	H	α-helix	trans	-57.6	-50.8	175.7	179.6	-170.6	-176.6	163.9	5	111	A230 N231 L236 L237 A238 A620 E623 E624	A230-R234 PolarHBondContact O-N 3.31Å; N231-R234 WeakPolarHBondContact O-CB 3.28Å; N231-R234 PolarHBondContact O-N 3.44Å; N231-R234 VanDerWaalsContact O-N 3.07Å; R234-L236 PolarHBondContact O-N 3.33Å; R234-L237 PolarHBondContact O-N 3.04Å; R234-A238 WeakPolarHBondContact O-CB 3.42Å; R234-A238 PolarHBondContact O-N 2.83Å; R234-A620 HydrophobicContact CG-CB 4.42Å; R234-A620 PolarHBondContact NE-O 3.08Å; R234-A620 PolarHBondContact NH2-O 3.38Å; R234-E623 IonicContact NH2-OE2 2.79Å; R234-E623 PolarHBondContact NH2-OE2 2.86Å; R234-E624 HydrophobicContact CG-CB 4.34Å; R234-E624 IonicContact CZ-OE2 2.83Å; R234-E624 IonicContact NE-OE2 2.8Å
235	T	96	Very high	94	Very high	6 Å²	6	54.1 Å²	54.1	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-43	178	-54.3	0	0	0	0	111.6	N231 L237 A238 G239 Y253 N257 I259	N231-T235 PolarHBondContact O-N 2.86Å; N231-T235 PolarHBondContact O-OG1 2.9Å; N231-T235 VanDerWaalsContact O-OG1 3.06Å; T235-L237 PolarHBondContact O-N 2.9Å; T235-A238 PolarHBondContact O-N 3.17Å; T235-G239 PolarHBondContact O-N 2.76Å; T235-Y253 HydrophobicContact CG2-CE1 3.81Å; T235-Y253 WeakPolarHBondContact O-CE1 3.4Å; T235-N257 HydrophobicContact CG2-CB 3.49Å; T235-N257 VanDerWaalsContact CG2-CB 3.49Å; T235-I259 HydrophobicContact CG2-CD1 4.18Å; T235-I259 HydrophobicContact CG2-CG1 3.65Å
236	L	97.1	Very high	94.4	Very high	39 Å²	39	52.9 Å²	52.9	20%	0.204	25%	0.254	C	S	.	.	H	α-helix	trans	-58.5	-49.5	175.5	173	63.8	0	0	0	111.5	N232 K233 R234 G239 C240 L254 I259 F270	N232-L236 VanDerWaalsContact O-CB 3.23Å; N232-L236 WeakPolarHBondContact O-CB 3.5Å; N232-L236 PolarHBondContact O-N 2.85Å; K233-L236 PolarHBondContact O-N 3.44Å; R234-L236 PolarHBondContact O-N 3.33Å; L236-G239 PolarHBondContact O-N 2.78Å; L236-C240 PolarHBondContact O-N 3.48Å; L236-C240 PolarHBondContact O-SG 3.39Å; L236-L254 HydrophobicContact CD1-CD2 4.24Å; L236-I259 HydrophobicContact CB-CG2 4.23Å; L236-I259 HydrophobicContact CD1-CG2 3.93Å; L236-F270 HydrophobicContact CD1-CE2 3.8Å; L236-F270 HydrophobicContact CD1-CZ 4.39Å
237	L	97	Very high	95	Very high	30 Å²	30	51.2 Å²	51.2	16%	0.157	24%	0.243	C	C	.	.	H	α-helix	trans	-65.8	-40.9	-179	-64.4	173	0	0	0	111.6	K233 R234 T235 G239 C240 T241 E621	K233-L237 HydrophobicContact CG-CD1 4.11Å; K233-L237 HydrophobicContact CG-CG 4.46Å; K233-L237 VanDerWaalsContact O-CG 3.25Å; K233-L237 WeakPolarHBondContact O-CG 3.39Å; K233-L237 PolarHBondContact O-N 2.85Å; R234-L237 PolarHBondContact O-N 3.04Å; T235-L237 PolarHBondContact O-N 2.9Å; L237-G239 VanDerWaalsContact C-N 3.34Å; L237-G239 PolarHBondContact O-N 2.89Å; L237-C240 PolarHBondContact O-N 2.79Å; L237-T241 PolarHBondContact O-N 2.93Å; L237-T241 PolarHBondContact O-OG1 3.17Å; L237-E621 HydrophobicContact CB-CG 4.34Å
238	A	97.3	Very high	95.4	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-44	172.4	0	0	0	0	0	111.4	R234 T235 C240 T241 L242 Y253 E621 E624 L625	R234-A238 WeakPolarHBondContact O-CB 3.42Å; R234-A238 PolarHBondContact O-N 2.83Å; T235-A238 PolarHBondContact O-N 3.17Å; A238-C240 PolarHBondContact O-N 3.03Å; A238-T241 PolarHBondContact O-N 3.38Å; A238-L242 WeakPolarHBondContact O-CG 3.38Å; A238-L242 PolarHBondContact O-N 2.82Å; A238-Y253 HydrophobicContact CB-CE1 4.3Å; A238-E621 HydrophobicContact CB-CG 4.48Å; A238-E624 HydrophobicContact CB-CB 4.06Å; A238-E624 HydrophobicContact CB-CG 3.59Å; A238-L625 HydrophobicContact CB-CD2 3.92Å; A238-L625 HydrophobicContact CB-CG 4.25Å; A238-L625 WeakPolarHBondContact O-CD2 3.35Å
239	G	97.8	Very high	95.6	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-38.9	175.3	0	0	0	0	0	113.4	T235 L236 L237 L242 F243 Y253	T235-G239 PolarHBondContact O-N 2.76Å; L236-G239 PolarHBondContact O-N 2.78Å; L237-G239 VanDerWaalsContact C-N 3.34Å; L237-G239 PolarHBondContact O-N 2.89Å; G239-L242 PolarHBondContact O-N 2.98Å; G239-F243 WeakPolarHBondContact O-CB 3.23Å; G239-F243 PolarHBondContact O-N 2.88Å; G239-Y253 VanDerWaalsContact CA-CD1 3.49Å
240	C	97.9	Very high	96	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.007	18%	0.178	C	C	.	.	H	α-helix	trans	-63.9	-43	172.1	-65.3	0	0	0	0	111.5	L236 L237 A238 L242 F243 N244 N276 L277	L236-C240 PolarHBondContact O-N 3.48Å; L236-C240 PolarHBondContact O-SG 3.39Å; L237-C240 PolarHBondContact O-N 2.79Å; A238-C240 PolarHBondContact O-N 3.03Å; C240-L242 VanDerWaalsContact C-N 3.34Å; C240-L242 PolarHBondContact O-N 2.9Å; C240-F243 WeakPolarHBondContact O-CB 3.3Å; C240-F243 PolarHBondContact O-N 2.85Å; C240-N244 WeakPolarHBondContact O-CB 3.43Å; C240-N244 PolarHBondContact O-N 3.43Å; C240-N244 PolarHBondContact O-ND2 3.28Å; C240-N276 HydrophobicContact CB-CB 4.06Å; C240-L277 HydrophobicContact CB-CD2 4.04Å
241	T	97.6	Very high	96.4	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-38.9	176.6	-64.8	0	0	0	0	111.5	L237 A238 R245 H452 N487 E621 L625	L237-T241 PolarHBondContact O-N 2.93Å; L237-T241 PolarHBondContact O-OG1 3.17Å; A238-T241 PolarHBondContact O-N 3.38Å; T241-R245 WeakPolarHBondContact O-CG 3.37Å; T241-R245 PolarHBondContact O-N 2.92Å; T241-H452 HydrophobicContact CG2-CB 4.12Å; T241-N487 PolarHBondContact OG1-ND2 3.25Å; T241-E621 PolarHBondContact OG1-OE1 3.05Å; T241-L625 HydrophobicContact CG2-CD1 3.5Å; T241-L625 VanDerWaalsContact CG2-CD1 3.5Å
242	L	97.6	Very high	96.6	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-45.7	171.3	-71.4	170.9	0	0	0	111.6	A238 G239 C240 N244 R245 N246 E249 Y253 L625	A238-L242 WeakPolarHBondContact O-CG 3.38Å; A238-L242 PolarHBondContact O-N 2.82Å; G239-L242 PolarHBondContact O-N 2.98Å; C240-L242 VanDerWaalsContact C-N 3.34Å; C240-L242 PolarHBondContact O-N 2.9Å; L242-N244 VanDerWaalsContact C-N 3.32Å; L242-N244 PolarHBondContact O-N 2.93Å; L242-R245 WeakPolarHBondContact O-CB 3.29Å; L242-R245 PolarHBondContact O-N 3.35Å; L242-N246 CarbonylContact O-C 3.55Å; L242-N246 PolarHBondContact O-N 2.88Å; L242-N246 VanDerWaalsContact O-O 3.05Å; L242-E249 HydrophobicContact CD2-CG 4.43Å; L242-Y253 HydrophobicContact CD1-CD1 3.84Å; L242-Y253 HydrophobicContact CD1-CD2 3.62Å; L242-Y253 HydrophobicContact CD1-CE1 4.35Å; L242-Y253 HydrophobicContact CD1-CE2 4.18Å; L242-Y253 HydrophobicContact CD1-CG 3.43Å; L242-Y253 VanDerWaalsContact CD1-CG 3.43Å; L242-L625 HydrophobicContact CD1-CD2 4.07Å; L242-L625 HydrophobicContact CD2-CD2 3.78Å; L242-L625 HydrophobicContact CG-CD2 3.53Å
243	F	98.2	Very high	96.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57.6	-46.3	177.8	-178.4	-87.7	0	0	0	111.6	G239 C240 R245 N246 P247 V251 L271 L277 A281 I282 Y285	G239-F243 WeakPolarHBondContact O-CB 3.23Å; G239-F243 PolarHBondContact O-N 2.88Å; C240-F243 WeakPolarHBondContact O-CB 3.3Å; C240-F243 PolarHBondContact O-N 2.85Å; F243-R245 PolarHBondContact O-N 3.46Å; F243-N246 CarbonylContact O-C 3.52Å; F243-N246 VanDerWaalsContact O-C 3.25Å; F243-N246 PolarHBondContact O-N 3.47Å; F243-P247 HydrophobicContact CD2-CB 4.01Å; F243-P247 WeakPolarHBondContact CD2-O 3.44Å; F243-P247 HydrophobicContact CE2-CB 3.71Å; F243-P247 HydrophobicContact CZ-CB 4Å; F243-P247 WeakPolarHBondContact O-CA 3.24Å; F243-P247 WeakPolarHBondContact O-CD 3.27Å; F243-P247 VanDerWaalsContact O-N 3.13Å; F243-V251 HydrophobicContact CD2-CG2 3.88Å; F243-V251 HydrophobicContact CE2-CG2 3.85Å; F243-L271 HydrophobicContact CD2-CD2 4.48Å; F243-L271 HydrophobicContact CE1-CD2 4.26Å; F243-L271 HydrophobicContact CE2-CD2 3.59Å; F243-L271 HydrophobicContact CZ-CD2 3.45Å; F243-L271 VanDerWaalsContact CZ-CD2 3.45Å; F243-L277 HydrophobicContact CB-CD2 4.18Å; F243-L277 HydrophobicContact CD1-CD2 3.67Å; F243-L277 HydrophobicContact CD1-CG 4.47Å; F243-L277 HydrophobicContact CE1-CB 4.49Å; F243-L277 HydrophobicContact CE1-CD1 4.43Å; F243-L277 HydrophobicContact CE1-CD2 4.27Å; F243-L277 HydrophobicContact CG-CD2 4.01Å; F243-A281 HydrophobicContact CD1-CB 3.85Å; F243-A281 HydrophobicContact CE1-CB 3.65Å; F243-I282 HydrophobicContact CE1-CG1 3.88Å; F243-I282 HydrophobicContact CZ-CG1 4.12Å; F243-Y285 HydrophobicContact CE2-CD2 4.44Å; F243-Y285 HydrophobicContact CE2-CG 4.34Å
244	N	97.4	Very high	97	Very high	8 Å²	8	22.3 Å²	22.3	4%	0.043	11%	0.108	C	C	.	.	H	α-helix	trans	-67.5	-17.3	179.4	-68.4	-15.5	0	0	0	113.4	C240 L242 N276 N278 R451 H452	C240-N244 WeakPolarHBondContact O-CB 3.43Å; C240-N244 PolarHBondContact O-N 3.43Å; C240-N244 PolarHBondContact O-ND2 3.28Å; L242-N244 VanDerWaalsContact C-N 3.32Å; L242-N244 PolarHBondContact O-N 2.93Å; N244-N276 PolarHBondContact ND2-O 3.41Å; N244-N278 HydrophobicContact CB-CB 4.27Å; N244-N278 WeakPolarHBondContact OD1-CB 3.43Å; N244-N278 PolarHBondContact OD1-N 3.25Å; N244-R451 WeakPolarHBondContact CB-O 3.35Å; N244-R451 PolarHBondContact ND2-O 3.43Å; N244-R451 WeakPolarHBondContact O-CB 3.45Å; N244-H452 HydrophobicContact CB-CB 3.8Å
245	R	96	Very high	97.1	Very high	90 Å²	90	21.1 Å²	21.1	34%	0.34	11%	0.106	S	C	.	.	H	α-helix	trans	-88.8	-51.4	170.4	-72.9	179.4	172.4	171.1	0.4	111.8	T241 L242 F243 H452	T241-R245 WeakPolarHBondContact O-CG 3.37Å; T241-R245 PolarHBondContact O-N 2.92Å; L242-R245 WeakPolarHBondContact O-CB 3.29Å; L242-R245 PolarHBondContact O-N 3.35Å; F243-R245 PolarHBondContact O-N 3.46Å; R245-H452 HydrophobicContact CG-CB 3.59Å; R245-H452 PolarHBondContact NE-CD2 2.85Å; R245-H452 PolarHBondContact NE-CE1 3.23Å; R245-H452 PolarHBondContact NE-NE2 3.33Å; R245-H452 VanDerWaalsContact NE-NE2 3.18Å; R245-H452 PolarHBondContact NH2-CD2 3.17Å; R245-H452 VanDerWaalsContact NH2-CD2 3.31Å; R245-H452 PolarHBondContact NH2-NE2 3.5Å
246	N	96.5	Very high	97.1	Very high	68 Å²	68	27.6 Å²	27.6	36%	0.364	13%	0.13	S	C	.	.			trans	-145.2	107.3	179.8	-179.3	-23.8	0	0	0	108.6	L242 F243 V248 E249 G250	L242-N246 CarbonylContact O-C 3.55Å; L242-N246 PolarHBondContact O-N 2.88Å; L242-N246 VanDerWaalsContact O-O 3.05Å; F243-N246 CarbonylContact O-C 3.52Å; F243-N246 VanDerWaalsContact O-C 3.25Å; F243-N246 PolarHBondContact O-N 3.47Å; N246-V248 VanDerWaalsContact C-N 3.31Å; N246-V248 PolarHBondContact O-N 3.42Å; N246-V248 PolarHBondContact OD1-N 2.87Å; N246-E249 HydrophobicContact CB-CB 3.96Å; N246-E249 PolarHBondContact O-N 3.32Å; N246-E249 VanDerWaalsContact O-N 3.14Å; N246-E249 PolarHBondContact OD1-N 2.92Å; N246-G250 PolarHBondContact O-N 3.49Å
247	P	97	Very high	97	Very high	8 Å²	8	28.7 Å²	28.7	5%	0.052	14%	0.136	C	C	.	.	H	α-helix	trans	-58.6	-38.6	-173.1	-27.6	34.4	0	0	0	114.5	F243 G250 V251 A281 E284 Y285	F243-P247 HydrophobicContact CD2-CB 4.01Å; F243-P247 WeakPolarHBondContact CD2-O 3.44Å; F243-P247 HydrophobicContact CE2-CB 3.71Å; F243-P247 HydrophobicContact CZ-CB 4Å; F243-P247 WeakPolarHBondContact O-CA 3.24Å; F243-P247 WeakPolarHBondContact O-CD 3.27Å; F243-P247 VanDerWaalsContact O-N 3.13Å; P247-G250 PolarHBondContact O-N 3.5Å; P247-V251 WeakPolarHBondContact O-CG2 3.4Å; P247-V251 PolarHBondContact O-N 3.23Å; P247-A281 HydrophobicContact CG-CB 4.19Å; P247-A281 WeakPolarHBondContact CG-O 3.36Å; P247-E284 HydrophobicContact CG-CB 4.09Å; P247-Y285 HydrophobicContact CB-CD2 3.8Å; P247-Y285 HydrophobicContact CB-CG 4.16Å
248	V	96.5	Very high	96.9	Very high	44 Å²	44	37.3 Å²	37.3	27%	0.267	17%	0.168	S	C	.	.	H	α-helix	trans	-64.9	-43	179.3	-178.8	0	0	0	0	111	N246 N252 L288	N246-V248 VanDerWaalsContact C-N 3.31Å; N246-V248 PolarHBondContact O-N 3.42Å; N246-V248 PolarHBondContact OD1-N 2.87Å; V248-N252 WeakPolarHBondContact O-CB 3.47Å; V248-N252 VanDerWaalsContact O-CG 3.24Å; V248-N252 PolarHBondContact O-N 3.48Å; V248-N252 PolarHBondContact O-ND2 3.44Å; V248-N252 VanDerWaalsContact O-ND2 3.16Å; V248-L288 HydrophobicContact CG2-CD1 3.23Å; V248-L288 HydrophobicContact CG2-CD2 4.4Å; V248-L288 HydrophobicContact CG2-CG 4.45Å
249	E	96	Very high	96.8	Very high	36 Å²	36	39.6 Å²	39.6	17%	0.168	18%	0.18	C	C	.	.	H	α-helix	trans	-64.8	-43.7	178.1	-177.9	166.7	-168.3	0	0	111.3	L242 N246 N252 Y253 H628 K632	L242-E249 HydrophobicContact CD2-CG 4.43Å; N246-E249 HydrophobicContact CB-CB 3.96Å; N246-E249 PolarHBondContact O-N 3.32Å; N246-E249 VanDerWaalsContact O-N 3.14Å; N246-E249 PolarHBondContact OD1-N 2.92Å; E249-N252 PolarHBondContact O-N 3.35Å; E249-Y253 VanDerWaalsContact O-CB 3.31Å; E249-Y253 WeakPolarHBondContact O-CB 3.27Å; E249-Y253 PolarHBondContact O-N 3.5Å; E249-H628 IonicContact OE1-CD2 3.88Å; E249-H628 IonicContact OE1-NE2 2.78Å; E249-K632 IonicContact OE1-NZ 2.6Å; E249-K632 PolarHBondContact OE1-NZ 2.84Å; E249-K632 IonicContact OE2-NZ 2.62Å; E249-K632 PolarHBondContact OE2-NZ 3.26Å
250	G	97.4	Very high	96.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.6	-48.8	176.9	0	0	0	0	0	113.4	N246 P247 N252 Y253 L254	N246-G250 PolarHBondContact O-N 3.49Å; P247-G250 PolarHBondContact O-N 3.5Å; G250-N252 PolarHBondContact O-N 2.92Å; G250-Y253 PolarHBondContact O-N 3.25Å; G250-L254 WeakPolarHBondContact O-CG 3.42Å; G250-L254 PolarHBondContact O-N 3.01Å
251	V	97.6	Very high	96.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-47.2	177.1	172.8	0	0	0	0	110.7	F243 P247 Y253 L254 I255 I267 Y285	F243-V251 HydrophobicContact CD2-CG2 3.88Å; F243-V251 HydrophobicContact CE2-CG2 3.85Å; P247-V251 WeakPolarHBondContact O-CG2 3.4Å; P247-V251 PolarHBondContact O-N 3.23Å; V251-Y253 VanDerWaalsContact C-N 3.34Å; V251-Y253 PolarHBondContact O-N 3.35Å; V251-L254 PolarHBondContact O-N 2.9Å; V251-I255 HydrophobicContact CG1-CD1 3.67Å; V251-I255 HydrophobicContact CG1-CG1 4.42Å; V251-I255 VanDerWaalsContact O-CG1 3.31Å; V251-I255 WeakPolarHBondContact O-CG1 3.13Å; V251-I255 PolarHBondContact O-N 3.31Å; V251-I267 HydrophobicContact CG1-CD1 4.23Å; V251-Y285 HydrophobicContact CB-CE2 4.37Å; V251-Y285 HydrophobicContact CG2-CD2 4.32Å; V251-Y285 HydrophobicContact CG2-CE2 3.79Å
252	N	96.6	Very high	96.3	Very high	64 Å²	64	48.9 Å²	48.9	34%	0.342	24%	0.235	S	C	.	.	H	α-helix	trans	-62.1	-40.5	178.6	-74.9	-27.4	0	0	0	112.5	V248 E249 G250 I255 R256	V248-N252 WeakPolarHBondContact O-CB 3.47Å; V248-N252 VanDerWaalsContact O-CG 3.24Å; V248-N252 PolarHBondContact O-N 3.48Å; V248-N252 PolarHBondContact O-ND2 3.44Å; V248-N252 VanDerWaalsContact O-ND2 3.16Å; E249-N252 PolarHBondContact O-N 3.35Å; G250-N252 PolarHBondContact O-N 2.92Å; N252-I255 PolarHBondContact O-N 2.87Å; N252-R256 WeakPolarHBondContact O-CB 3.43Å; N252-R256 WeakPolarHBondContact O-CG 3.46Å; N252-R256 PolarHBondContact O-N 2.76Å
253	Y	97.4	Very high	96.3	Very high	6 Å²	6	51.5 Å²	51.5	2%	0.024	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-45.2	176.9	174.1	-89.5	0	0	0	111.4	T235 A238 G239 L242 E249 G250 V251 I255 R256 N257 E624 H628	T235-Y253 HydrophobicContact CG2-CE1 3.81Å; T235-Y253 WeakPolarHBondContact O-CE1 3.4Å; A238-Y253 HydrophobicContact CB-CE1 4.3Å; G239-Y253 VanDerWaalsContact CA-CD1 3.49Å; L242-Y253 HydrophobicContact CD1-CD1 3.84Å; L242-Y253 HydrophobicContact CD1-CD2 3.62Å; L242-Y253 HydrophobicContact CD1-CE1 4.35Å; L242-Y253 HydrophobicContact CD1-CE2 4.18Å; L242-Y253 HydrophobicContact CD1-CG 3.43Å; L242-Y253 VanDerWaalsContact CD1-CG 3.43Å; E249-Y253 VanDerWaalsContact O-CB 3.31Å; E249-Y253 WeakPolarHBondContact O-CB 3.27Å; E249-Y253 PolarHBondContact O-N 3.5Å; G250-Y253 PolarHBondContact O-N 3.25Å; V251-Y253 VanDerWaalsContact C-N 3.34Å; V251-Y253 PolarHBondContact O-N 3.35Å; Y253-I255 VanDerWaalsContact C-N 3.32Å; Y253-I255 PolarHBondContact O-N 2.78Å; Y253-R256 PolarHBondContact O-N 3.29Å; Y253-N257 WeakPolarHBondContact CD2-ND2 3.27Å; Y253-N257 WeakPolarHBondContact CE2-ND2 3.37Å; Y253-N257 VanDerWaalsContact CZ-ND2 3.32Å; Y253-N257 PolarHBondContact O-N 3.2Å; Y253-N257 VanDerWaalsContact O-N 3.1Å; Y253-N257 PolarHBondContact O-ND2 2.97Å; Y253-E624 WeakPolarHBondContact OH-CG 3.39Å; Y253-E624 PolarHBondContact OH-OE1 3.19Å; Y253-H628 HydrophobicContact CD2-CB 4.39Å; Y253-H628 AromaticContact CD2-CD2 3.99Å; Y253-H628 AromaticContact CD2-CE1 3.66Å; Y253-H628 AromaticContact CD2-CG 3.69Å; Y253-H628 AromaticContact CD2-ND1 3.48Å; Y253-H628 WeakPolarHBondContact CD2-ND1 3.46Å; Y253-H628 AromaticContact CD2-NE2 3.97Å; Y253-H628 HydrophobicContact CE2-CB 4.07Å; Y253-H628 AromaticContact CE2-CG 3.86Å; Y253-H628 AromaticContact CE2-ND1 3.84Å
254	L	97.4	Very high	96.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-38.3	178.3	-70.4	167.8	0	0	0	112.1	L236 G250 V251 Y258 I259 L260 F270	L236-L254 HydrophobicContact CD1-CD2 4.24Å; G250-L254 WeakPolarHBondContact O-CG 3.42Å; G250-L254 PolarHBondContact O-N 3.01Å; V251-L254 PolarHBondContact O-N 2.9Å; L254-Y258 PolarHBondContact O-N 3.12Å; L254-I259 HydrophobicContact CD2-CB 4.02Å; L254-I259 HydrophobicContact CD2-CG2 3.82Å; L254-I259 PolarHBondContact O-N 2.8Å; L254-L260 HydrophobicContact CB-CB 3.8Å; L254-L260 HydrophobicContact CB-CD2 4.36Å; L254-L260 HydrophobicContact CD1-CD2 4.44Å; L254-L260 PolarHBondContact O-N 3.34Å; L254-L260 VanDerWaalsContact O-N 3.17Å; L254-F270 HydrophobicContact CD1-CD1 4.46Å; L254-F270 HydrophobicContact CD1-CE1 3.55Å; L254-F270 HydrophobicContact CD1-CE2 4.33Å; L254-F270 HydrophobicContact CD1-CZ 3.48Å; L254-F270 VanDerWaalsContact CD1-CZ 3.48Å
255	I	96.7	Very high	96.3	Very high	36 Å²	36	55.7 Å²	55.7	19%	0.185	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-48.4	175.4	-68.4	168	0	0	0	111.3	V251 N252 Y253 N257 Y258 L260 I267	V251-I255 HydrophobicContact CG1-CD1 3.67Å; V251-I255 HydrophobicContact CG1-CG1 4.42Å; V251-I255 VanDerWaalsContact O-CG1 3.31Å; V251-I255 WeakPolarHBondContact O-CG1 3.13Å; V251-I255 PolarHBondContact O-N 3.31Å; N252-I255 PolarHBondContact O-N 2.87Å; Y253-I255 VanDerWaalsContact C-N 3.32Å; Y253-I255 PolarHBondContact O-N 2.78Å; I255-N257 PolarHBondContact O-N 3.24Å; I255-Y258 PolarHBondContact O-N 3.14Å; I255-L260 WeakPolarHBondContact CA-O 3.23Å; I255-L260 HydrophobicContact CG1-CB 4.42Å; I255-I267 HydrophobicContact CD1-CD1 4.35Å
256	R	95.8	Very high	96.4	Very high	142 Å²	142	55.6 Å²	55.6	54%	0.536	27%	0.274	S	S	.	.	H	α-helix	trans	-60.6	-32	-180	-74.1	173	-165.9	-176.2	2.8	113.1	N252 Y253 Y258	N252-R256 WeakPolarHBondContact O-CB 3.43Å; N252-R256 WeakPolarHBondContact O-CG 3.46Å; N252-R256 PolarHBondContact O-N 2.76Å; Y253-R256 PolarHBondContact O-N 3.29Å; R256-Y258 VanDerWaalsContact C-N 3.32Å
257	N	95.1	Very high	96.5	Very high	61 Å²	61	52.4 Å²	52.4	33%	0.326	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	11.3	178.3	-69	-75.6	0	0	0	113.7	T235 Y253 I255 I259	T235-N257 HydrophobicContact CG2-CB 3.49Å; T235-N257 VanDerWaalsContact CG2-CB 3.49Å; Y253-N257 WeakPolarHBondContact CD2-ND2 3.27Å; Y253-N257 WeakPolarHBondContact CE2-ND2 3.37Å; Y253-N257 VanDerWaalsContact CZ-ND2 3.32Å; Y253-N257 PolarHBondContact O-N 3.2Å; Y253-N257 VanDerWaalsContact O-N 3.1Å; Y253-N257 PolarHBondContact O-ND2 2.97Å; I255-N257 PolarHBondContact O-N 3.24Å; N257-I259 HydrophobicContact CB-CG1 4.21Å; N257-I259 PolarHBondContact O-N 3.15Å
258	Y	94.9	Very high	96.5	Very high	212 Å²	212	52 Å²	52	83%	0.831	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	22.7	178.6	-49.5	-82.5	0	0	0	114.3	L254 I255 R256	L254-Y258 PolarHBondContact O-N 3.12Å; I255-Y258 PolarHBondContact O-N 3.14Å; R256-Y258 VanDerWaalsContact C-N 3.32Å
259	I	95.4	Very high	96.6	Very high	48 Å²	48	52.6 Å²	52.6	25%	0.246	25%	0.254	C	S	.	.	S	Bend	trans	-80.7	-33.7	172.3	-58.5	-59.8	0	0	0	109.9	N232 T235 L236 L254 N257	N232-I259 HydrophobicContact CB-CD1 4.04Å; T235-I259 HydrophobicContact CG2-CD1 4.18Å; T235-I259 HydrophobicContact CG2-CG1 3.65Å; L236-I259 HydrophobicContact CB-CG2 4.23Å; L236-I259 HydrophobicContact CD1-CG2 3.93Å; L254-I259 HydrophobicContact CD2-CB 4.02Å; L254-I259 HydrophobicContact CD2-CG2 3.82Å; L254-I259 PolarHBondContact O-N 2.8Å; N257-I259 HydrophobicContact CB-CG1 4.21Å; N257-I259 PolarHBondContact O-N 3.15Å
260	L	95.2	Very high	96.7	Very high	14 Å²	14	52 Å²	52	7%	0.073	25%	0.251	C	S	.	.	S	Bend	trans	-127.1	139.7	179.8	-170.7	59.3	0	0	0	110.1	L254 I255 I267 F270	L254-L260 HydrophobicContact CB-CB 3.8Å; L254-L260 HydrophobicContact CB-CD2 4.36Å; L254-L260 HydrophobicContact CD1-CD2 4.44Å; L254-L260 PolarHBondContact O-N 3.34Å; L254-L260 VanDerWaalsContact O-N 3.17Å; I255-L260 WeakPolarHBondContact CA-O 3.23Å; I255-L260 HydrophobicContact CG1-CB 4.42Å; L260-I267 HydrophobicContact CD2-CB 4.41Å; L260-I267 HydrophobicContact CD2-CG1 3.88Å; L260-I267 HydrophobicContact CD2-CG2 4.39Å; L260-I267 HydrophobicContact CG-CG1 4.12Å; L260-F270 HydrophobicContact CD1-CB 3.66Å; L260-F270 HydrophobicContact CD1-CG 4.06Å; L260-F270 HydrophobicContact CD2-CB 4.35Å; L260-F270 HydrophobicContact CD2-CD1 3.86Å; L260-F270 HydrophobicContact CD2-CE1 4.45Å; L260-F270 HydrophobicContact CD2-CG 4.15Å
261	L	94.9	Very high	96.7	Very high	105 Å²	105	52.2 Å²	52.2	55%	0.55	25%	0.252	S	S	.	.			trans	-81.5	146.5	173.1	-62.9	176.9	0	0	0	110.1	D263 K266	L261-D263 HydrophobicContact CB-CB 4.45Å; L261-D263 PolarHBondContact O-N 2.87Å; L261-K266 HydrophobicContact CB-CB 4.25Å; L261-K266 HydrophobicContact CB-CG 4.23Å; L261-K266 HydrophobicContact CD1-CG 4.25Å
262	S	93.9	Very high	96.6	Very high	79 Å²	79	54 Å²	54	55%	0.552	26%	0.261	S	S	*	.	S	Bend	trans	-75.5	38.9	175.1	-172.2	0	0	0	0	112.9
263	D	96.6	Very high	96.5	Very high	59 Å²	59	57.4 Å²	57.4	32%	0.316	28%	0.275	S	S	.	.			trans	-107.7	125.4	178.6	173.8	5.8	0	0	0	109.1	L261 I265 K266 I267	L261-D263 HydrophobicContact CB-CB 4.45Å; L261-D263 PolarHBondContact O-N 2.87Å; D263-I265 PolarHBondContact O-N 3.5Å; D263-I265 VanDerWaalsContact O-N 3.13Å; D263-I265 PolarHBondContact OD1-N 2.94Å; D263-I265 VanDerWaalsContact OD1-N 3.13Å; D263-K266 HydrophobicContact CB-CB 4.17Å; D263-K266 HydrophobicContact CB-CG 3.9Å; D263-K266 PolarHBondContact O-N 2.78Å; D263-K266 VanDerWaalsContact O-N 3.08Å; D263-I267 WeakPolarHBondContact O-CG1 3.32Å; D263-I267 PolarHBondContact O-N 3.14Å
264	P	97.7	Very high	96.4	Very high	27 Å²	27	58.9 Å²	58.9	18%	0.175	28%	0.282	C	S	.	.	H	α-helix	trans	-48.5	-38.3	178.1	-26.8	31.4	0	0	0	114.8	A268 L293 K296 V297 E300	P264-A268 VanDerWaalsContact O-CB 3.31Å; P264-A268 WeakPolarHBondContact O-CB 3.45Å; P264-A268 PolarHBondContact O-N 2.87Å; P264-L293 HydrophobicContact CG-CD1 3.91Å; P264-K296 HydrophobicContact CB-CB 3.92Å; P264-K296 HydrophobicContact CG-CB 3.86Å; P264-K296 HydrophobicContact CG-CD 4.17Å; P264-V297 HydrophobicContact CB-CG2 4.13Å; P264-E300 HydrophobicContact CB-CG 4.06Å
265	I	97.9	Very high	96.2	Very high	69 Å²	69	62.6 Å²	62.6	35%	0.354	31%	0.306	S	S	.	.	H	α-helix	trans	-67.9	-45.8	-179	-62.2	172.2	0	0	0	110.2	D263 A268 Q269 E300	D263-I265 PolarHBondContact O-N 3.5Å; D263-I265 VanDerWaalsContact O-N 3.13Å; D263-I265 PolarHBondContact OD1-N 2.94Å; D263-I265 VanDerWaalsContact OD1-N 3.13Å; I265-A268 PolarHBondContact O-N 2.88Å; I265-Q269 WeakPolarHBondContact O-CG 3.31Å; I265-Q269 PolarHBondContact O-N 2.84Å; I265-E300 HydrophobicContact CG1-CG 3.91Å
266	K	97.7	Very high	96.1	Very high	89 Å²	89	62.4 Å²	62.4	39%	0.387	31%	0.306	S	S	.	.	H	α-helix	trans	-66.7	-38.5	179.9	-60.6	-63	-179.1	-175.9	0	111.6	L261 D263 Q269 F270	L261-K266 HydrophobicContact CB-CB 4.25Å; L261-K266 HydrophobicContact CB-CG 4.23Å; L261-K266 HydrophobicContact CD1-CG 4.25Å; D263-K266 HydrophobicContact CB-CB 4.17Å; D263-K266 HydrophobicContact CB-CG 3.9Å; D263-K266 PolarHBondContact O-N 2.78Å; D263-K266 VanDerWaalsContact O-N 3.08Å; K266-Q269 PolarHBondContact O-N 3.24Å; K266-F270 WeakPolarHBondContact O-CB 3.32Å; K266-F270 PolarHBondContact O-N 3.39Å
267	I	98.3	Very high	96.1	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-43.5	174	-59	166.6	0	0	0	109.9	V251 I255 L260 D263 Q269 F270 L271 L293 V297	V251-I267 HydrophobicContact CG1-CD1 4.23Å; I255-I267 HydrophobicContact CD1-CD1 4.35Å; L260-I267 HydrophobicContact CD2-CB 4.41Å; L260-I267 HydrophobicContact CD2-CG1 3.88Å; L260-I267 HydrophobicContact CD2-CG2 4.39Å; L260-I267 HydrophobicContact CG-CG1 4.12Å; D263-I267 WeakPolarHBondContact O-CG1 3.32Å; D263-I267 PolarHBondContact O-N 3.14Å; I267-Q269 PolarHBondContact O-N 3.4Å; I267-F270 WeakPolarHBondContact O-CB 3.47Å; I267-F270 PolarHBondContact O-N 2.89Å; I267-L271 HydrophobicContact CG2-CD1 4.2Å; I267-L271 HydrophobicContact CG2-CG 4.27Å; I267-L271 VanDerWaalsContact O-CG 3.31Å; I267-L271 WeakPolarHBondContact O-CG 3.35Å; I267-L271 PolarHBondContact O-N 3.19Å; I267-L293 HydrophobicContact CD1-CD1 4.06Å; I267-L293 HydrophobicContact CD1-CD2 3.93Å; I267-L293 HydrophobicContact CD1-CG 4.2Å; I267-V297 HydrophobicContact CB-CG1 4.16Å; I267-V297 HydrophobicContact CB-CG2 3.88Å; I267-V297 HydrophobicContact CD1-CG2 4.07Å; I267-V297 HydrophobicContact CG2-CB 4.48Å; I267-V297 HydrophobicContact CG2-CG1 3.73Å; I267-V297 HydrophobicContact CG2-CG2 3.85Å
268	A	98.3	Very high	96.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-44.5	176.4	0	0	0	0	0	112.4	P264 I265 F270 L271 I272 V297 E300 F301 L304	P264-A268 VanDerWaalsContact O-CB 3.31Å; P264-A268 WeakPolarHBondContact O-CB 3.45Å; P264-A268 PolarHBondContact O-N 2.87Å; I265-A268 PolarHBondContact O-N 2.88Å; A268-F270 VanDerWaalsContact C-N 3.32Å; A268-F270 PolarHBondContact O-N 2.85Å; A268-L271 PolarHBondContact O-N 2.94Å; A268-I272 WeakPolarHBondContact O-CG2 3.3Å; A268-I272 PolarHBondContact O-N 3.46Å; A268-I272 VanDerWaalsContact O-N 3.11Å; A268-V297 HydrophobicContact CB-CG1 4.21Å; A268-E300 HydrophobicContact CB-CB 3.79Å; A268-F301 HydrophobicContact CB-CB 4.01Å; A268-L304 HydrophobicContact CB-CD1 4.05Å
269	Q	97.9	Very high	96.1	Very high	56 Å²	56	45.5 Å²	45.5	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	-40	174.1	-73.7	175.8	-15.6	0	0	112.2	I265 K266 I267 I272 H273 L304	I265-Q269 WeakPolarHBondContact O-CG 3.31Å; I265-Q269 PolarHBondContact O-N 2.84Å; K266-Q269 PolarHBondContact O-N 3.24Å; I267-Q269 PolarHBondContact O-N 3.4Å; Q269-I272 WeakPolarHBondContact O-CG2 3.32Å; Q269-H273 WeakPolarHBondContact O-CB 3.25Å; Q269-H273 PolarHBondContact O-CD2 3.36Å; Q269-H273 PolarHBondContact O-N 2.86Å; Q269-L304 HydrophobicContact CG-CD1 3.95Å
270	F	97.4	Very high	96	Very high	24 Å²	24	47.3 Å²	47.3	11%	0.105	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-48.6	174.4	171.2	-106	0	0	0	111.9	L236 L254 L260 K266 I267 A268 I272 H273 E274 L277	L236-F270 HydrophobicContact CD1-CE2 3.8Å; L236-F270 HydrophobicContact CD1-CZ 4.39Å; L254-F270 HydrophobicContact CD1-CD1 4.46Å; L254-F270 HydrophobicContact CD1-CE1 3.55Å; L254-F270 HydrophobicContact CD1-CE2 4.33Å; L254-F270 HydrophobicContact CD1-CZ 3.48Å; L254-F270 VanDerWaalsContact CD1-CZ 3.48Å; L260-F270 HydrophobicContact CD1-CB 3.66Å; L260-F270 HydrophobicContact CD1-CG 4.06Å; L260-F270 HydrophobicContact CD2-CB 4.35Å; L260-F270 HydrophobicContact CD2-CD1 3.86Å; L260-F270 HydrophobicContact CD2-CE1 4.45Å; L260-F270 HydrophobicContact CD2-CG 4.15Å; K266-F270 WeakPolarHBondContact O-CB 3.32Å; K266-F270 PolarHBondContact O-N 3.39Å; I267-F270 WeakPolarHBondContact O-CB 3.47Å; I267-F270 PolarHBondContact O-N 2.89Å; A268-F270 VanDerWaalsContact C-N 3.32Å; A268-F270 PolarHBondContact O-N 2.85Å; F270-I272 VanDerWaalsContact C-N 3.26Å; F270-I272 PolarHBondContact O-N 3.25Å; F270-H273 PolarHBondContact O-N 3.4Å; F270-E274 HydrophobicContact CD2-CB 3.9Å; F270-E274 HydrophobicContact CD2-CG 4.35Å; F270-E274 HydrophobicContact CE2-CB 3.61Å; F270-E274 HydrophobicContact CE2-CG 3.57Å; F270-E274 HydrophobicContact CZ-CB 4.11Å; F270-E274 HydrophobicContact CZ-CG 3.91Å; F270-E274 VanDerWaalsContact O-CB 3.23Å; F270-E274 WeakPolarHBondContact O-CB 3.12Å; F270-E274 PolarHBondContact O-N 2.97Å; F270-L277 HydrophobicContact CD1-CD1 4.18Å; F270-L277 HydrophobicContact CE1-CD1 3.7Å; F270-L277 HydrophobicContact CE1-CD2 4.18Å; F270-L277 HydrophobicContact CE1-CG 4.45Å; F270-L277 HydrophobicContact CZ-CD1 4.03Å; F270-L277 HydrophobicContact CZ-CD2 4.04Å; F270-L277 HydrophobicContact CZ-CG 4.38Å
271	L	97.5	Very high	96.1	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-28.8	-177.5	-67.1	-178.4	0	0	0	113.4	F243 I267 A268 L277 I282 Y285 F286 V297 F301	F243-L271 HydrophobicContact CD2-CD2 4.48Å; F243-L271 HydrophobicContact CE1-CD2 4.26Å; F243-L271 HydrophobicContact CE2-CD2 3.59Å; F243-L271 HydrophobicContact CZ-CD2 3.45Å; F243-L271 VanDerWaalsContact CZ-CD2 3.45Å; I267-L271 HydrophobicContact CG2-CD1 4.2Å; I267-L271 HydrophobicContact CG2-CG 4.27Å; I267-L271 VanDerWaalsContact O-CG 3.31Å; I267-L271 WeakPolarHBondContact O-CG 3.35Å; I267-L271 PolarHBondContact O-N 3.19Å; A268-L271 PolarHBondContact O-N 2.94Å; L271-L277 HydrophobicContact CD2-CD1 3.68Å; L271-I282 WeakPolarHBondContact O-CD1 3.28Å; L271-Y285 HydrophobicContact CD1-CD1 3.84Å; L271-Y285 HydrophobicContact CD1-CE1 4.08Å; L271-F286 HydrophobicContact CD1-CE1 3.67Å; L271-F286 HydrophobicContact CD1-CZ 3.85Å; L271-V297 HydrophobicContact CD1-CG1 3.79Å; L271-F301 HydrophobicContact CB-CD2 3.99Å; L271-F301 HydrophobicContact CB-CE2 3.88Å
272	I	95.8	Very high	96.2	Very high	40 Å²	40	42 Å²	42	21%	0.205	22%	0.216	C	C	.	.	H	α-helix	trans	-86.6	-32	-179.5	-161.9	170	0	0	0	112.8	A268 Q269 F270 F301 L304 I305	A268-I272 WeakPolarHBondContact O-CG2 3.3Å; A268-I272 PolarHBondContact O-N 3.46Å; A268-I272 VanDerWaalsContact O-N 3.11Å; Q269-I272 WeakPolarHBondContact O-CG2 3.32Å; F270-I272 VanDerWaalsContact C-N 3.26Å; F270-I272 PolarHBondContact O-N 3.25Å; I272-F301 HydrophobicContact CB-CD2 4.13Å; I272-F301 HydrophobicContact CB-CE2 3.6Å; I272-F301 HydrophobicContact CB-CZ 4.23Å; I272-F301 HydrophobicContact CG1-CE2 4.12Å; I272-F301 HydrophobicContact CG1-CZ 4.25Å; I272-L304 HydrophobicContact CD1-CB 4.13Å; I272-L304 HydrophobicContact CG2-CD1 4.03Å; I272-I305 HydrophobicContact CD1-CG1 4.2Å
273	H	95	Very high	96.2	Very high	135 Å²	135	38.3 Å²	38.3	63%	0.625	19%	0.19	S	C	*	.	H	α-helix	trans	-101.4	-22.6	-172.5	-66.2	-50	0	0	0	114.8	Q269 F270 P275	Q269-H273 WeakPolarHBondContact O-CB 3.25Å; Q269-H273 PolarHBondContact O-CD2 3.36Å; Q269-H273 PolarHBondContact O-N 2.86Å; F270-H273 PolarHBondContact O-N 3.4Å; H273-P275 VanDerWaalsContact O-CD 3.24Å; H273-P275 WeakPolarHBondContact O-CD 3.49Å
274	E	95.3	Very high	96.2	Very high	36 Å²	36	38.3 Å²	38.3	17%	0.168	19%	0.189	C	C	.	.			trans	-74.9	113.2	-176.8	-178.7	59.6	-138.7	0	0	111.6	F270 N276 L277	F270-E274 HydrophobicContact CD2-CB 3.9Å; F270-E274 HydrophobicContact CD2-CG 4.35Å; F270-E274 HydrophobicContact CE2-CB 3.61Å; F270-E274 HydrophobicContact CE2-CG 3.57Å; F270-E274 HydrophobicContact CZ-CB 4.11Å; F270-E274 HydrophobicContact CZ-CG 3.91Å; F270-E274 VanDerWaalsContact O-CB 3.23Å; F270-E274 WeakPolarHBondContact O-CB 3.12Å; F270-E274 PolarHBondContact O-N 2.97Å; E274-N276 HydrophobicContact CG-CB 4.41Å; E274-N276 PolarHBondContact O-N 3.29Å; E274-N276 PolarHBondContact OE1-ND2 3.07Å; E274-L277 HydrophobicContact CB-CD1 3.92Å; E274-L277 HydrophobicContact CB-CG 3.91Å; E274-L277 HydrophobicContact CG-CD1 4.29Å; E274-L277 HydrophobicContact CG-CD2 4.3Å; E274-L277 HydrophobicContact CG-CG 3.8Å; E274-L277 PolarHBondContact O-N 2.96Å
275	P	93.3	Very high	96.1	Very high	79 Å²	79	37.2 Å²	37.2	51%	0.513	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-15.3	-173.3	30.1	-37.2	0	0	0	113.7	H273 L277 P428	H273-P275 VanDerWaalsContact O-CD 3.24Å; H273-P275 WeakPolarHBondContact O-CD 3.49Å; P275-L277 VanDerWaalsContact C-N 3.33Å; P275-P428 VanDerWaalsContact O-CG 3.28Å; P275-P428 WeakPolarHBondContact O-CG 3.37Å
276	N	94.2	Very high	96.1	Very high	32 Å²	32	34.3 Å²	34.3	17%	0.171	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-2.4	-177	-67.6	-66.5	0	0	0	113.8	C240 N244 E274 R454	C240-N276 HydrophobicContact CB-CB 4.06Å; N244-N276 PolarHBondContact ND2-O 3.41Å; E274-N276 HydrophobicContact CG-CB 4.41Å; E274-N276 PolarHBondContact O-N 3.29Å; E274-N276 PolarHBondContact OE1-ND2 3.07Å; N276-R454 WeakPolarHBondContact OD1-CD 3.29Å; N276-R454 PolarHBondContact OD1-NH1 2.86Å
277	L	96.3	Very high	95.9	Very high	7 Å²	7	30.3 Å²	30.3	4%	0.037	15%	0.149	C	C	.	.	S	Bend	trans	-86	141.4	-179.4	-59.1	-177	0	0	0	111.7	C240 F243 F270 L271 E274 P275 I282	C240-L277 HydrophobicContact CB-CD2 4.04Å; F243-L277 HydrophobicContact CB-CD2 4.18Å; F243-L277 HydrophobicContact CD1-CD2 3.67Å; F243-L277 HydrophobicContact CD1-CG 4.47Å; F243-L277 HydrophobicContact CE1-CB 4.49Å; F243-L277 HydrophobicContact CE1-CD1 4.43Å; F243-L277 HydrophobicContact CE1-CD2 4.27Å; F243-L277 HydrophobicContact CG-CD2 4.01Å; F270-L277 HydrophobicContact CD1-CD1 4.18Å; F270-L277 HydrophobicContact CE1-CD1 3.7Å; F270-L277 HydrophobicContact CE1-CD2 4.18Å; F270-L277 HydrophobicContact CE1-CG 4.45Å; F270-L277 HydrophobicContact CZ-CD1 4.03Å; F270-L277 HydrophobicContact CZ-CD2 4.04Å; F270-L277 HydrophobicContact CZ-CG 4.38Å; L271-L277 HydrophobicContact CD2-CD1 3.68Å; E274-L277 HydrophobicContact CB-CD1 3.92Å; E274-L277 HydrophobicContact CB-CG 3.91Å; E274-L277 HydrophobicContact CG-CD1 4.29Å; E274-L277 HydrophobicContact CG-CD2 4.3Å; E274-L277 HydrophobicContact CG-CG 3.8Å; E274-L277 PolarHBondContact O-N 2.96Å; P275-L277 VanDerWaalsContact C-N 3.33Å; L277-I282 HydrophobicContact CB-CD1 4.09Å; L277-I282 HydrophobicContact CB-CG1 4.33Å
278	N	95.2	Very high	95.8	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	16%	0.16	C	C	.	.			trans	-84.3	127.8	176.4	-175.3	-75.4	0	0	0	110.4	N244 Q280 A281 I282 D427 S429 R451	N244-N278 HydrophobicContact CB-CB 4.27Å; N244-N278 WeakPolarHBondContact OD1-CB 3.43Å; N244-N278 PolarHBondContact OD1-N 3.25Å; N278-Q280 PolarHBondContact O-N 3.06Å; N278-Q280 WeakPolarHBondContact OD1-CA 3.41Å; N278-Q280 WeakPolarHBondContact OD1-CB 3.24Å; N278-Q280 PolarHBondContact OD1-N 2.77Å; N278-A281 HydrophobicContact CB-CB 4Å; N278-A281 WeakPolarHBondContact O-CA 3.42Å; N278-A281 WeakPolarHBondContact O-CB 3.21Å; N278-A281 PolarHBondContact O-N 2.9Å; N278-A281 PolarHBondContact OD1-N 3.43Å; N278-I282 WeakPolarHBondContact O-CG1 3.46Å; N278-I282 PolarHBondContact O-N 2.77Å; N278-D427 VanDerWaalsContact CA-OD1 3.23Å; N278-D427 WeakPolarHBondContact CA-OD1 2.97Å; N278-D427 PolarHBondContact ND2-OD2 3.05Å; N278-S429 PolarHBondContact ND2-OG 2.81Å; N278-R451 HydrophobicContact CB-CB 4.29Å
279	R	94.3	Very high	95.6	Very high	49 Å²	49	35.6 Å²	35.6	19%	0.185	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-28.4	-177.5	-66.9	-173	-169.9	-80.1	-5	114	G283 H322 H324 L425 P426 D427	R279-G283 PolarHBondContact O-N 2.9Å; R279-H322 PolarHBondContact NH1-O 2.79Å; R279-H324 HydrophobicContact CB-CB 4.44Å; R279-H324 PolarHBondContact O-N 2.62Å; R279-L425 VanDerWaalsContact CD-O 3.27Å; R279-L425 WeakPolarHBondContact CD-O 3.39Å; R279-L425 PolarHBondContact NE-O 3.15Å; R279-P426 PolarHBondContact NE-O 3.09Å; R279-P426 PolarHBondContact NH2-O 3.37Å; R279-D427 HydrophobicContact CG-CB 4.31Å; R279-D427 PolarHBondContact N-OD1 3.46Å
280	Q	93.6	Very high	95.4	Very high	86 Å²	86	39.9 Å²	39.9	40%	0.402	20%	0.202	S	C	.	.	H	α-helix	trans	-74.1	-37.4	171.9	-176.2	179.5	-0.1	0	0	111.9	N278 I282 G283 E284 H324	N278-Q280 PolarHBondContact O-N 3.06Å; N278-Q280 WeakPolarHBondContact OD1-CA 3.41Å; N278-Q280 WeakPolarHBondContact OD1-CB 3.24Å; N278-Q280 PolarHBondContact OD1-N 2.77Å; Q280-I282 VanDerWaalsContact C-N 3.31Å; Q280-I282 PolarHBondContact O-N 3.33Å; Q280-G283 PolarHBondContact O-N 2.78Å; Q280-E284 WeakPolarHBondContact O-CG 3.32Å; Q280-E284 PolarHBondContact O-N 2.97Å; Q280-H324 HydrophobicContact CB-CB 4.33Å
281	A	96.2	Very high	95.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.9	-38.1	172.7	0	0	0	0	0	111.7	F243 P247 N278 E284 Y285	F243-A281 HydrophobicContact CD1-CB 3.85Å; F243-A281 HydrophobicContact CE1-CB 3.65Å; P247-A281 HydrophobicContact CG-CB 4.19Å; P247-A281 WeakPolarHBondContact CG-O 3.36Å; N278-A281 HydrophobicContact CB-CB 4Å; N278-A281 WeakPolarHBondContact O-CA 3.42Å; N278-A281 WeakPolarHBondContact O-CB 3.21Å; N278-A281 PolarHBondContact O-N 2.9Å; N278-A281 PolarHBondContact OD1-N 3.43Å; A281-E284 PolarHBondContact O-N 3.44Å; A281-Y285 PolarHBondContact O-N 3.01Å
282	I	97	Very high	95.1	Very high	6 Å²	6	45.8 Å²	45.8	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-48	173.2	-62.2	172.3	0	0	0	111	F243 L271 L277 N278 Q280 E284 Y285 F286 F323	F243-I282 HydrophobicContact CE1-CG1 3.88Å; F243-I282 HydrophobicContact CZ-CG1 4.12Å; L271-I282 WeakPolarHBondContact O-CD1 3.28Å; L277-I282 HydrophobicContact CB-CD1 4.09Å; L277-I282 HydrophobicContact CB-CG1 4.33Å; N278-I282 WeakPolarHBondContact O-CG1 3.46Å; N278-I282 PolarHBondContact O-N 2.77Å; Q280-I282 VanDerWaalsContact C-N 3.31Å; Q280-I282 PolarHBondContact O-N 3.33Å; I282-E284 VanDerWaalsContact C-N 3.34Å; I282-E284 PolarHBondContact O-N 3.06Å; I282-Y285 WeakPolarHBondContact O-CB 3.33Å; I282-Y285 PolarHBondContact O-N 3.46Å; I282-F286 HydrophobicContact CG2-CD2 3.87Å; I282-F286 HydrophobicContact CG2-CE2 3.28Å; I282-F286 HydrophobicContact CG2-CZ 3.68Å; I282-F286 WeakPolarHBondContact O-CG 3.19Å; I282-F286 PolarHBondContact O-N 3.5Å; I282-F323 HydrophobicContact CB-CB 3.96Å; I282-F323 HydrophobicContact CG2-CB 3.56Å; I282-F323 HydrophobicContact CG2-CG 4.24Å
283	G	95.1	Very high	95.2	Very high	2 Å²	2	45.7 Å²	45.7	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-68.3	-29.9	178.3	0	0	0	0	0	114.6	R279 Q280 G287 H324	R279-G283 PolarHBondContact O-N 2.9Å; Q280-G283 PolarHBondContact O-N 2.78Å; G283-G287 PolarHBondContact O-N 2.65Å; G283-H324 VanDerWaalsContact CA-O 3.32Å; G283-H324 WeakPolarHBondContact CA-O 3.32Å
284	E	95.4	Very high	95.2	Very high	60 Å²	60	39.3 Å²	39.3	28%	0.28	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-40.7	169.7	-80.8	176	-160.3	0	0	111.8	P247 Q280 A281 I282 G287 R451	P247-E284 HydrophobicContact CG-CB 4.09Å; Q280-E284 WeakPolarHBondContact O-CG 3.32Å; Q280-E284 PolarHBondContact O-N 2.97Å; A281-E284 PolarHBondContact O-N 3.44Å; I282-E284 VanDerWaalsContact C-N 3.34Å; I282-E284 PolarHBondContact O-N 3.06Å; E284-G287 PolarHBondContact O-N 2.79Å; E284-G287 VanDerWaalsContact O-N 3.16Å; E284-R451 IonicContact OE1-CZ 2.97Å; E284-R451 VanDerWaalsContact OE1-CZ 3.23Å; E284-R451 IonicContact OE1-NH1 2.74Å; E284-R451 PolarHBondContact OE1-NH1 3.4Å; E284-R451 IonicContact OE1-NH2 2.9Å; E284-R451 PolarHBondContact OE1-NH2 3.43Å; E284-R451 IonicContact OE2-CZ 3.92Å; E284-R451 IonicContact OE2-NH1 3.36Å; E284-R451 PolarHBondContact OE2-NH1 3.39Å; E284-R451 IonicContact OE2-NH2 2.95Å; E284-R451 PolarHBondContact OE2-NH2 3.33Å
285	Y	97.5	Very high	95.3	Very high	3 Å²	3	39.4 Å²	39.4	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-47.4	174.8	-172.8	-107.2	0	0	0	111.9	F243 P247 V251 L271 A281 I282 G287 L288 A294 V297	F243-Y285 HydrophobicContact CE2-CD2 4.44Å; F243-Y285 HydrophobicContact CE2-CG 4.34Å; P247-Y285 HydrophobicContact CB-CD2 3.8Å; P247-Y285 HydrophobicContact CB-CG 4.16Å; V251-Y285 HydrophobicContact CB-CE2 4.37Å; V251-Y285 HydrophobicContact CG2-CD2 4.32Å; V251-Y285 HydrophobicContact CG2-CE2 3.79Å; L271-Y285 HydrophobicContact CD1-CD1 3.84Å; L271-Y285 HydrophobicContact CD1-CE1 4.08Å; A281-Y285 PolarHBondContact O-N 3.01Å; I282-Y285 WeakPolarHBondContact O-CB 3.33Å; I282-Y285 PolarHBondContact O-N 3.46Å; Y285-G287 PolarHBondContact O-N 3.05Å; Y285-L288 HydrophobicContact CD2-CD1 3.88Å; Y285-L288 HydrophobicContact CE2-CD1 4.32Å; Y285-L288 WeakPolarHBondContact O-CB 3.48Å; Y285-L288 WeakPolarHBondContact O-CD1 3.17Å; Y285-L288 VanDerWaalsContact O-CG 3.29Å; Y285-L288 WeakPolarHBondContact O-CG 3.44Å; Y285-L288 PolarHBondContact O-N 3.41Å; Y285-A294 HydrophobicContact CD1-CB 4.33Å; Y285-A294 HydrophobicContact CE1-CB 3.9Å; Y285-A294 HydrophobicContact CE2-CB 4.2Å; Y285-V297 HydrophobicContact CE1-CB 4.05Å; Y285-V297 HydrophobicContact CE1-CG1 3.96Å; Y285-V297 HydrophobicContact CE1-CG2 4.3Å
286	F	96.7	Very high	95.5	Very high	9 Å²	9	41.9 Å²	41.9	4%	0.039	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-19.2	176.2	-62.9	-28.3	0	0	0	113.5	L271 I282 L288 V297 L298 F301 F323	L271-F286 HydrophobicContact CD1-CE1 3.67Å; L271-F286 HydrophobicContact CD1-CZ 3.85Å; I282-F286 HydrophobicContact CG2-CD2 3.87Å; I282-F286 HydrophobicContact CG2-CE2 3.28Å; I282-F286 HydrophobicContact CG2-CZ 3.68Å; I282-F286 WeakPolarHBondContact O-CG 3.19Å; I282-F286 PolarHBondContact O-N 3.5Å; F286-L288 VanDerWaalsContact C-N 3.27Å; F286-L288 PolarHBondContact O-N 3.44Å; F286-V297 HydrophobicContact CE1-CG1 4.09Å; F286-L298 HydrophobicContact CB-CD1 4.04Å; F286-L298 HydrophobicContact CB-CD2 4.35Å; F286-L298 HydrophobicContact CD1-CB 3.85Å; F286-L298 HydrophobicContact CD1-CD1 4.07Å; F286-L298 HydrophobicContact CD1-CG 4.5Å; F286-L298 HydrophobicContact CD2-CD1 3.83Å; F286-L298 HydrophobicContact CE1-CB 4.35Å; F286-L298 HydrophobicContact CE2-CD1 4.26Å; F286-L298 HydrophobicContact CG-CB 4.27Å; F286-L298 HydrophobicContact CG-CD1 3.73Å; F286-L298 HydrophobicContact CG-CG 4.45Å; F286-F301 HydrophobicContact CE1-CB 4.36Å; F286-F301 HydrophobicContact CE1-CG 4.42Å; F286-F301 AromaticContact CE2-CD1 3.8Å; F286-F301 HydrophobicContact CE2-CD1 3.8Å; F286-F301 HydrophobicContact CE2-CD2 4.3Å; F286-F301 AromaticContact CE2-CE1 3.92Å; F286-F301 HydrophobicContact CE2-CE1 3.92Å; F286-F301 HydrophobicContact CE2-CE2 4.36Å; F286-F301 HydrophobicContact CE2-CG 4Å; F286-F301 HydrophobicContact CE2-CZ 4.19Å; F286-F301 HydrophobicContact CZ-CB 3.86Å; F286-F301 AromaticContact CZ-CD1 3.79Å; F286-F301 HydrophobicContact CZ-CD1 3.79Å; F286-F301 AromaticContact CZ-CD2 3.63Å; F286-F301 HydrophobicContact CZ-CD2 3.63Å; F286-F301 HydrophobicContact CZ-CE1 4.2Å; F286-F301 HydrophobicContact CZ-CE2 4.01Å; F286-F301 AromaticContact CZ-CG 3.48Å; F286-F301 HydrophobicContact CZ-CG 3.48Å; F286-F301 VanDerWaalsContact CZ-CG 3.48Å; F286-F301 HydrophobicContact CZ-CZ 4.29Å; F286-F323 AromaticContact CD2-CD1 3.96Å; F286-F323 HydrophobicContact CD2-CD1 3.96Å; F286-F323 AromaticContact CD2-CD2 3.9Å; F286-F323 HydrophobicContact CD2-CD2 3.9Å; F286-F323 HydrophobicContact CD2-CE1 4.01Å; F286-F323 AromaticContact CD2-CE2 3.97Å; F286-F323 HydrophobicContact CD2-CE2 3.97Å; F286-F323 AromaticContact CD2-CG 3.9Å; F286-F323 HydrophobicContact CD2-CG 3.9Å; F286-F323 HydrophobicContact CD2-CZ 4.02Å; F286-F323 HydrophobicContact CE2-CB 4.47Å; F286-F323 AromaticContact CE2-CD1 3.76Å; F286-F323 HydrophobicContact CE2-CD1 3.76Å; F286-F323 HydrophobicContact CE2-CD2 4.44Å; F286-F323 HydrophobicContact CE2-CE1 4.06Å; F286-F323 AromaticContact CE2-CG 3.96Å; F286-F323 HydrophobicContact CE2-CG 3.96Å
287	G	94	Very high	95.7	Very high	4 Å²	4	40.3 Å²	40.3	4%	0.041	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.9	174	0	0	0	0	0	115	G283 E284 Y285 L289 K331	G283-G287 PolarHBondContact O-N 2.65Å; E284-G287 PolarHBondContact O-N 2.79Å; E284-G287 VanDerWaalsContact O-N 3.16Å; Y285-G287 PolarHBondContact O-N 3.05Å; G287-L289 PolarHBondContact O-N 2.97Å; G287-K331 WeakPolarHBondContact O-CD 3.3Å; G287-K331 WeakPolarHBondContact O-CE 3.43Å; G287-K331 WeakPolarHBondContact O-CG 2.81Å
288	L	95.3	Very high	95.7	Very high	43 Å²	43	40 Å²	40	23%	0.225	20%	0.203	C	C	.	.			trans	-79.8	80.6	-177.4	-60.9	169.6	0	0	0	111.6	V248 Y285 F286 D290 N291 A294	V248-L288 HydrophobicContact CG2-CD1 3.23Å; V248-L288 HydrophobicContact CG2-CD2 4.4Å; V248-L288 HydrophobicContact CG2-CG 4.45Å; Y285-L288 HydrophobicContact CD2-CD1 3.88Å; Y285-L288 HydrophobicContact CE2-CD1 4.32Å; Y285-L288 WeakPolarHBondContact O-CB 3.48Å; Y285-L288 WeakPolarHBondContact O-CD1 3.17Å; Y285-L288 VanDerWaalsContact O-CG 3.29Å; Y285-L288 WeakPolarHBondContact O-CG 3.44Å; Y285-L288 PolarHBondContact O-N 3.41Å; F286-L288 VanDerWaalsContact C-N 3.27Å; F286-L288 PolarHBondContact O-N 3.44Å; L288-D290 PolarHBondContact O-N 3.1Å; L288-N291 HydrophobicContact CB-CB 3.76Å; L288-N291 PolarHBondContact O-N 2.94Å; L288-N291 VanDerWaalsContact O-N 3.09Å; L288-A294 HydrophobicContact CB-CB 4.1Å; L288-A294 HydrophobicContact CD1-CB 4.38Å
289	L	93.8	Very high	95.9	Very high	68 Å²	68	43.2 Å²	43.2	36%	0.356	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-26.3	-173.9	-56	-175	0	0	0	114.2	G287 Q330 K331 N334	G287-L289 PolarHBondContact O-N 2.97Å; L289-Q330 HydrophobicContact CD1-CB 3.93Å; L289-K331 HydrophobicContact CD1-CG 4.3Å; L289-K331 HydrophobicContact CD2-CG 4.47Å; L289-K331 HydrophobicContact CG-CG 4.26Å; L289-N334 HydrophobicContact CD2-CB 3.51Å; L289-N334 VanDerWaalsContact CD2-CG 3.47Å; L289-N334 WeakPolarHBondContact CD2-ND2 3.44Å
290	D	94.2	Very high	96.1	Very high	146 Å²	146	43.8 Å²	43.8	78%	0.781	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.3	178.1	62.5	-30	0	0	0	113.1	L288	L288-D290 PolarHBondContact O-N 3.1Å
291	N	94.3	Very high	96.3	Very high	42 Å²	42	39.7 Å²	39.7	23%	0.225	20%	0.202	C	C	.	.			trans	-94	105.8	-178	-170.8	-42	0	0	0	111.3	L288 L293 A294 M295	L288-N291 HydrophobicContact CB-CB 3.76Å; L288-N291 PolarHBondContact O-N 2.94Å; L288-N291 VanDerWaalsContact O-N 3.09Å; N291-L293 VanDerWaalsContact C-N 3.28Å; N291-L293 PolarHBondContact O-N 3.38Å; N291-L293 WeakPolarHBondContact OD1-CB 3.38Å; N291-L293 PolarHBondContact OD1-N 3.07Å; N291-A294 HydrophobicContact CB-CB 3.87Å; N291-A294 PolarHBondContact O-N 3.38Å; N291-A294 PolarHBondContact OD1-N 3.12Å; N291-M295 WeakPolarHBondContact O-CG 3.39Å; N291-M295 PolarHBondContact O-N 3Å
292	T	95.3	Very high	96.4	Very high	111 Å²	111	39.7 Å²	39.7	68%	0.681	20%	0.202	S	C	*	.	H	α-helix	trans	-61.3	-33.5	-178.6	58.2	0	0	0	0	113.5	K296	T292-K296 WeakPolarHBondContact O-CG 3.21Å; T292-K296 PolarHBondContact O-N 3.46Å
293	L	96.4	Very high	96.4	Very high	38 Å²	38	42.3 Å²	42.3	20%	0.199	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-50.3	176	178.9	62.1	0	0	0	110.1	P264 I267 N291 M295 K296 V297	P264-L293 HydrophobicContact CG-CD1 3.91Å; I267-L293 HydrophobicContact CD1-CD1 4.06Å; I267-L293 HydrophobicContact CD1-CD2 3.93Å; I267-L293 HydrophobicContact CD1-CG 4.2Å; N291-L293 VanDerWaalsContact C-N 3.28Å; N291-L293 PolarHBondContact O-N 3.38Å; N291-L293 WeakPolarHBondContact OD1-CB 3.38Å; N291-L293 PolarHBondContact OD1-N 3.07Å; L293-M295 PolarHBondContact O-N 3.48Å; L293-K296 PolarHBondContact O-N 3.24Å; L293-K296 VanDerWaalsContact O-N 3.08Å; L293-V297 HydrophobicContact CD1-CG2 4.2Å; L293-V297 HydrophobicContact CG-CG2 4.26Å; L293-V297 VanDerWaalsContact O-CG2 3.23Å; L293-V297 WeakPolarHBondContact O-CG2 3.2Å; L293-V297 PolarHBondContact O-N 3.32Å
294	A	96.6	Very high	96.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.1	-38.5	179.9	0	0	0	0	0	112.3	Y285 L288 N291 V297 L298	Y285-A294 HydrophobicContact CD1-CB 4.33Å; Y285-A294 HydrophobicContact CE1-CB 3.9Å; Y285-A294 HydrophobicContact CE2-CB 4.2Å; L288-A294 HydrophobicContact CB-CB 4.1Å; L288-A294 HydrophobicContact CD1-CB 4.38Å; N291-A294 HydrophobicContact CB-CB 3.87Å; N291-A294 PolarHBondContact O-N 3.38Å; N291-A294 PolarHBondContact OD1-N 3.12Å; A294-V297 PolarHBondContact O-N 2.79Å; A294-L298 PolarHBondContact O-N 3.25Å
295	M	96.2	Very high	96.6	Very high	38 Å²	38	43.1 Å²	43.1	19%	0.187	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-42.6	175.1	-74.9	-56.1	-55.2	0	0	113.3	N291 L293 K299 N334 I338	N291-M295 WeakPolarHBondContact O-CG 3.39Å; N291-M295 PolarHBondContact O-N 3Å; L293-M295 PolarHBondContact O-N 3.48Å; M295-K299 PolarHBondContact O-N 3.01Å; M295-N334 WeakPolarHBondContact CE-ND2 3.39Å; M295-N334 VanDerWaalsContact CE-OD1 3.26Å; M295-N334 WeakPolarHBondContact CE-OD1 3.36Å; M295-N334 PolarHBondContact SD-ND2 3Å; M295-I338 HydrophobicContact CE-CD1 4Å; M295-I338 HydrophobicContact CE-CG1 4.01Å
296	K	97.4	Very high	96.6	Very high	131 Å²	131	48.2 Å²	48.2	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-65.6	-43.7	173.7	-70.6	177.6	-179.8	-175.6	0	111.1	P264 T292 L293 L298 K299 E300	P264-K296 HydrophobicContact CB-CB 3.92Å; P264-K296 HydrophobicContact CG-CB 3.86Å; P264-K296 HydrophobicContact CG-CD 4.17Å; T292-K296 WeakPolarHBondContact O-CG 3.21Å; T292-K296 PolarHBondContact O-N 3.46Å; L293-K296 PolarHBondContact O-N 3.24Å; L293-K296 VanDerWaalsContact O-N 3.08Å; K296-L298 VanDerWaalsContact C-N 3.32Å; K296-L298 PolarHBondContact O-N 3.08Å; K296-K299 PolarHBondContact O-N 3.23Å; K296-E300 PolarHBondContact O-N 3.36Å
297	V	98.3	Very high	96.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-42.3	178	177.7	0	0	0	0	111	P264 I267 A268 L271 Y285 F286 L293 A294 K299 E300 F301	P264-V297 HydrophobicContact CB-CG2 4.13Å; I267-V297 HydrophobicContact CB-CG1 4.16Å; I267-V297 HydrophobicContact CB-CG2 3.88Å; I267-V297 HydrophobicContact CD1-CG2 4.07Å; I267-V297 HydrophobicContact CG2-CB 4.48Å; I267-V297 HydrophobicContact CG2-CG1 3.73Å; I267-V297 HydrophobicContact CG2-CG2 3.85Å; A268-V297 HydrophobicContact CB-CG1 4.21Å; L271-V297 HydrophobicContact CD1-CG1 3.79Å; Y285-V297 HydrophobicContact CE1-CB 4.05Å; Y285-V297 HydrophobicContact CE1-CG1 3.96Å; Y285-V297 HydrophobicContact CE1-CG2 4.3Å; F286-V297 HydrophobicContact CE1-CG1 4.09Å; L293-V297 HydrophobicContact CD1-CG2 4.2Å; L293-V297 HydrophobicContact CG-CG2 4.26Å; L293-V297 VanDerWaalsContact O-CG2 3.23Å; L293-V297 WeakPolarHBondContact O-CG2 3.2Å; L293-V297 PolarHBondContact O-N 3.32Å; A294-V297 PolarHBondContact O-N 2.79Å; V297-K299 VanDerWaalsContact C-N 3.33Å; V297-K299 PolarHBondContact O-N 3.22Å; V297-E300 PolarHBondContact O-N 2.73Å; V297-F301 WeakPolarHBondContact O-CB 3.38Å; V297-F301 PolarHBondContact O-N 3.1Å
298	L	98	Very high	96.7	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-58	-45.2	176.2	172.6	59.1	0	0	0	111.5	F286 A294 K296 F301 L302 L335 I338	F286-L298 HydrophobicContact CB-CD1 4.04Å; F286-L298 HydrophobicContact CB-CD2 4.35Å; F286-L298 HydrophobicContact CD1-CB 3.85Å; F286-L298 HydrophobicContact CD1-CD1 4.07Å; F286-L298 HydrophobicContact CD1-CG 4.5Å; F286-L298 HydrophobicContact CD2-CD1 3.83Å; F286-L298 HydrophobicContact CE1-CB 4.35Å; F286-L298 HydrophobicContact CE2-CD1 4.26Å; F286-L298 HydrophobicContact CG-CB 4.27Å; F286-L298 HydrophobicContact CG-CD1 3.73Å; F286-L298 HydrophobicContact CG-CG 4.45Å; A294-L298 PolarHBondContact O-N 3.25Å; K296-L298 VanDerWaalsContact C-N 3.32Å; K296-L298 PolarHBondContact O-N 3.08Å; L298-F301 PolarHBondContact O-N 3.16Å; L298-L302 HydrophobicContact CD1-CD1 4.45Å; L298-L302 HydrophobicContact CD1-CD2 4.36Å; L298-L302 HydrophobicContact CD1-CG 4.11Å; L298-L302 WeakPolarHBondContact O-CG 3.02Å; L298-L302 PolarHBondContact O-N 3.17Å; L298-L335 HydrophobicContact CD1-CD1 3.95Å; L298-L335 HydrophobicContact CD2-CD1 4.3Å; L298-I338 HydrophobicContact CD2-CB 4.24Å; L298-I338 HydrophobicContact CD2-CG1 4.1Å; L298-I338 HydrophobicContact CD2-CG2 4.4Å; L298-I338 HydrophobicContact CG-CB 4.46Å; L298-I338 HydrophobicContact CG-CG2 4.09Å
299	K	98	Very high	96.7	Very high	70 Å²	70	58.7 Å²	58.7	30%	0.304	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-47.9	178.4	-174.9	167.3	-177.6	155.5	0	111.9	M295 K296 V297 F301 L302 L303 I338 E341 V342	M295-K299 PolarHBondContact O-N 3.01Å; K296-K299 PolarHBondContact O-N 3.23Å; V297-K299 VanDerWaalsContact C-N 3.33Å; V297-K299 PolarHBondContact O-N 3.22Å; K299-F301 VanDerWaalsContact C-N 3.32Å; K299-F301 PolarHBondContact O-N 3.29Å; K299-L302 PolarHBondContact O-N 2.84Å; K299-L303 HydrophobicContact CG-CD1 4.41Å; K299-L303 WeakPolarHBondContact O-CG 3.36Å; K299-L303 PolarHBondContact O-N 3.49Å; K299-L303 VanDerWaalsContact O-N 3.09Å; K299-I338 HydrophobicContact CB-CG2 4.01Å; K299-I338 HydrophobicContact CG-CG2 4.39Å; K299-E341 IonicContact NZ-OE2 2.77Å; K299-E341 PolarHBondContact NZ-OE2 3.31Å; K299-V342 HydrophobicContact CG-CG2 4.2Å
300	E	98.1	Very high	96.8	Very high	61 Å²	61	57.7 Å²	57.7	29%	0.285	29%	0.292	S	S	.	.	H	α-helix	trans	-62.4	-39	175.7	-64.6	-54.7	150.9	0	0	112	P264 I265 A268 K296 V297 L302 L303 L304	P264-E300 HydrophobicContact CB-CG 4.06Å; I265-E300 HydrophobicContact CG1-CG 3.91Å; A268-E300 HydrophobicContact CB-CB 3.79Å; K296-E300 PolarHBondContact O-N 3.36Å; V297-E300 PolarHBondContact O-N 2.73Å; E300-L302 PolarHBondContact O-N 2.95Å; E300-L303 WeakPolarHBondContact O-CB 3.47Å; E300-L303 PolarHBondContact O-N 2.9Å; E300-L304 WeakPolarHBondContact O-CG 3.06Å; E300-L304 PolarHBondContact O-N 2.84Å
301	F	98.4	Very high	96.9	Very high	1 Å²	1	52.9 Å²	52.9	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-44.5	177.5	-176.3	-85.4	0	0	0	112	A268 L271 I272 F286 V297 L298 K299 L303 L304 I305 H322 F323	A268-F301 HydrophobicContact CB-CB 4.01Å; L271-F301 HydrophobicContact CB-CD2 3.99Å; L271-F301 HydrophobicContact CB-CE2 3.88Å; I272-F301 HydrophobicContact CB-CD2 4.13Å; I272-F301 HydrophobicContact CB-CE2 3.6Å; I272-F301 HydrophobicContact CB-CZ 4.23Å; I272-F301 HydrophobicContact CG1-CE2 4.12Å; I272-F301 HydrophobicContact CG1-CZ 4.25Å; F286-F301 HydrophobicContact CE1-CB 4.36Å; F286-F301 HydrophobicContact CE1-CG 4.42Å; F286-F301 AromaticContact CE2-CD1 3.8Å; F286-F301 HydrophobicContact CE2-CD1 3.8Å; F286-F301 HydrophobicContact CE2-CD2 4.3Å; F286-F301 AromaticContact CE2-CE1 3.92Å; F286-F301 HydrophobicContact CE2-CE1 3.92Å; F286-F301 HydrophobicContact CE2-CE2 4.36Å; F286-F301 HydrophobicContact CE2-CG 4Å; F286-F301 HydrophobicContact CE2-CZ 4.19Å; F286-F301 HydrophobicContact CZ-CB 3.86Å; F286-F301 AromaticContact CZ-CD1 3.79Å; F286-F301 HydrophobicContact CZ-CD1 3.79Å; F286-F301 AromaticContact CZ-CD2 3.63Å; F286-F301 HydrophobicContact CZ-CD2 3.63Å; F286-F301 HydrophobicContact CZ-CE1 4.2Å; F286-F301 HydrophobicContact CZ-CE2 4.01Å; F286-F301 AromaticContact CZ-CG 3.48Å; F286-F301 HydrophobicContact CZ-CG 3.48Å; F286-F301 VanDerWaalsContact CZ-CG 3.48Å; F286-F301 HydrophobicContact CZ-CZ 4.29Å; V297-F301 WeakPolarHBondContact O-CB 3.38Å; V297-F301 PolarHBondContact O-N 3.1Å; L298-F301 PolarHBondContact O-N 3.16Å; K299-F301 VanDerWaalsContact C-N 3.32Å; K299-F301 PolarHBondContact O-N 3.29Å; F301-L303 VanDerWaalsContact C-N 3.3Å; F301-L303 PolarHBondContact O-N 3.06Å; F301-L304 PolarHBondContact O-N 3.42Å; F301-I305 HydrophobicContact CD1-CD1 4.22Å; F301-I305 HydrophobicContact CE1-CD1 3.88Å; F301-H322 HydrophobicContact CE1-CB 3.94Å; F301-H322 HydrophobicContact CZ-CB 3.86Å; F301-F323 AromaticContact CE1-CD1 3.82Å; F301-F323 HydrophobicContact CE1-CD1 3.82Å; F301-F323 HydrophobicContact CE1-CE1 4.23Å; F301-F323 HydrophobicContact CZ-CD1 4.41Å
302	L	98.1	Very high	97.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.5	-30.9	175.9	-64.7	-164.8	0	0	0	112.4	L298 K299 E300 L304 I305 V319 F323 L335 I338 F339 V342	L298-L302 HydrophobicContact CD1-CD1 4.45Å; L298-L302 HydrophobicContact CD1-CD2 4.36Å; L298-L302 HydrophobicContact CD1-CG 4.11Å; L298-L302 WeakPolarHBondContact O-CG 3.02Å; L298-L302 PolarHBondContact O-N 3.17Å; K299-L302 PolarHBondContact O-N 2.84Å; E300-L302 PolarHBondContact O-N 2.95Å; L302-L304 VanDerWaalsContact C-N 3.26Å; L302-L304 PolarHBondContact O-N 3.49Å; L302-I305 HydrophobicContact CD2-CD1 4.2Å; L302-I305 PolarHBondContact O-N 2.67Å; L302-V319 HydrophobicContact CD2-CB 4.32Å; L302-V319 HydrophobicContact CD2-CG1 3.44Å; L302-V319 VanDerWaalsContact CD2-CG1 3.44Å; L302-V319 HydrophobicContact CD2-CG2 3.95Å; L302-F323 HydrophobicContact CD2-CE1 4.35Å; L302-L335 HydrophobicContact CD1-CD1 4.38Å; L302-I338 HydrophobicContact CD1-CG2 4.04Å; L302-F339 HydrophobicContact CD1-CB 4.17Å; L302-V342 HydrophobicContact CB-CB 4.22Å; L302-V342 HydrophobicContact CB-CG1 4.06Å; L302-V342 HydrophobicContact CB-CG2 4.03Å
303	L	97.8	Very high	97.2	Very high	60 Å²	60	45.7 Å²	45.7	31%	0.314	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-28.3	175	-77	164.4	0	0	0	112.8	K299 E300 F301 I305 V342 I345 Q346	K299-L303 HydrophobicContact CG-CD1 4.41Å; K299-L303 WeakPolarHBondContact O-CG 3.36Å; K299-L303 PolarHBondContact O-N 3.49Å; K299-L303 VanDerWaalsContact O-N 3.09Å; E300-L303 WeakPolarHBondContact O-CB 3.47Å; E300-L303 PolarHBondContact O-N 2.9Å; F301-L303 VanDerWaalsContact C-N 3.3Å; F301-L303 PolarHBondContact O-N 3.06Å; L303-I305 VanDerWaalsContact C-N 3.29Å; L303-V342 HydrophobicContact CD2-CG1 3.86Å; L303-V342 HydrophobicContact CD2-CG2 4.48Å; L303-V342 HydrophobicContact CG-CG1 4.06Å; L303-V342 HydrophobicContact CG-CG2 4.23Å; L303-I345 HydrophobicContact CD2-CG2 4.44Å; L303-Q346 PolarHBondContact O-NE2 2.8Å
304	L	97.4	Very high	97.2	Very high	75 Å²	75	46.1 Å²	46.1	39%	0.393	23%	0.227	S	C	.	.	H	α-helix	trans	-73	-20.3	175.1	-64.1	174.1	0	0	0	113.1	A268 Q269 I272 E300 F301 L302	A268-L304 HydrophobicContact CB-CD1 4.05Å; Q269-L304 HydrophobicContact CG-CD1 3.95Å; I272-L304 HydrophobicContact CD1-CB 4.13Å; I272-L304 HydrophobicContact CG2-CD1 4.03Å; E300-L304 WeakPolarHBondContact O-CG 3.06Å; E300-L304 PolarHBondContact O-N 2.84Å; F301-L304 PolarHBondContact O-N 3.42Å; L302-L304 VanDerWaalsContact C-N 3.26Å; L302-L304 PolarHBondContact O-N 3.49Å
305	I	97.3	Very high	97.3	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.227	C	C	.	.	S	Bend	trans	-84.4	120.6	179.1	-59.1	175.5	0	0	0	108.7	I272 F301 L302 L303 M307 S318 V319 H322 Q346	I272-I305 HydrophobicContact CD1-CG1 4.2Å; F301-I305 HydrophobicContact CD1-CD1 4.22Å; F301-I305 HydrophobicContact CE1-CD1 3.88Å; L302-I305 HydrophobicContact CD2-CD1 4.2Å; L302-I305 PolarHBondContact O-N 2.67Å; L303-I305 VanDerWaalsContact C-N 3.29Å; I305-M307 HydrophobicContact CG2-CG 4.16Å; I305-M307 PolarHBondContact O-N 2.98Å; I305-M307 VanDerWaalsContact O-N 3.16Å; I305-S318 VanDerWaalsContact CG2-OG 3.3Å; I305-S318 WeakPolarHBondContact CG2-OG 3.28Å; I305-V319 HydrophobicContact CD1-CG2 4.18Å; I305-V319 HydrophobicContact CG2-CG2 4.48Å; I305-H322 HydrophobicContact CD1-CB 4.2Å; I305-Q346 PolarHBondContact O-NE2 3.42Å; I305-Q346 PolarHBondContact O-OE1 3.49Å
306	N	96.5	Very high	97.3	Very high	109 Å²	109	44.4 Å²	44.4	58%	0.583	22%	0.218	S	C	*	.			trans	-72	109.9	176.6	-176.6	19.9	0	0	0	110.5	K308 M310	N306-K308 WeakPolarHBondContact OD1-CB 3.44Å; N306-K308 WeakPolarHBondContact OD1-CG 3.25Å; N306-K308 PolarHBondContact OD1-N 3.22Å; N306-K308 VanDerWaalsContact OD1-N 3.16Å; N306-M310 VanDerWaalsContact O-SD 3.35Å
307	M	96.8	Very high	97.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.201	C	C	.	.			trans	-114.1	8	175.9	-61.4	-179.5	-74.1	0	0	112.3	I305 N309 M310 A315 V319 F339 V342 N347	I305-M307 HydrophobicContact CG2-CG 4.16Å; I305-M307 PolarHBondContact O-N 2.98Å; I305-M307 VanDerWaalsContact O-N 3.16Å; M307-N309 PolarHBondContact O-N 3.5Å; M307-M310 WeakPolarHBondContact O-CB 3.34Å; M307-M310 PolarHBondContact O-N 3.18Å; M307-A315 HydrophobicContact CB-CB 3.95Å; M307-A315 HydrophobicContact CG-CB 3.94Å; M307-A315 HydrophobicContact SD-CB 3.98Å; M307-V319 HydrophobicContact SD-CG2 3.66Å; M307-F339 HydrophobicContact SD-CD2 4.18Å; M307-F339 HydrophobicContact SD-CE2 3.71Å; M307-V342 HydrophobicContact CE-CB 4.21Å; M307-V342 HydrophobicContact CE-CG1 3.48Å; M307-V342 VanDerWaalsContact CE-CG1 3.48Å; M307-N347 PolarHBondContact O-ND2 3.31Å; M307-N347 PolarHBondContact O-OD1 2.87Å
308	K	96.2	Very high	97.2	Very high	131 Å²	131	42.4 Å²	42.4	57%	0.57	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	133.7	-177	-64	179.5	-179.7	179.9	0	110.9	N306 M310 Q346 N347	N306-K308 WeakPolarHBondContact OD1-CB 3.44Å; N306-K308 WeakPolarHBondContact OD1-CG 3.25Å; N306-K308 PolarHBondContact OD1-N 3.22Å; N306-K308 VanDerWaalsContact OD1-N 3.16Å; K308-M310 PolarHBondContact O-N 2.93Å; K308-Q346 HydrophobicContact CG-CB 4.21Å; K308-N347 WeakPolarHBondContact CA-OD1 3.37Å
309	N	95.3	Very high	97.1	Very high	146 Å²	146	42.4 Å²	42.4	78%	0.781	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	17.8	-179.3	-53.3	-42.2	0	0	0	114.8	M307 N347 R350	M307-N309 PolarHBondContact O-N 3.5Å; N309-N347 PolarHBondContact N-OD1 2.93Å; N309-R350 PolarHBondContact O-NH1 3.17Å
310	M	97	Very high	97	Very high	46 Å²	46	39.1 Å²	39.1	23%	0.227	20%	0.198	C	C	.	.			trans	-96.9	150.8	179.1	-60.4	178.6	73.2	0	0	111.3	N306 M307 K308 V314 A315 Y343 R350	N306-M310 VanDerWaalsContact O-SD 3.35Å; M307-M310 WeakPolarHBondContact O-CB 3.34Å; M307-M310 PolarHBondContact O-N 3.18Å; K308-M310 PolarHBondContact O-N 2.93Å; M310-V314 HydrophobicContact CB-CB 4.44Å; M310-V314 HydrophobicContact CE-CB 4.14Å; M310-V314 HydrophobicContact CE-CG1 3.42Å; M310-V314 VanDerWaalsContact CE-CG1 3.42Å; M310-V314 WeakPolarHBondContact CE-O 3.05Å; M310-A315 HydrophobicContact CB-CB 4.09Å; M310-Y343 PolarHBondContact O-OH 2.84Å; M310-R350 PolarHBondContact O-NH1 3.05Å
311	E	96.7	Very high	96.8	Very high	45 Å²	45	36.6 Å²	36.6	21%	0.21	19%	0.188	C	C	.	.			trans	-75.9	160.5	171.2	-71.5	-173.1	166.5	0	0	110	D313 V314 A315 R350 L409 R416	E311-D313 VanDerWaalsContact C-N 3.29Å; E311-D313 WeakPolarHBondContact CB-OD1 3.41Å; E311-D313 PolarHBondContact O-N 3.29Å; E311-V314 HydrophobicContact CB-CG2 4.09Å; E311-V314 PolarHBondContact O-N 3.14Å; E311-A315 WeakPolarHBondContact O-CB 3.29Å; E311-A315 PolarHBondContact O-N 2.95Å; E311-R350 VanDerWaalsContact N-NH1 3.17Å; E311-R350 IonicContact OE1-CZ 2.81Å; E311-R350 IonicContact OE1-NH2 3.65Å; E311-R350 PolarHBondContact OE1-NH2 3.2Å; E311-L409 HydrophobicContact CG-CD1 4.41Å; E311-R416 IonicContact OE2-CZ 2.78Å; E311-R416 IonicContact OE2-NH1 3.94Å; E311-R416 PolarHBondContact OE2-NH1 3.49Å; E311-R416 IonicContact OE2-NH2 2.97Å; E311-R416 PolarHBondContact OE2-NH2 3.4Å
312	V	97.3	Very high	96.6	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-53.8	-45.5	-174.2	177.1	0	0	0	0	111.5	L316 F339 Y343 F355 V361 L364 A365	V312-L316 WeakPolarHBondContact O-CB 3.38Å; V312-L316 PolarHBondContact O-N 3.44Å; V312-F339 HydrophobicContact CG1-CE1 4.17Å; V312-Y343 HydrophobicContact CG2-CE1 3.98Å; V312-Y343 PolarHBondContact N-OH 3.39Å; V312-F355 HydrophobicContact CG2-CE2 4.31Å; V312-F355 HydrophobicContact CG2-CZ 4.18Å; V312-V361 HydrophobicContact CG1-CG1 4.46Å; V312-V361 HydrophobicContact CG2-CG1 4.32Å; V312-L364 HydrophobicContact CB-CD2 4.4Å; V312-L364 HydrophobicContact CG1-CG 4.5Å; V312-L364 HydrophobicContact CG2-CD2 4.26Å; V312-A365 HydrophobicContact CG1-CB 4.03Å
313	D	97.1	Very high	96.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.1	-33.9	178.9	67.5	-58.1	0	0	0	113.2	E311 R317 V368 I413 R416 I417	E311-D313 VanDerWaalsContact C-N 3.29Å; E311-D313 WeakPolarHBondContact CB-OD1 3.41Å; E311-D313 PolarHBondContact O-N 3.29Å; D313-R317 VanDerWaalsContact O-CB 3.29Å; D313-R317 WeakPolarHBondContact O-CB 3.49Å; D313-R317 PolarHBondContact O-N 3.37Å; D313-V368 HydrophobicContact CB-CG1 3.96Å; D313-V368 HydrophobicContact CB-CG2 4.37Å; D313-I413 HydrophobicContact CB-CG1 4.2Å; D313-I413 HydrophobicContact CB-CG2 4.16Å; D313-R416 VanDerWaalsContact CG-NH2 3.27Å; D313-R416 IonicContact OD1-CZ 3.03Å; D313-R416 IonicContact OD1-NE 2.77Å; D313-R416 IonicContact OD1-NH2 3.95Å; D313-R416 PolarHBondContact OD1-NH2 3.45Å; D313-R416 IonicContact OD2-CZ 3.12Å; D313-R416 IonicContact OD2-NE 3.4Å; D313-R416 PolarHBondContact OD2-NE 3.5Å; D313-R416 IonicContact OD2-NH2 3.5Å; D313-R416 PolarHBondContact OD2-NH2 2.95Å; D313-I417 HydrophobicContact CB-CD1 4.29Å
314	V	97.6	Very high	96.2	Very high	47 Å²	47	36.7 Å²	36.7	29%	0.285	19%	0.187	S	C	.	.	H	α-helix	trans	-74.4	-40.7	179.2	-166.9	0	0	0	0	110.1	M310 E311 R317 S318	M310-V314 HydrophobicContact CB-CB 4.44Å; M310-V314 HydrophobicContact CE-CB 4.14Å; M310-V314 HydrophobicContact CE-CG1 3.42Å; M310-V314 VanDerWaalsContact CE-CG1 3.42Å; M310-V314 WeakPolarHBondContact CE-O 3.05Å; E311-V314 HydrophobicContact CB-CG2 4.09Å; E311-V314 PolarHBondContact O-N 3.14Å; V314-R317 WeakPolarHBondContact O-CB 3.38Å; V314-R317 PolarHBondContact O-N 3.37Å; V314-S318 PolarHBondContact O-N 3.23Å
315	A	98	Very high	95.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-45.8	172.2	0	0	0	0	0	111.1	M307 M310 E311 R317 S318 V319 F339 Y343	M307-A315 HydrophobicContact CB-CB 3.95Å; M307-A315 HydrophobicContact CG-CB 3.94Å; M307-A315 HydrophobicContact SD-CB 3.98Å; M310-A315 HydrophobicContact CB-CB 4.09Å; E311-A315 WeakPolarHBondContact O-CB 3.29Å; E311-A315 PolarHBondContact O-N 2.95Å; A315-R317 VanDerWaalsContact C-N 3.3Å; A315-R317 PolarHBondContact O-N 2.95Å; A315-S318 WeakPolarHBondContact O-CA 3.17Å; A315-S318 VanDerWaalsContact O-CB 3.27Å; A315-S318 WeakPolarHBondContact O-CB 3.37Å; A315-S318 PolarHBondContact O-N 3Å; A315-V319 PolarHBondContact O-N 3Å; A315-F339 HydrophobicContact CB-CE2 4.15Å; A315-F339 HydrophobicContact CB-CZ 4.06Å; A315-Y343 HydrophobicContact CB-CD2 3.67Å; A315-Y343 HydrophobicContact CB-CE2 3.56Å
316	L	97.2	Very high	95.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-40	176	-176.8	61.5	0	0	0	111.6	V312 S318 V319 I320 M336 F339 A365 V368 F422	V312-L316 WeakPolarHBondContact O-CB 3.38Å; V312-L316 PolarHBondContact O-N 3.44Å; L316-S318 VanDerWaalsContact C-N 3.31Å; L316-S318 PolarHBondContact O-N 2.63Å; L316-V319 PolarHBondContact O-N 2.81Å; L316-I320 HydrophobicContact CD1-CD1 3.97Å; L316-I320 HydrophobicContact CD1-CG1 4.24Å; L316-I320 HydrophobicContact CD2-CD1 4.42Å; L316-I320 HydrophobicContact CG-CD1 3.81Å; L316-I320 HydrophobicContact CG-CG1 4.43Å; L316-I320 WeakPolarHBondContact O-CB 3.39Å; L316-I320 WeakPolarHBondContact O-CG1 3.41Å; L316-I320 PolarHBondContact O-N 3Å; L316-M336 HydrophobicContact CD1-CE 4.15Å; L316-M336 HydrophobicContact CD1-SD 4.08Å; L316-F339 HydrophobicContact CB-CE2 4.24Å; L316-F339 HydrophobicContact CB-CZ 3.97Å; L316-F339 HydrophobicContact CD1-CD2 4.39Å; L316-F339 HydrophobicContact CD1-CE2 4.36Å; L316-F339 HydrophobicContact CD1-CZ 4.48Å; L316-A365 HydrophobicContact CD2-CB 4.37Å; L316-V368 HydrophobicContact CD2-CB 4.24Å; L316-V368 HydrophobicContact CD2-CG1 3.98Å; L316-F422 HydrophobicContact CD2-CE2 4.19Å; L316-F422 HydrophobicContact CD2-CZ 4.19Å; L316-F422 HydrophobicContact CG-CE2 4.46Å; L316-F422 HydrophobicContact CG-CZ 4.33Å
317	R	96.5	Very high	94.3	Very high	56 Å²	56	30.1 Å²	30.1	21%	0.211	16%	0.159	C	C	.	.	H	α-helix	trans	-58.6	-42.5	172.3	-173.8	179.4	-61.5	-83.6	2.2	111.9	D313 V314 A315 G321 R416 S420 E421 F422	D313-R317 VanDerWaalsContact O-CB 3.29Å; D313-R317 WeakPolarHBondContact O-CB 3.49Å; D313-R317 PolarHBondContact O-N 3.37Å; V314-R317 WeakPolarHBondContact O-CB 3.38Å; V314-R317 PolarHBondContact O-N 3.37Å; A315-R317 VanDerWaalsContact C-N 3.3Å; A315-R317 PolarHBondContact O-N 2.95Å; R317-G321 PolarHBondContact O-N 3Å; R317-R416 PolarHBondContact NH2-O 3.4Å; R317-S420 PolarHBondContact NH1-O 3.22Å; R317-S420 PolarHBondContact NH1-OG 3.01Å; R317-S420 PolarHBondContact NH2-O 2.88Å; R317-E421 PolarHBondContact NH1-O 3.31Å; R317-F422 HydrophobicContact CB-CD1 3.96Å; R317-F422 HydrophobicContact CB-CE1 3.7Å; R317-F422 HydrophobicContact CG-CD1 3.92Å; R317-F422 HydrophobicContact CG-CE1 4.13Å
318	S	96.3	Very high	93.8	Very high	33 Å²	33	35 Å²	35	23%	0.231	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-46.1	176.2	-167.8	0	0	0	0	111	I305 V314 A315 L316 G321 H322	I305-S318 VanDerWaalsContact CG2-OG 3.3Å; I305-S318 WeakPolarHBondContact CG2-OG 3.28Å; V314-S318 PolarHBondContact O-N 3.23Å; A315-S318 WeakPolarHBondContact O-CA 3.17Å; A315-S318 VanDerWaalsContact O-CB 3.27Å; A315-S318 WeakPolarHBondContact O-CB 3.37Å; A315-S318 PolarHBondContact O-N 3Å; L316-S318 VanDerWaalsContact C-N 3.31Å; L316-S318 PolarHBondContact O-N 2.63Å; S318-G321 PolarHBondContact O-N 3.25Å; S318-H322 PolarHBondContact O-CE1 3.5Å; S318-H322 PolarHBondContact O-ND1 3.48Å
319	V	96.5	Very high	93.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-51.6	178	171.7	0	0	0	0	112.2	L302 I305 M307 A315 L316 G321 H322 F323 F339	L302-V319 HydrophobicContact CD2-CB 4.32Å; L302-V319 HydrophobicContact CD2-CG1 3.44Å; L302-V319 VanDerWaalsContact CD2-CG1 3.44Å; L302-V319 HydrophobicContact CD2-CG2 3.95Å; I305-V319 HydrophobicContact CD1-CG2 4.18Å; I305-V319 HydrophobicContact CG2-CG2 4.48Å; M307-V319 HydrophobicContact SD-CG2 3.66Å; A315-V319 PolarHBondContact O-N 3Å; L316-V319 PolarHBondContact O-N 2.81Å; V319-G321 PolarHBondContact O-N 3.31Å; V319-H322 PolarHBondContact O-N 2.74Å; V319-F323 HydrophobicContact CG1-CE1 3.78Å; V319-F323 HydrophobicContact CG1-CZ 4.16Å; V319-F339 HydrophobicContact CG2-CD2 3.94Å; V319-F339 HydrophobicContact CG2-CE2 4.05Å
320	I	94.4	Very high	93.3	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-24.4	178.6	-66.9	173.7	0	0	0	111.7	I105 L316 H322 L369 F422 T424	I105-I320 HydrophobicContact CD1-CG2 3.32Å; I105-I320 HydrophobicContact CG1-CG2 4.44Å; L316-I320 HydrophobicContact CD1-CD1 3.97Å; L316-I320 HydrophobicContact CD1-CG1 4.24Å; L316-I320 HydrophobicContact CD2-CD1 4.42Å; L316-I320 HydrophobicContact CG-CD1 3.81Å; L316-I320 HydrophobicContact CG-CG1 4.43Å; L316-I320 WeakPolarHBondContact O-CB 3.39Å; L316-I320 WeakPolarHBondContact O-CG1 3.41Å; L316-I320 PolarHBondContact O-N 3Å; I320-H322 PolarHBondContact O-N 3.12Å; I320-L369 HydrophobicContact CD1-CD1 4.19Å; I320-F422 HydrophobicContact CD1-CD2 3.58Å; I320-F422 HydrophobicContact CD1-CE2 3.75Å; I320-F422 HydrophobicContact CD1-CG 4.19Å; I320-F422 HydrophobicContact CD1-CZ 4.5Å; I320-F422 HydrophobicContact CG2-CB 4.01Å; I320-T424 WeakPolarHBondContact O-CG2 3.48Å
321	G	94.2	Very high	93.1	Very high	8 Å²	8	31 Å²	31	8%	0.082	17%	0.165	C	C	.	.	H	α-helix	trans	-56.9	-33.8	170.6	0	0	0	0	0	112.9	R317 S318 V319 T424 L425	R317-G321 PolarHBondContact O-N 3Å; S318-G321 PolarHBondContact O-N 3.25Å; V319-G321 PolarHBondContact O-N 3.31Å; G321-T424 CarbonylContact O-C 3.57Å; G321-T424 WeakPolarHBondContact O-CA 3.45Å; G321-L425 VanDerWaalsContact O-CB 3.32Å; G321-L425 WeakPolarHBondContact O-CB 3.12Å; G321-L425 VanDerWaalsContact O-CG 3.28Å; G321-L425 WeakPolarHBondContact O-CG 3.05Å; G321-L425 PolarHBondContact O-N 3.19Å
322	H	95.8	Very high	92.9	Very high	41 Å²	41	29 Å²	29	19%	0.19	16%	0.156	C	C	.	.	H	α-helix	trans	-87.1	-29.7	-171.2	-69.4	80	0	0	0	114.1	R279 F301 I305 S318 V319 I320	R279-H322 PolarHBondContact NH1-O 2.79Å; F301-H322 HydrophobicContact CE1-CB 3.94Å; F301-H322 HydrophobicContact CZ-CB 3.86Å; I305-H322 HydrophobicContact CD1-CB 4.2Å; S318-H322 PolarHBondContact O-CE1 3.5Å; S318-H322 PolarHBondContact O-ND1 3.48Å; V319-H322 PolarHBondContact O-N 2.74Å; I320-H322 PolarHBondContact O-N 3.12Å
323	F	94.9	Very high	92.6	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.009	17%	0.168	C	C	.	.			trans	-149.4	164.3	179.6	69.4	-88	0	0	0	111.9	I282 F286 F301 L302 V319 P325 L335	I282-F323 HydrophobicContact CB-CB 3.96Å; I282-F323 HydrophobicContact CG2-CB 3.56Å; I282-F323 HydrophobicContact CG2-CG 4.24Å; F286-F323 AromaticContact CD2-CD1 3.96Å; F286-F323 HydrophobicContact CD2-CD1 3.96Å; F286-F323 AromaticContact CD2-CD2 3.9Å; F286-F323 HydrophobicContact CD2-CD2 3.9Å; F286-F323 HydrophobicContact CD2-CE1 4.01Å; F286-F323 AromaticContact CD2-CE2 3.97Å; F286-F323 HydrophobicContact CD2-CE2 3.97Å; F286-F323 AromaticContact CD2-CG 3.9Å; F286-F323 HydrophobicContact CD2-CG 3.9Å; F286-F323 HydrophobicContact CD2-CZ 4.02Å; F286-F323 HydrophobicContact CE2-CB 4.47Å; F286-F323 AromaticContact CE2-CD1 3.76Å; F286-F323 HydrophobicContact CE2-CD1 3.76Å; F286-F323 HydrophobicContact CE2-CD2 4.44Å; F286-F323 HydrophobicContact CE2-CE1 4.06Å; F286-F323 AromaticContact CE2-CG 3.96Å; F286-F323 HydrophobicContact CE2-CG 3.96Å; F301-F323 AromaticContact CE1-CD1 3.82Å; F301-F323 HydrophobicContact CE1-CD1 3.82Å; F301-F323 HydrophobicContact CE1-CE1 4.23Å; F301-F323 HydrophobicContact CZ-CD1 4.41Å; L302-F323 HydrophobicContact CD2-CE1 4.35Å; V319-F323 HydrophobicContact CG1-CE1 3.78Å; V319-F323 HydrophobicContact CG1-CZ 4.16Å; F323-P325 HydrophobicContact CE2-CB 4.07Å; F323-P325 WeakPolarHBondContact O-CD 3.35Å; F323-L335 HydrophobicContact CE2-CD1 4.5Å; F323-L335 HydrophobicContact CE2-CD2 3.92Å; F323-L335 HydrophobicContact CZ-CD1 3.7Å; F323-L335 HydrophobicContact CZ-CD2 3.73Å; F323-L335 HydrophobicContact CZ-CG 4.39Å
324	H	90.8	Very high	92.5	Very high	21 Å²	21	32 Å²	32	10%	0.097	18%	0.176	C	C	.	.			trans	-100.6	103.5	-178.5	-170.1	61.9	0	0	0	110.5	S104 I108 R279 Q280 G283 T424	S104-H324 WeakPolarHBondContact CB-CE1 3.47Å; S104-H324 WeakPolarHBondContact CB-NE2 3.41Å; S104-H324 PolarHBondContact O-CE1 2.88Å; I108-H324 WeakPolarHBondContact CD1-CE1 3.43Å; I108-H324 WeakPolarHBondContact CD1-NE2 3.19Å; R279-H324 HydrophobicContact CB-CB 4.44Å; R279-H324 PolarHBondContact O-N 2.62Å; Q280-H324 HydrophobicContact CB-CB 4.33Å; G283-H324 VanDerWaalsContact CA-O 3.32Å; G283-H324 WeakPolarHBondContact CA-O 3.32Å; H324-T424 HydrophobicContact CB-CG2 4.13Å
325	P	88.2	Confident	92.4	Very high	6 Å²	6	30.2 Å²	30.2	4%	0.039	17%	0.165	C	C	.	.			trans	-61.6	151.8	-173.2	25.3	-34.1	0	0	0	112	I108 F323 L335	I108-P325 WeakPolarHBondContact CD1-O 3.47Å; F323-P325 HydrophobicContact CE2-CB 4.07Å; F323-P325 WeakPolarHBondContact O-CD 3.35Å; P325-L335 HydrophobicContact CB-CD2 3.93Å
326	S	85.4	Confident	92.3	Very high	25 Å²	25	30.3 Å²	30.3	18%	0.175	17%	0.166	C	C	.	.			trans	-69	143.6	172.7	-174.7	0	0	0	0	111	E328 K331 I332	S326-E328 VanDerWaalsContact C-N 3.26Å; S326-E328 PolarHBondContact O-N 2.88Å; S326-K331 VanDerWaalsContact CB-CD 3.49Å; S326-K331 WeakPolarHBondContact OG-CD 3.36Å; S326-I332 WeakPolarHBondContact O-CG1 3.24Å
327	G	79.4	Confident	92.3	Very high	19 Å²	19	35.2 Å²	35.2	20%	0.196	19%	0.187	C	C	.	.	S	Bend	trans	-73.2	-9.7	179.1	0	0	0	0	0	116.1	S329	G327-S329 PolarHBondContact O-N 3.01Å
328	E	85.9	Confident	92.3	Very high	103 Å²	103	33.1 Å²	33.1	48%	0.481	18%	0.18	S	C	.	.			trans	-69.4	128	178.5	-64.2	169.1	-144.8	0	0	111.1	S326 Q330 K331 I332	S326-E328 VanDerWaalsContact C-N 3.26Å; S326-E328 PolarHBondContact O-N 2.88Å; E328-Q330 VanDerWaalsContact C-N 3.28Å; E328-Q330 PolarHBondContact O-N 2.88Å; E328-Q330 VanDerWaalsContact O-N 3.17Å; E328-K331 HydrophobicContact CB-CB 4.39Å; E328-K331 HydrophobicContact CB-CD 4Å; E328-K331 HydrophobicContact CB-CG 4.15Å; E328-K331 HydrophobicContact CG-CD 4.42Å; E328-K331 WeakPolarHBondContact O-CB 3.4Å; E328-K331 PolarHBondContact O-N 2.63Å; E328-K331 IonicContact OE1-NZ 3.22Å; E328-K331 PolarHBondContact OE1-NZ 3.35Å; E328-K331 WeakPolarHBondContact OE2-CD 3.23Å; E328-K331 WeakPolarHBondContact OE2-CE 3.18Å; E328-K331 IonicContact OE2-NZ 3.23Å; E328-K331 PolarHBondContact OE2-NZ 3.41Å; E328-I332 PolarHBondContact O-N 3.06Å; E328-I332 VanDerWaalsContact O-N 3.09Å
329	S	87.9	Confident	92.4	Very high	55 Å²	55	31.6 Å²	31.6	39%	0.385	17%	0.169	S	C	.	.	H	α-helix	trans	-45.6	-47.7	-179.5	50.9	0	0	0	0	114.4	G327 K331 I332 A333	G327-S329 PolarHBondContact O-N 3.01Å; S329-K331 VanDerWaalsContact C-N 3.33Å; S329-K331 PolarHBondContact O-N 3.27Å; S329-I332 PolarHBondContact O-N 3.19Å; S329-A333 WeakPolarHBondContact O-CB 3.41Å; S329-A333 PolarHBondContact O-N 3.24Å
330	Q	92.3	Very high	92.4	Very high	140 Å²	140	32.6 Å²	32.6	65%	0.654	17%	0.174	S	C	*	.	H	α-helix	trans	-65.3	-37.1	-177.9	-64.1	178.2	-2.4	0	0	112	L289 E328 N334	L289-Q330 HydrophobicContact CD1-CB 3.93Å; E328-Q330 VanDerWaalsContact C-N 3.28Å; E328-Q330 PolarHBondContact O-N 2.88Å; E328-Q330 VanDerWaalsContact O-N 3.17Å; Q330-N334 WeakPolarHBondContact O-CB 3.23Å; Q330-N334 PolarHBondContact O-N 3.09Å
331	K	93.1	Very high	92.5	Very high	44 Å²	44	35.5 Å²	35.5	19%	0.191	19%	0.187	C	C	.	.	H	α-helix	trans	-71.1	-41	178.9	-64.6	177.7	178.1	163.4	0	111.3	G287 L289 S326 E328 S329 N334 L335	G287-K331 WeakPolarHBondContact O-CD 3.3Å; G287-K331 WeakPolarHBondContact O-CE 3.43Å; G287-K331 WeakPolarHBondContact O-CG 2.81Å; L289-K331 HydrophobicContact CD1-CG 4.3Å; L289-K331 HydrophobicContact CD2-CG 4.47Å; L289-K331 HydrophobicContact CG-CG 4.26Å; S326-K331 VanDerWaalsContact CB-CD 3.49Å; S326-K331 WeakPolarHBondContact OG-CD 3.36Å; E328-K331 HydrophobicContact CB-CB 4.39Å; E328-K331 HydrophobicContact CB-CD 4Å; E328-K331 HydrophobicContact CB-CG 4.15Å; E328-K331 HydrophobicContact CG-CD 4.42Å; E328-K331 WeakPolarHBondContact O-CB 3.4Å; E328-K331 PolarHBondContact O-N 2.63Å; E328-K331 IonicContact OE1-NZ 3.22Å; E328-K331 PolarHBondContact OE1-NZ 3.35Å; E328-K331 WeakPolarHBondContact OE2-CD 3.23Å; E328-K331 WeakPolarHBondContact OE2-CE 3.18Å; E328-K331 IonicContact OE2-NZ 3.23Å; E328-K331 PolarHBondContact OE2-NZ 3.41Å; S329-K331 VanDerWaalsContact C-N 3.33Å; S329-K331 PolarHBondContact O-N 3.27Å; K331-N334 PolarHBondContact O-N 2.83Å; K331-L335 WeakPolarHBondContact O-CB 3.46Å; K331-L335 PolarHBondContact O-N 3.06Å
332	I	92.4	Very high	92.7	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-46.5	174.6	-62.3	177.8	0	0	0	110.7	I108 V109 S326 E328 S329 N334 L335 M336 Y366 L369	I108-I332 HydrophobicContact CG2-CD1 4.11Å; V109-I332 HydrophobicContact CG2-CD1 4.49Å; S326-I332 WeakPolarHBondContact O-CG1 3.24Å; E328-I332 PolarHBondContact O-N 3.06Å; E328-I332 VanDerWaalsContact O-N 3.09Å; S329-I332 PolarHBondContact O-N 3.19Å; I332-N334 VanDerWaalsContact C-N 3.32Å; I332-N334 PolarHBondContact O-N 2.81Å; I332-L335 WeakPolarHBondContact O-CB 3.46Å; I332-L335 PolarHBondContact O-N 3.37Å; I332-L335 VanDerWaalsContact O-N 3.15Å; I332-M336 HydrophobicContact CG2-CE 4.06Å; I332-M336 HydrophobicContact CG2-CG 4.46Å; I332-M336 WeakPolarHBondContact O-CG 3.32Å; I332-M336 PolarHBondContact O-N 3.25Å; I332-Y366 HydrophobicContact CG2-CD2 4.41Å; I332-Y366 HydrophobicContact CG2-CE2 3.89Å; I332-L369 HydrophobicContact CD1-CD2 4.44Å; I332-L369 HydrophobicContact CG2-CD2 3.56Å
333	A	91.9	Very high	92.8	Very high	34 Å²	34	33.2 Å²	33.2	28%	0.281	18%	0.175	S	C	.	.	H	α-helix	trans	-58.7	-45.5	178.2	0	0	0	0	0	111.5	S329 L335 M336 K337	S329-A333 WeakPolarHBondContact O-CB 3.41Å; S329-A333 PolarHBondContact O-N 3.24Å; A333-L335 VanDerWaalsContact C-N 3.35Å; A333-L335 PolarHBondContact O-N 3.03Å; A333-M336 PolarHBondContact O-N 2.95Å; A333-K337 PolarHBondContact O-N 3.19Å
334	N	94.4	Very high	92.9	Very high	32 Å²	32	35.2 Å²	35.2	17%	0.171	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-40.9	175.1	-179.2	68	0	0	0	112.7	L289 M295 Q330 K331 I332 M336 K337 I338	L289-N334 HydrophobicContact CD2-CB 3.51Å; L289-N334 VanDerWaalsContact CD2-CG 3.47Å; L289-N334 WeakPolarHBondContact CD2-ND2 3.44Å; M295-N334 WeakPolarHBondContact CE-ND2 3.39Å; M295-N334 VanDerWaalsContact CE-OD1 3.26Å; M295-N334 WeakPolarHBondContact CE-OD1 3.36Å; M295-N334 PolarHBondContact SD-ND2 3Å; Q330-N334 WeakPolarHBondContact O-CB 3.23Å; Q330-N334 PolarHBondContact O-N 3.09Å; K331-N334 PolarHBondContact O-N 2.83Å; I332-N334 VanDerWaalsContact C-N 3.32Å; I332-N334 PolarHBondContact O-N 2.81Å; N334-M336 PolarHBondContact O-N 3.45Å; N334-K337 PolarHBondContact O-N 3.17Å; N334-I338 WeakPolarHBondContact O-CG1 3.32Å; N334-I338 PolarHBondContact O-N 3.29Å; N334-I338 VanDerWaalsContact O-N 3.09Å
335	L	96	Very high	93.2	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.052	21%	0.206	C	C	.	.	H	α-helix	trans	-60	-44.7	173.6	173.2	61.1	0	0	0	111.7	L298 L302 F323 P325 K331 I332 A333 K337 I338 F339	L298-L335 HydrophobicContact CD1-CD1 3.95Å; L298-L335 HydrophobicContact CD2-CD1 4.3Å; L302-L335 HydrophobicContact CD1-CD1 4.38Å; F323-L335 HydrophobicContact CE2-CD1 4.5Å; F323-L335 HydrophobicContact CE2-CD2 3.92Å; F323-L335 HydrophobicContact CZ-CD1 3.7Å; F323-L335 HydrophobicContact CZ-CD2 3.73Å; F323-L335 HydrophobicContact CZ-CG 4.39Å; P325-L335 HydrophobicContact CB-CD2 3.93Å; K331-L335 WeakPolarHBondContact O-CB 3.46Å; K331-L335 PolarHBondContact O-N 3.06Å; I332-L335 WeakPolarHBondContact O-CB 3.46Å; I332-L335 PolarHBondContact O-N 3.37Å; I332-L335 VanDerWaalsContact O-N 3.15Å; A333-L335 VanDerWaalsContact C-N 3.35Å; A333-L335 PolarHBondContact O-N 3.03Å; L335-K337 VanDerWaalsContact C-N 3.31Å; L335-K337 PolarHBondContact O-N 3.1Å; L335-I338 PolarHBondContact O-N 2.98Å; L335-F339 VanDerWaalsContact O-CB 3.29Å; L335-F339 WeakPolarHBondContact O-CB 3.37Å; L335-F339 PolarHBondContact O-N 2.82Å
336	M	95.7	Very high	93.7	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.015	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-37.3	179.1	-65.2	-49.8	130	0	0	112.1	L316 I332 A333 N334 F339 H340 E362 A365 Y366 L369	L316-M336 HydrophobicContact CD1-CE 4.15Å; L316-M336 HydrophobicContact CD1-SD 4.08Å; I332-M336 HydrophobicContact CG2-CE 4.06Å; I332-M336 HydrophobicContact CG2-CG 4.46Å; I332-M336 WeakPolarHBondContact O-CG 3.32Å; I332-M336 PolarHBondContact O-N 3.25Å; A333-M336 PolarHBondContact O-N 2.95Å; N334-M336 PolarHBondContact O-N 3.45Å; M336-F339 PolarHBondContact O-N 3.44Å; M336-H340 VanDerWaalsContact O-CB 3.26Å; M336-H340 WeakPolarHBondContact O-CB 3.28Å; M336-H340 PolarHBondContact O-N 3.49Å; M336-E362 HydrophobicContact CB-CG 4.2Å; M336-A365 HydrophobicContact SD-CB 3.93Å; M336-Y366 HydrophobicContact CG-CD2 3.91Å; M336-L369 HydrophobicContact CE-CD2 4Å
337	K	95.9	Very high	94.3	Very high	103 Å²	103	39.3 Å²	39.3	45%	0.448	20%	0.203	S	C	.	.	H	α-helix	trans	-60	-49.7	173	-178.4	-178	176.4	-178.8	0	112.1	A333 N334 L335 H340 E341	A333-K337 PolarHBondContact O-N 3.19Å; N334-K337 PolarHBondContact O-N 3.17Å; L335-K337 VanDerWaalsContact C-N 3.31Å; L335-K337 PolarHBondContact O-N 3.1Å; K337-H340 WeakPolarHBondContact O-CB 3.28Å; K337-H340 PolarHBondContact O-N 3.44Å; K337-E341 PolarHBondContact O-N 3.38Å; K337-E341 VanDerWaalsContact O-N 3.08Å
338	I	97	Very high	95.1	Very high	13 Å²	13	41.4 Å²	41.4	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-67.7	-38	179.1	-57.6	-61	0	0	0	111.2	M295 L298 K299 L302 N334 L335 H340 E341 V342	M295-I338 HydrophobicContact CE-CD1 4Å; M295-I338 HydrophobicContact CE-CG1 4.01Å; L298-I338 HydrophobicContact CD2-CB 4.24Å; L298-I338 HydrophobicContact CD2-CG1 4.1Å; L298-I338 HydrophobicContact CD2-CG2 4.4Å; L298-I338 HydrophobicContact CG-CB 4.46Å; L298-I338 HydrophobicContact CG-CG2 4.09Å; K299-I338 HydrophobicContact CB-CG2 4.01Å; K299-I338 HydrophobicContact CG-CG2 4.39Å; L302-I338 HydrophobicContact CD1-CG2 4.04Å; N334-I338 WeakPolarHBondContact O-CG1 3.32Å; N334-I338 PolarHBondContact O-N 3.29Å; N334-I338 VanDerWaalsContact O-N 3.09Å; L335-I338 PolarHBondContact O-N 2.98Å; I338-H340 VanDerWaalsContact C-N 3.35Å; I338-H340 PolarHBondContact O-N 3.02Å; I338-E341 PolarHBondContact O-N 3.19Å; I338-V342 HydrophobicContact CG2-CG2 4.47Å; I338-V342 WeakPolarHBondContact O-CG2 3.22Å; I338-V342 PolarHBondContact O-N 3.27Å; I338-V342 VanDerWaalsContact O-N 3.1Å
339	F	97.7	Very high	95.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-47.3	172.8	169.8	-97.6	0	0	0	111.6	L302 M307 V312 A315 L316 V319 L335 M336 V342 Y343 V361 A365	L302-F339 HydrophobicContact CD1-CB 4.17Å; M307-F339 HydrophobicContact SD-CD2 4.18Å; M307-F339 HydrophobicContact SD-CE2 3.71Å; V312-F339 HydrophobicContact CG1-CE1 4.17Å; A315-F339 HydrophobicContact CB-CE2 4.15Å; A315-F339 HydrophobicContact CB-CZ 4.06Å; L316-F339 HydrophobicContact CB-CE2 4.24Å; L316-F339 HydrophobicContact CB-CZ 3.97Å; L316-F339 HydrophobicContact CD1-CD2 4.39Å; L316-F339 HydrophobicContact CD1-CE2 4.36Å; L316-F339 HydrophobicContact CD1-CZ 4.48Å; V319-F339 HydrophobicContact CG2-CD2 3.94Å; V319-F339 HydrophobicContact CG2-CE2 4.05Å; L335-F339 VanDerWaalsContact O-CB 3.29Å; L335-F339 WeakPolarHBondContact O-CB 3.37Å; L335-F339 PolarHBondContact O-N 2.82Å; M336-F339 PolarHBondContact O-N 3.44Å; F339-V342 PolarHBondContact O-N 3.11Å; F339-Y343 HydrophobicContact CZ-CD2 4.03Å; F339-Y343 HydrophobicContact CZ-CG 4.39Å; F339-Y343 WeakPolarHBondContact O-CB 3.28Å; F339-Y343 PolarHBondContact O-N 2.89Å; F339-V361 HydrophobicContact CE1-CG1 4.35Å; F339-A365 HydrophobicContact CD1-CB 3.85Å; F339-A365 HydrophobicContact CE1-CB 3.73Å
340	H	97	Very high	96	Very high	22 Å²	22	42.1 Å²	42.1	10%	0.102	21%	0.211	C	C	.	.	H	α-helix	trans	-55.8	-52.5	175.9	155.3	-146.5	0	0	0	111.5	M336 K337 I338 V342 Y343 I344 P358 E362	M336-H340 VanDerWaalsContact O-CB 3.26Å; M336-H340 WeakPolarHBondContact O-CB 3.28Å; M336-H340 PolarHBondContact O-N 3.49Å; K337-H340 WeakPolarHBondContact O-CB 3.28Å; K337-H340 PolarHBondContact O-N 3.44Å; I338-H340 VanDerWaalsContact C-N 3.35Å; I338-H340 PolarHBondContact O-N 3.02Å; H340-V342 VanDerWaalsContact C-N 3.31Å; H340-V342 PolarHBondContact O-N 2.99Å; H340-Y343 PolarHBondContact O-N 3.47Å; H340-I344 WeakPolarHBondContact CD2-CD1 3.15Å; H340-I344 WeakPolarHBondContact NE2-CD1 3.47Å; H340-I344 WeakPolarHBondContact O-CG1 3.07Å; H340-I344 PolarHBondContact O-N 2.86Å; H340-I344 VanDerWaalsContact O-N 3.14Å; H340-P358 PolarHBondContact CD2-O 3.16Å; H340-P358 PolarHBondContact NE2-O 3.19Å; H340-E362 HydrophobicContact CB-CB 3.75Å; H340-E362 HydrophobicContact CB-CG 4.32Å; H340-E362 IonicContact CE1-OE2 2.83Å; H340-E362 IonicContact ND1-OE2 3.21Å; H340-E362 PolarHBondContact ND1-OE2 3.36Å
341	E	97.3	Very high	96.1	Very high	62 Å²	62	35.9 Å²	35.9	29%	0.29	18%	0.183	S	C	.	.	H	α-helix	trans	-54.9	-46.2	178.5	-71.3	-179.7	-159.6	0	0	112	K299 K337 I338 I345	K299-E341 IonicContact NZ-OE2 2.77Å; K299-E341 PolarHBondContact NZ-OE2 3.31Å; K337-E341 PolarHBondContact O-N 3.38Å; K337-E341 VanDerWaalsContact O-N 3.08Å; I338-E341 PolarHBondContact O-N 3.19Å; E341-I345 WeakPolarHBondContact O-CD1 3.33Å; E341-I345 WeakPolarHBondContact O-CG1 3.36Å; E341-I345 PolarHBondContact O-N 3.03Å
342	V	97.9	Very high	96.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-74.5	-37.8	-177.1	179	0	0	0	0	112	K299 L302 L303 M307 I338 F339 H340 I344 I345 Q346	K299-V342 HydrophobicContact CG-CG2 4.2Å; L302-V342 HydrophobicContact CB-CB 4.22Å; L302-V342 HydrophobicContact CB-CG1 4.06Å; L302-V342 HydrophobicContact CB-CG2 4.03Å; L303-V342 HydrophobicContact CD2-CG1 3.86Å; L303-V342 HydrophobicContact CD2-CG2 4.48Å; L303-V342 HydrophobicContact CG-CG1 4.06Å; L303-V342 HydrophobicContact CG-CG2 4.23Å; M307-V342 HydrophobicContact CE-CB 4.21Å; M307-V342 HydrophobicContact CE-CG1 3.48Å; M307-V342 VanDerWaalsContact CE-CG1 3.48Å; I338-V342 HydrophobicContact CG2-CG2 4.47Å; I338-V342 WeakPolarHBondContact O-CG2 3.22Å; I338-V342 PolarHBondContact O-N 3.27Å; I338-V342 VanDerWaalsContact O-N 3.1Å; F339-V342 PolarHBondContact O-N 3.11Å; H340-V342 VanDerWaalsContact C-N 3.31Å; H340-V342 PolarHBondContact O-N 2.99Å; V342-I344 VanDerWaalsContact C-N 3.32Å; V342-I344 PolarHBondContact O-N 3.29Å; V342-I345 PolarHBondContact O-N 3.46Å; V342-Q346 PolarHBondContact O-N 3.27Å; V342-Q346 VanDerWaalsContact O-N 3.13Å
343	Y	98.4	Very high	96.4	Very high	2 Å²	2	51 Å²	51	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-40.4	178.9	-179	-91.8	0	0	0	111.6	M310 V312 A315 F339 H340 Q346 N347 V351 V361	M310-Y343 PolarHBondContact O-OH 2.84Å; V312-Y343 HydrophobicContact CG2-CE1 3.98Å; V312-Y343 PolarHBondContact N-OH 3.39Å; A315-Y343 HydrophobicContact CB-CD2 3.67Å; A315-Y343 HydrophobicContact CB-CE2 3.56Å; F339-Y343 HydrophobicContact CZ-CD2 4.03Å; F339-Y343 HydrophobicContact CZ-CG 4.39Å; F339-Y343 WeakPolarHBondContact O-CB 3.28Å; F339-Y343 PolarHBondContact O-N 2.89Å; H340-Y343 PolarHBondContact O-N 3.47Å; Y343-Q346 PolarHBondContact O-N 3.06Å; Y343-N347 HydrophobicContact CE1-CB 4.24Å; Y343-N347 WeakPolarHBondContact O-CB 3.33Å; Y343-N347 PolarHBondContact O-N 2.89Å; Y343-N347 PolarHBondContact O-ND2 3.4Å; Y343-V351 HydrophobicContact CD1-CG2 3.97Å; Y343-V351 HydrophobicContact CE1-CG2 3.76Å; Y343-V361 HydrophobicContact CD1-CG1 3.66Å; Y343-V361 HydrophobicContact CD1-CG2 4.27Å; Y343-V361 HydrophobicContact CE1-CG1 4.19Å; Y343-V361 HydrophobicContact CE1-CG2 4.36Å; Y343-V361 HydrophobicContact CG-CG1 4.2Å
344	I	97.5	Very high	96.5	Very high	44 Å²	44	51.7 Å²	51.7	23%	0.226	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-44.5	175.7	-68.8	173.9	0	0	0	111.3	H340 V342 Q346 N347 P348 V351 P358	H340-I344 WeakPolarHBondContact CD2-CD1 3.15Å; H340-I344 WeakPolarHBondContact NE2-CD1 3.47Å; H340-I344 WeakPolarHBondContact O-CG1 3.07Å; H340-I344 PolarHBondContact O-N 2.86Å; H340-I344 VanDerWaalsContact O-N 3.14Å; V342-I344 VanDerWaalsContact C-N 3.32Å; V342-I344 PolarHBondContact O-N 3.29Å; I344-Q346 PolarHBondContact O-N 3.49Å; I344-N347 CarbonylContact O-C 3.52Å; I344-N347 PolarHBondContact O-N 3.2Å; I344-P348 WeakPolarHBondContact O-CA 3.43Å; I344-P348 WeakPolarHBondContact O-CD 3.33Å; I344-P348 VanDerWaalsContact O-N 3.12Å; I344-V351 HydrophobicContact CG1-CG1 4.32Å; I344-V351 HydrophobicContact CG1-CG2 4.13Å; I344-P358 HydrophobicContact CD1-CB 3.33Å; I344-P358 HydrophobicContact CG1-CB 4.43Å
345	I	96.9	Very high	96.6	Very high	104 Å²	104	50.8 Å²	50.8	53%	0.533	24%	0.237	S	C	.	.	H	α-helix	trans	-58.2	-40.2	179	-69	166.4	0	0	0	110.7	L303 E341 V342	L303-I345 HydrophobicContact CD2-CG2 4.44Å; E341-I345 WeakPolarHBondContact O-CD1 3.33Å; E341-I345 WeakPolarHBondContact O-CG1 3.36Å; E341-I345 PolarHBondContact O-N 3.03Å; V342-I345 PolarHBondContact O-N 3.46Å
346	Q	97.9	Very high	96.5	Very high	27 Å²	27	56.5 Å²	56.5	13%	0.126	26%	0.263	C	S	.	.	H	α-helix	trans	-85.1	-18.7	-179	-63.1	-166.8	19.8	0	0	114.4	L303 I305 K308 V342 Y343 I344	L303-Q346 PolarHBondContact O-NE2 2.8Å; I305-Q346 PolarHBondContact O-NE2 3.42Å; I305-Q346 PolarHBondContact O-OE1 3.49Å; K308-Q346 HydrophobicContact CG-CB 4.21Å; V342-Q346 PolarHBondContact O-N 3.27Å; V342-Q346 VanDerWaalsContact O-N 3.13Å; Y343-Q346 PolarHBondContact O-N 3.06Å; I344-Q346 PolarHBondContact O-N 3.49Å
347	N	97.5	Very high	96.5	Very high	6 Å²	6	57 Å²	57	3%	0.032	27%	0.267	C	S	.	.			trans	-135.2	47.7	-174.4	-61.4	-81.1	0	0	0	114.2	M307 K308 N309 Y343 I344 D349 R350 V351	M307-N347 PolarHBondContact O-ND2 3.31Å; M307-N347 PolarHBondContact O-OD1 2.87Å; K308-N347 WeakPolarHBondContact CA-OD1 3.37Å; N309-N347 PolarHBondContact N-OD1 2.93Å; Y343-N347 HydrophobicContact CE1-CB 4.24Å; Y343-N347 WeakPolarHBondContact O-CB 3.33Å; Y343-N347 PolarHBondContact O-N 2.89Å; Y343-N347 PolarHBondContact O-ND2 3.4Å; I344-N347 CarbonylContact O-C 3.52Å; I344-N347 PolarHBondContact O-N 3.2Å; N347-D349 VanDerWaalsContact C-N 3.33Å; N347-D349 PolarHBondContact O-N 3.24Å; N347-R350 HydrophobicContact CB-CB 4.27Å; N347-R350 PolarHBondContact O-N 3.25Å; N347-V351 WeakPolarHBondContact O-CG2 3.24Å; N347-V351 PolarHBondContact O-N 2.77Å; N347-V351 VanDerWaalsContact O-N 3.1Å
348	P	96.6	Very high	96.4	Very high	63 Å²	63	55.1 Å²	55.1	41%	0.409	27%	0.266	S	S	.	.	H	α-helix	trans	-61.1	-40	-171.3	24.7	-34.7	0	0	0	112.9	I344 R352	I344-P348 WeakPolarHBondContact O-CA 3.43Å; I344-P348 WeakPolarHBondContact O-CD 3.33Å; I344-P348 VanDerWaalsContact O-N 3.12Å; P348-R352 WeakPolarHBondContact O-CB 3.43Å; P348-R352 PolarHBondContact O-N 3Å; P348-R352 VanDerWaalsContact O-N 3.12Å
349	D	96.2	Very high	96.2	Very high	110 Å²	110	60.9 Å²	60.9	59%	0.588	29%	0.292	S	S	*	.	H	α-helix	trans	-73.6	-35.3	-177	-59.6	-38.2	0	0	0	112.4	N347 R352 K353	N347-D349 VanDerWaalsContact C-N 3.33Å; N347-D349 PolarHBondContact O-N 3.24Å; D349-R352 IonicContact OD1-CZ 3.84Å; D349-R352 IonicContact OD1-NH2 3.91Å; D349-R352 PolarHBondContact OD1-NH2 3.29Å; D349-K353 VanDerWaalsContact O-CB 3.27Å; D349-K353 WeakPolarHBondContact O-CB 3.43Å; D349-K353 PolarHBondContact O-N 3.48Å
350	R	95.5	Very high	96.1	Very high	63 Å²	63	61 Å²	61	24%	0.238	29%	0.293	C	S	.	.	H	α-helix	trans	-67.6	-42.8	176.1	-168.2	-179.7	-161.1	142.2	18.1	111.3	N309 M310 E311 N347 K353 N354	N309-R350 PolarHBondContact O-NH1 3.17Å; M310-R350 PolarHBondContact O-NH1 3.05Å; E311-R350 VanDerWaalsContact N-NH1 3.17Å; E311-R350 IonicContact OE1-CZ 2.81Å; E311-R350 IonicContact OE1-NH2 3.65Å; E311-R350 PolarHBondContact OE1-NH2 3.2Å; N347-R350 HydrophobicContact CB-CB 4.27Å; N347-R350 PolarHBondContact O-N 3.25Å; R350-K353 PolarHBondContact O-N 2.77Å; R350-N354 WeakPolarHBondContact O-CB 3.48Å; R350-N354 PolarHBondContact O-N 2.81Å
351	V	96.3	Very high	96.1	Very high	9 Å²	9	60 Å²	60	6%	0.055	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-48.7	178.6	172.6	0	0	0	0	110	Y343 I344 N347 K353 N354 F355 P358 V361	Y343-V351 HydrophobicContact CD1-CG2 3.97Å; Y343-V351 HydrophobicContact CE1-CG2 3.76Å; I344-V351 HydrophobicContact CG1-CG1 4.32Å; I344-V351 HydrophobicContact CG1-CG2 4.13Å; N347-V351 WeakPolarHBondContact O-CG2 3.24Å; N347-V351 PolarHBondContact O-N 2.77Å; N347-V351 VanDerWaalsContact O-N 3.1Å; V351-K353 VanDerWaalsContact C-N 3.26Å; V351-K353 PolarHBondContact O-N 2.74Å; V351-N354 PolarHBondContact O-N 2.75Å; V351-F355 HydrophobicContact CG1-CD2 4.31Å; V351-F355 PolarHBondContact O-N 3.29Å; V351-P358 HydrophobicContact CG1-CB 4.34Å; V351-V361 HydrophobicContact CG1-CG2 4.35Å; V351-V361 HydrophobicContact CG2-CG2 4.13Å
352	R	95.3	Very high	96.1	Very high	186 Å²	186	60 Å²	60	70%	0.702	29%	0.288	S	S	*	.	H	α-helix	trans	-61.3	-32.4	177.5	-162.8	-168.5	-31.4	-153.8	10.8	113.7	P348 D349	P348-R352 WeakPolarHBondContact O-CB 3.43Å; P348-R352 PolarHBondContact O-N 3Å; P348-R352 VanDerWaalsContact O-N 3.12Å; D349-R352 IonicContact OD1-CZ 3.84Å; D349-R352 IonicContact OD1-NH2 3.91Å; D349-R352 PolarHBondContact OD1-NH2 3.29Å
353	K	95	Very high	95.9	Very high	178 Å²	178	62.1 Å²	62.1	77%	0.774	30%	0.301	S	S	*	.	H	α-helix	trans	-77	-37.8	179.8	-177.1	-179	176.1	-178.2	0	112.5	D349 R350 V351	D349-K353 VanDerWaalsContact O-CB 3.27Å; D349-K353 WeakPolarHBondContact O-CB 3.43Å; D349-K353 PolarHBondContact O-N 3.48Å; R350-K353 PolarHBondContact O-N 2.77Å; V351-K353 VanDerWaalsContact C-N 3.26Å; V351-K353 PolarHBondContact O-N 2.74Å
354	N	94.1	Very high	95.9	Very high	48 Å²	48	62 Å²	62	26%	0.257	30%	0.301	S	S	.	.	H	α-helix	trans	-102.3	-17.6	-167.6	-69.4	2.9	0	0	0	114.1	R350 V351	R350-N354 WeakPolarHBondContact O-CB 3.48Å; R350-N354 PolarHBondContact O-N 2.81Å; V351-N354 PolarHBondContact O-N 2.75Å
355	F	96.2	Very high	95.8	Very high	13 Å²	13	60 Å²	60	6%	0.057	29%	0.29	C	S	.	.			trans	-135.5	144	-175.6	-51.4	-67.5	0	0	0	111.3	V312 V351 T360 V361 L364 D400 V405 L409	V312-F355 HydrophobicContact CG2-CE2 4.31Å; V312-F355 HydrophobicContact CG2-CZ 4.18Å; V351-F355 HydrophobicContact CG1-CD2 4.31Å; V351-F355 PolarHBondContact O-N 3.29Å; F355-T360 HydrophobicContact CD1-CG2 3.72Å; F355-T360 HydrophobicContact CE1-CG2 4.16Å; F355-T360 HydrophobicContact CG-CG2 4.4Å; F355-V361 HydrophobicContact CD2-CG2 3.96Å; F355-V361 HydrophobicContact CE2-CG2 3.91Å; F355-L364 HydrophobicContact CE1-CD2 3.9Å; F355-L364 HydrophobicContact CZ-CD2 3.82Å; F355-D400 WeakPolarHBondContact CA-OD2 3.4Å; F355-V405 HydrophobicContact CD1-CG2 4.2Å; F355-V405 HydrophobicContact CE1-CG1 3.97Å; F355-V405 HydrophobicContact CE1-CG2 4.11Å; F355-L409 HydrophobicContact CE1-CD2 4Å; F355-L409 HydrophobicContact CZ-CD2 3.88Å
356	H	95.2	Very high	95.7	Very high	130 Å²	130	56.2 Å²	56.2	60%	0.602	27%	0.27	S	S	*	.	S	Bend	trans	-75.9	-37.2	172.3	-60.9	78.5	0	0	0	110.9	D400	H356-D400 WeakPolarHBondContact CA-OD1 3.49Å; H356-D400 WeakPolarHBondContact CB-OD1 3.37Å; H356-D400 IonicContact CE1-OD2 2.77Å; H356-D400 IonicContact CG-OD2 2.71Å; H356-D400 VanDerWaalsContact N-CG 3.27Å; H356-D400 PolarHBondContact N-OD1 2.89Å; H356-D400 PolarHBondContact N-OD2 2.98Å; H356-D400 IonicContact ND1-OD2 3.59Å; H356-D400 PolarHBondContact ND1-OD2 2.92Å
357	S	94.5	Very high	95.6	Very high	15 Å²	15	55.3 Å²	55.3	11%	0.105	27%	0.266	C	S	.	.			trans	-116.5	135.1	175.3	-179.8	0	0	0	0	112.5	E359 T360 D400 S401	S357-E359 PolarHBondContact O-N 3.2Å; S357-E359 PolarHBondContact OG-N 2.92Å; S357-T360 VanDerWaalsContact O-CB 3.32Å; S357-T360 WeakPolarHBondContact O-CB 3.4Å; S357-T360 PolarHBondContact O-N 2.81Å; S357-T360 PolarHBondContact O-OG1 3.2Å; S357-D400 PolarHBondContact N-OD1 2.95Å; S357-S401 VanDerWaalsContact CB-OG 3.27Å; S357-S401 WeakPolarHBondContact CB-OG 3.5Å
358	P	94.3	Very high	95.5	Very high	63 Å²	63	55 Å²	55	41%	0.409	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-32.1	171	21.1	-29.9	0	0	0	113	H340 I344 V351 T360 V361	H340-P358 PolarHBondContact CD2-O 3.16Å; H340-P358 PolarHBondContact NE2-O 3.19Å; I344-P358 HydrophobicContact CD1-CB 3.33Å; I344-P358 HydrophobicContact CG1-CB 4.43Å; V351-P358 HydrophobicContact CG1-CB 4.34Å; P358-T360 PolarHBondContact O-N 3.08Å; P358-T360 VanDerWaalsContact O-N 3.15Å; P358-V361 WeakPolarHBondContact O-CB 3.37Å; P358-V361 WeakPolarHBondContact O-CG2 3.45Å; P358-V361 PolarHBondContact O-N 2.93Å; P358-V361 VanDerWaalsContact O-N 3.1Å
359	E	93.6	Very high	95.3	Very high	133 Å²	133	52.3 Å²	52.3	62%	0.621	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.6	-178.4	-61.8	179.8	170.1	0	0	112.7	S357 V361 E362 V363	S357-E359 PolarHBondContact O-N 3.2Å; S357-E359 PolarHBondContact OG-N 2.92Å; E359-V361 PolarHBondContact O-N 2.85Å; E359-E362 WeakPolarHBondContact O-CB 3.43Å; E359-E362 PolarHBondContact O-N 3Å; E359-E362 VanDerWaalsContact O-N 3.07Å; E359-V363 PolarHBondContact O-N 3.5Å
360	T	96	Very high	95.1	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-28.5	176.3	-57.2	0	0	0	0	112.4	F355 S357 P358 E362 V363 L364 I399 D400 V405	F355-T360 HydrophobicContact CD1-CG2 3.72Å; F355-T360 HydrophobicContact CE1-CG2 4.16Å; F355-T360 HydrophobicContact CG-CG2 4.4Å; S357-T360 VanDerWaalsContact O-CB 3.32Å; S357-T360 WeakPolarHBondContact O-CB 3.4Å; S357-T360 PolarHBondContact O-N 2.81Å; S357-T360 PolarHBondContact O-OG1 3.2Å; P358-T360 PolarHBondContact O-N 3.08Å; P358-T360 VanDerWaalsContact O-N 3.15Å; T360-E362 VanDerWaalsContact C-N 3.33Å; T360-E362 PolarHBondContact O-N 3.4Å; T360-V363 PolarHBondContact O-N 2.97Å; T360-L364 WeakPolarHBondContact O-CB 3.48Å; T360-L364 PolarHBondContact O-N 2.82Å; T360-I399 HydrophobicContact CG2-CD1 4.15Å; T360-I399 HydrophobicContact CG2-CG1 4.02Å; T360-I399 PolarHBondContact OG1-O 3.18Å; T360-D400 HydrophobicContact CG2-CB 3.91Å; T360-D400 WeakPolarHBondContact OG1-CA 3.45Å; T360-D400 PolarHBondContact OG1-OD1 3.2Å; T360-D400 VanDerWaalsContact OG1-OD1 3.06Å; T360-V405 HydrophobicContact CG2-CG2 3.84Å
361	V	96.9	Very high	95.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.3	-41.8	175.6	177.2	0	0	0	0	111.3	V312 F339 Y343 V351 F355 P358 E359 A365	V312-V361 HydrophobicContact CG1-CG1 4.46Å; V312-V361 HydrophobicContact CG2-CG1 4.32Å; F339-V361 HydrophobicContact CE1-CG1 4.35Å; Y343-V361 HydrophobicContact CD1-CG1 3.66Å; Y343-V361 HydrophobicContact CD1-CG2 4.27Å; Y343-V361 HydrophobicContact CE1-CG1 4.19Å; Y343-V361 HydrophobicContact CE1-CG2 4.36Å; Y343-V361 HydrophobicContact CG-CG1 4.2Å; V351-V361 HydrophobicContact CG1-CG2 4.35Å; V351-V361 HydrophobicContact CG2-CG2 4.13Å; F355-V361 HydrophobicContact CD2-CG2 3.96Å; F355-V361 HydrophobicContact CE2-CG2 3.91Å; P358-V361 WeakPolarHBondContact O-CB 3.37Å; P358-V361 WeakPolarHBondContact O-CG2 3.45Å; P358-V361 PolarHBondContact O-N 2.93Å; P358-V361 VanDerWaalsContact O-N 3.1Å; E359-V361 PolarHBondContact O-N 2.85Å; V361-A365 VanDerWaalsContact O-CB 3.24Å; V361-A365 WeakPolarHBondContact O-CB 3.41Å; V361-A365 PolarHBondContact O-N 3.45Å
362	E	95.9	Very high	94.9	Very high	62 Å²	62	44.2 Å²	44.2	29%	0.29	21%	0.208	S	C	.	.	H	α-helix	trans	-64.1	-49.7	179.3	-173.8	175.2	150.6	0	0	111.2	M336 H340 E359 T360 A365 Y366	M336-E362 HydrophobicContact CB-CG 4.2Å; H340-E362 HydrophobicContact CB-CB 3.75Å; H340-E362 HydrophobicContact CB-CG 4.32Å; H340-E362 IonicContact CE1-OE2 2.83Å; H340-E362 IonicContact ND1-OE2 3.21Å; H340-E362 PolarHBondContact ND1-OE2 3.36Å; E359-E362 WeakPolarHBondContact O-CB 3.43Å; E359-E362 PolarHBondContact O-N 3Å; E359-E362 VanDerWaalsContact O-N 3.07Å; T360-E362 VanDerWaalsContact C-N 3.33Å; T360-E362 PolarHBondContact O-N 3.4Å; E362-A365 PolarHBondContact O-N 3.37Å; E362-Y366 WeakPolarHBondContact O-CB 3.5Å; E362-Y366 PolarHBondContact O-N 3.46Å
363	V	95.1	Very high	94.6	Very high	46 Å²	46	35.5 Å²	35.5	28%	0.279	18%	0.175	S	C	.	.	H	α-helix	trans	-64	-43.1	-179.8	-178.2	0	0	0	0	110.7	E359 T360 Y366 S367 I399	E359-V363 PolarHBondContact O-N 3.5Å; T360-V363 PolarHBondContact O-N 2.97Å; V363-Y366 WeakPolarHBondContact O-CB 3.27Å; V363-Y366 PolarHBondContact O-N 3.26Å; V363-S367 WeakPolarHBondContact O-CB 3.36Å; V363-S367 PolarHBondContact O-N 3.5Å; V363-I399 HydrophobicContact CG1-CB 4.29Å; V363-I399 HydrophobicContact CG1-CG2 4.28Å
364	L	97.1	Very high	94.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66.1	-44.1	178.3	-177.3	60.8	0	0	0	111.6	V312 F355 T360 Y366 S367 V368 I399 L410 I413	V312-L364 HydrophobicContact CB-CD2 4.4Å; V312-L364 HydrophobicContact CG1-CG 4.5Å; V312-L364 HydrophobicContact CG2-CD2 4.26Å; F355-L364 HydrophobicContact CE1-CD2 3.9Å; F355-L364 HydrophobicContact CZ-CD2 3.82Å; T360-L364 WeakPolarHBondContact O-CB 3.48Å; T360-L364 PolarHBondContact O-N 2.82Å; L364-Y366 VanDerWaalsContact C-N 3.27Å; L364-Y366 PolarHBondContact O-N 3.47Å; L364-S367 WeakPolarHBondContact O-CB 3.41Å; L364-S367 PolarHBondContact O-N 2.86Å; L364-S367 VanDerWaalsContact O-N 3.15Å; L364-V368 VanDerWaalsContact O-CG2 3.31Å; L364-V368 WeakPolarHBondContact O-CG2 3.41Å; L364-V368 PolarHBondContact O-N 2.94Å; L364-I399 HydrophobicContact CB-CD1 4.32Å; L364-I399 HydrophobicContact CD1-CD1 4.24Å; L364-L410 HydrophobicContact CD1-CD2 3.82Å; L364-I413 HydrophobicContact CD1-CD1 4.34Å; L364-I413 HydrophobicContact CD2-CD1 4.07Å; L364-I413 HydrophobicContact CG-CD1 4.44Å
365	A	96.5	Very high	94.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.5	-40.3	176.2	0	0	0	0	0	111.7	V312 L316 M336 F339 V361 E362 V368 L369	V312-A365 HydrophobicContact CG1-CB 4.03Å; L316-A365 HydrophobicContact CD2-CB 4.37Å; M336-A365 HydrophobicContact SD-CB 3.93Å; F339-A365 HydrophobicContact CD1-CB 3.85Å; F339-A365 HydrophobicContact CE1-CB 3.73Å; V361-A365 VanDerWaalsContact O-CB 3.24Å; V361-A365 WeakPolarHBondContact O-CB 3.41Å; V361-A365 PolarHBondContact O-N 3.45Å; E362-A365 PolarHBondContact O-N 3.37Å; A365-V368 PolarHBondContact O-N 3.47Å; A365-L369 PolarHBondContact O-N 2.9Å
366	Y	93.8	Very high	94.1	Very high	26 Å²	26	27 Å²	27	10%	0.102	14%	0.137	C	C	.	.	H	α-helix	trans	-61.2	-47.2	173.4	-161.6	-88.1	0	0	0	112.1	F112 I332 M336 E362 V363 L364 V368 L369 L370	F112-Y366 HydrophobicContact CE1-CE1 4.48Å; F112-Y366 VanDerWaalsContact CE1-OH 3.31Å; F112-Y366 WeakPolarHBondContact CE1-OH 3.23Å; F112-Y366 WeakPolarHBondContact CE2-OH 3.42Å; F112-Y366 HydrophobicContact CZ-CE1 4.32Å; F112-Y366 AromaticContact CZ-CZ 3.87Å; F112-Y366 WeakPolarHBondContact CZ-OH 3.2Å; I332-Y366 HydrophobicContact CG2-CD2 4.41Å; I332-Y366 HydrophobicContact CG2-CE2 3.89Å; M336-Y366 HydrophobicContact CG-CD2 3.91Å; E362-Y366 WeakPolarHBondContact O-CB 3.5Å; E362-Y366 PolarHBondContact O-N 3.46Å; V363-Y366 WeakPolarHBondContact O-CB 3.27Å; V363-Y366 PolarHBondContact O-N 3.26Å; L364-Y366 VanDerWaalsContact C-N 3.27Å; L364-Y366 PolarHBondContact O-N 3.47Å; Y366-V368 VanDerWaalsContact C-N 3.32Å; Y366-V368 PolarHBondContact O-N 3.13Å; Y366-L369 PolarHBondContact O-N 3.05Å; Y366-L370 HydrophobicContact CD1-CD1 3.98Å; Y366-L370 HydrophobicContact CD1-CG 4.17Å; Y366-L370 HydrophobicContact CE1-CD1 3.83Å; Y366-L370 HydrophobicContact CE1-CD2 4.19Å; Y366-L370 HydrophobicContact CE1-CG 3.97Å; Y366-L370 PolarHBondContact O-N 2.86Å; Y366-L370 VanDerWaalsContact O-N 3.1Å
367	S	95.6	Very high	93.7	Very high	7 Å²	7	21.1 Å²	21.1	5%	0.049	11%	0.11	C	C	.	.	H	α-helix	trans	-59.7	-39.8	176.8	-172.5	0	0	0	0	112.4	V363 L364 L369 L370 L371 F392 N396	V363-S367 WeakPolarHBondContact O-CB 3.36Å; V363-S367 PolarHBondContact O-N 3.5Å; L364-S367 WeakPolarHBondContact O-CB 3.41Å; L364-S367 PolarHBondContact O-N 2.86Å; L364-S367 VanDerWaalsContact O-N 3.15Å; S367-L369 VanDerWaalsContact C-N 3.35Å; S367-L369 PolarHBondContact O-N 3.48Å; S367-L370 PolarHBondContact O-N 3.3Å; S367-L371 PolarHBondContact O-N 2.91Å; S367-F392 WeakPolarHBondContact OG-CE2 3.35Å; S367-N396 VanDerWaalsContact CB-OD1 3.23Å; S367-N396 WeakPolarHBondContact CB-OD1 3.45Å; S367-N396 VanDerWaalsContact OG-CG 3.29Å; S367-N396 PolarHBondContact OG-ND2 2.97Å; S367-N396 VanDerWaalsContact OG-ND2 3.08Å; S367-N396 PolarHBondContact OG-OD1 3.08Å
368	V	96.3	Very high	93.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.6	-40.7	174.9	170.6	0	0	0	0	111.8	D313 L316 L364 A365 Y366 L371 H372 I413 I417 F422	D313-V368 HydrophobicContact CB-CG1 3.96Å; D313-V368 HydrophobicContact CB-CG2 4.37Å; L316-V368 HydrophobicContact CD2-CB 4.24Å; L316-V368 HydrophobicContact CD2-CG1 3.98Å; L364-V368 VanDerWaalsContact O-CG2 3.31Å; L364-V368 WeakPolarHBondContact O-CG2 3.41Å; L364-V368 PolarHBondContact O-N 2.94Å; A365-V368 PolarHBondContact O-N 3.47Å; Y366-V368 VanDerWaalsContact C-N 3.32Å; Y366-V368 PolarHBondContact O-N 3.13Å; V368-L371 PolarHBondContact O-N 2.98Å; V368-H372 PolarHBondContact O-N 3.45Å; V368-I413 HydrophobicContact CG2-CG2 3.61Å; V368-I417 HydrophobicContact CG1-CD1 3.74Å; V368-I417 HydrophobicContact CG1-CG1 4.07Å; V368-F422 HydrophobicContact CG1-CE2 4.18Å; V368-F422 HydrophobicContact CG1-CZ 3.78Å
369	L	92.5	Very high	92.6	Very high	6 Å²	6	22.4 Å²	22.4	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-68.8	-36.2	177.9	-173.9	61.9	0	0	0	112.2	I105 V109 I320 I332 M336 A365 Y366 S367 T373 F422	I105-L369 HydrophobicContact CG2-CD1 4.12Å; V109-L369 HydrophobicContact CG2-CD1 4.19Å; V109-L369 HydrophobicContact CG2-CD2 4.26Å; V109-L369 HydrophobicContact CG2-CG 4.01Å; I320-L369 HydrophobicContact CD1-CD1 4.19Å; I332-L369 HydrophobicContact CD1-CD2 4.44Å; I332-L369 HydrophobicContact CG2-CD2 3.56Å; M336-L369 HydrophobicContact CE-CD2 4Å; A365-L369 PolarHBondContact O-N 2.9Å; Y366-L369 PolarHBondContact O-N 3.05Å; S367-L369 VanDerWaalsContact C-N 3.35Å; S367-L369 PolarHBondContact O-N 3.48Å; L369-T373 PolarHBondContact O-N 3.41Å; L369-T373 PolarHBondContact O-OG1 3.41Å; L369-F422 HydrophobicContact CD1-CD2 4.31Å; L369-F422 HydrophobicContact CD1-CE2 4.39Å
370	L	91.6	Very high	91.8	Very high	9 Å²	9	17.8 Å²	17.8	5%	0.047	10%	0.095	C	C	.	.	H	α-helix	trans	-64.1	-44.2	171.4	-67.3	-179.6	0	0	0	111.3	V109 F112 F133 Y366 S367 H372 T373 D374	V109-L370 HydrophobicContact CG1-CD2 4.1Å; F112-L370 HydrophobicContact CD1-CD2 4.16Å; F112-L370 HydrophobicContact CE1-CD2 4.22Å; F133-L370 HydrophobicContact CB-CD1 4.23Å; Y366-L370 HydrophobicContact CD1-CD1 3.98Å; Y366-L370 HydrophobicContact CD1-CG 4.17Å; Y366-L370 HydrophobicContact CE1-CD1 3.83Å; Y366-L370 HydrophobicContact CE1-CD2 4.19Å; Y366-L370 HydrophobicContact CE1-CG 3.97Å; Y366-L370 PolarHBondContact O-N 2.86Å; Y366-L370 VanDerWaalsContact O-N 3.1Å; S367-L370 PolarHBondContact O-N 3.3Å; L370-H372 PolarHBondContact O-N 2.96Å; L370-T373 WeakPolarHBondContact O-CB 3.47Å; L370-T373 PolarHBondContact O-N 3.4Å; L370-T373 VanDerWaalsContact O-N 3.16Å; L370-D374 PolarHBondContact O-N 3.29Å
371	L	95.1	Very high	90.7	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-59.7	-46.7	176	178.6	66.8	0	0	0	111.7	S367 V368 T373 D374 L375 M387 F392 Y414 I417	S367-L371 PolarHBondContact O-N 2.91Å; V368-L371 PolarHBondContact O-N 2.98Å; L371-T373 PolarHBondContact O-N 2.99Å; L371-D374 PolarHBondContact O-N 3.44Å; L371-L375 HydrophobicContact CD1-CD1 3.76Å; L371-L375 HydrophobicContact CD1-CD2 4.47Å; L371-L375 HydrophobicContact CD1-CG 3.88Å; L371-L375 HydrophobicContact CD2-CD1 4.38Å; L371-L375 HydrophobicContact CG-CD1 3.86Å; L371-L375 HydrophobicContact CG-CG 4.26Å; L371-L375 WeakPolarHBondContact O-CB 3.43Å; L371-L375 WeakPolarHBondContact O-CG 3.37Å; L371-L375 PolarHBondContact O-N 3.39Å; L371-M387 HydrophobicContact CD1-CB 4.43Å; L371-M387 HydrophobicContact CD1-SD 4.01Å; L371-F392 HydrophobicContact CB-CD2 4.06Å; L371-F392 HydrophobicContact CB-CE2 3.94Å; L371-F392 HydrophobicContact CD1-CB 4.41Å; L371-F392 HydrophobicContact CD1-CD2 4Å; L371-F392 HydrophobicContact CD1-CG 4.34Å; L371-F392 HydrophobicContact CD2-CD1 4.29Å; L371-F392 HydrophobicContact CD2-CD2 3.8Å; L371-F392 HydrophobicContact CD2-CE1 4.3Å; L371-F392 HydrophobicContact CD2-CE2 3.81Å; L371-F392 HydrophobicContact CD2-CG 4.04Å; L371-F392 HydrophobicContact CD2-CZ 4.07Å; L371-F392 HydrophobicContact CG-CD2 4.16Å; L371-F392 HydrophobicContact CG-CE2 4.33Å; L371-Y414 HydrophobicContact CD1-CD2 3.78Å; L371-Y414 HydrophobicContact CD1-CE2 3.82Å; L371-Y414 HydrophobicContact CD2-CD2 3.83Å; L371-Y414 HydrophobicContact CD2-CG 4.4Å; L371-Y414 HydrophobicContact CG-CD2 4.43Å; L371-I417 HydrophobicContact CD2-CB 4.14Å; L371-I417 HydrophobicContact CD2-CG1 4.41Å; L371-I417 HydrophobicContact CD2-CG2 4.22Å; L371-I417 HydrophobicContact CG-CG2 4.18Å
372	H	93	Very high	89.7	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.009	15%	0.148	C	C	.	.	H	α-helix	trans	-52.1	-44.7	175.2	166.3	-85.2	0	0	0	111.4	V368 L370 L375 H376 I417 F422	V368-H372 PolarHBondContact O-N 3.45Å; L370-H372 PolarHBondContact O-N 2.96Å; H372-L375 PolarHBondContact O-N 2.68Å; H372-H376 AromaticContact CD2-CD2 3.71Å; H372-H376 WeakPolarHBondContact O-CB 3.33Å; H372-H376 PolarHBondContact O-CD2 3.41Å; H372-H376 PolarHBondContact O-N 3.14Å; H372-I417 HydrophobicContact CB-CG2 4.09Å; H372-F422 HydrophobicContact CB-CD2 3.95Å; H372-F422 HydrophobicContact CB-CE2 4.04Å; H372-F422 AromaticContact CD2-CD2 3.56Å; H372-F422 AromaticContact CD2-CG 3.64Å; H372-F422 PolarHBondContact CD2-N 3.01Å; H372-F422 AromaticContact CG-CD2 3.64Å; H372-F422 PolarHBondContact NE2-N 3.35Å
373	T	89.2	Confident	88.6	Confident	4 Å²	4	33 Å²	33	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-67.8	-44.8	-179.2	-53.4	0	0	0	0	111.2	V109 L369 L370 L371 L375 N377	V109-T373 HydrophobicContact CB-CG2 3.6Å; V109-T373 WeakPolarHBondContact CB-OG1 3.46Å; V109-T373 HydrophobicContact CG1-CG2 3.79Å; V109-T373 WeakPolarHBondContact CG1-OG1 3.45Å; V109-T373 WeakPolarHBondContact CG2-OG1 3.42Å; L369-T373 PolarHBondContact O-N 3.41Å; L369-T373 PolarHBondContact O-OG1 3.41Å; L370-T373 WeakPolarHBondContact O-CB 3.47Å; L370-T373 PolarHBondContact O-N 3.4Å; L370-T373 VanDerWaalsContact O-N 3.16Å; L371-T373 PolarHBondContact O-N 2.99Å; T373-L375 VanDerWaalsContact C-N 3.32Å; T373-L375 PolarHBondContact O-N 3.05Å; T373-N377 HydrophobicContact CG2-CB 4.26Å; T373-N377 WeakPolarHBondContact O-CA 2.81Å; T373-N377 WeakPolarHBondContact O-CB 3.22Å; T373-N377 PolarHBondContact O-N 3.46Å
374	D	91.3	Very high	87.8	Confident	10 Å²	10	32.8 Å²	32.8	5%	0.053	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-43.9	177.1	-170	96.6	0	0	0	112.2	Y134 L370 L371 R386 M387	Y134-D374 PolarHBondContact OH-OD1 2.99Å; L370-D374 PolarHBondContact O-N 3.29Å; L371-D374 PolarHBondContact O-N 3.44Å; D374-R386 WeakPolarHBondContact OD2-CA 3.1Å; D374-M387 WeakPolarHBondContact OD2-CB 2.93Å; D374-M387 PolarHBondContact OD2-N 3.37Å
375	L	92.7	Very high	87.2	Confident	11 Å²	11	41.5 Å²	41.5	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-78.5	-35.9	-175.7	-65.4	-176.7	0	0	0	114	L371 H372 T373 R386 Y414 I417 A418	L371-L375 HydrophobicContact CD1-CD1 3.76Å; L371-L375 HydrophobicContact CD1-CD2 4.47Å; L371-L375 HydrophobicContact CD1-CG 3.88Å; L371-L375 HydrophobicContact CD2-CD1 4.38Å; L371-L375 HydrophobicContact CG-CD1 3.86Å; L371-L375 HydrophobicContact CG-CG 4.26Å; L371-L375 WeakPolarHBondContact O-CB 3.43Å; L371-L375 WeakPolarHBondContact O-CG 3.37Å; L371-L375 PolarHBondContact O-N 3.39Å; H372-L375 PolarHBondContact O-N 2.68Å; T373-L375 VanDerWaalsContact C-N 3.32Å; T373-L375 PolarHBondContact O-N 3.05Å; L375-R386 HydrophobicContact CD2-CB 4.34Å; L375-R386 PolarHBondContact O-NH1 2.77Å; L375-R386 PolarHBondContact O-NH2 3.19Å; L375-Y414 HydrophobicContact CD1-CE2 4.23Å; L375-Y414 HydrophobicContact CD2-CE2 4.44Å; L375-I417 HydrophobicContact CD1-CG2 4.18Å; L375-A418 HydrophobicContact CD1-CB 3.9Å
376	H	90.3	Very high	86.9	Confident	38 Å²	38	46.6 Å²	46.6	18%	0.176	24%	0.24	C	C	.	.	H	α-helix	trans	-109	-11	-171.8	-62.1	-63	0	0	0	114.1	H372 P378 I417 E421	H372-H376 AromaticContact CD2-CD2 3.71Å; H372-H376 WeakPolarHBondContact O-CB 3.33Å; H372-H376 PolarHBondContact O-CD2 3.41Å; H372-H376 PolarHBondContact O-N 3.14Å; H376-P378 WeakPolarHBondContact O-CD 3.21Å; H376-I417 PolarHBondContact NE2-O 3.28Å; H376-E421 HydrophobicContact CB-CB 4.04Å; H376-E421 VanDerWaalsContact CG-CB 3.48Å; H376-E421 WeakPolarHBondContact NE2-CA 3.29Å; H376-E421 PolarHBondContact NE2-N 3.47Å
377	N	86	Confident	86.8	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.037	24%	0.24	C	C	.	.			trans	-75.3	120.1	172.8	-172.8	-6.5	0	0	0	110.9	S110 T373 N379 V380	S110-N377 PolarHBondContact OG-ND2 3.4Å; T373-N377 HydrophobicContact CG2-CB 4.26Å; T373-N377 WeakPolarHBondContact O-CA 2.81Å; T373-N377 WeakPolarHBondContact O-CB 3.22Å; T373-N377 PolarHBondContact O-N 3.46Å; N377-N379 PolarHBondContact O-N 3.26Å; N377-N379 WeakPolarHBondContact OD1-CB 3.42Å; N377-N379 PolarHBondContact OD1-N 3.46Å; N377-V380 HydrophobicContact CB-CB 4.41Å; N377-V380 HydrophobicContact CB-CG2 3.85Å; N377-V380 PolarHBondContact O-N 3.21Å
378	P	84.6	Confident	86.8	Confident	23 Å²	23	49 Å²	49	15%	0.149	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-25.2	176.5	31.2	-43.2	0	0	0	113.8	Y102 H376	Y102-P378 HydrophobicContact CE1-CB 4.38Å; Y102-P378 HydrophobicContact CE1-CG 3.61Å; Y102-P378 WeakPolarHBondContact OH-CB 3.43Å; Y102-P378 WeakPolarHBondContact OH-CG 3.17Å; H376-P378 WeakPolarHBondContact O-CD 3.21Å
379	N	80.8	Confident	86.9	Confident	83 Å²	83	51.8 Å²	51.8	44%	0.444	27%	0.268	S	S	.	.	H	α-helix	trans	-74.1	-31.5	-178	-64.9	-32.1	0	0	0	111.7	N377 K382 M383	N377-N379 PolarHBondContact O-N 3.26Å; N377-N379 WeakPolarHBondContact OD1-CB 3.42Å; N377-N379 PolarHBondContact OD1-N 3.46Å; N379-K382 PolarHBondContact O-N 3.39Å; N379-M383 PolarHBondContact O-N 3.03Å
380	V	77.5	Confident	87.1	Confident	35 Å²	35	56.2 Å²	56.2	21%	0.212	29%	0.288	C	S	.	.	H	α-helix	trans	-64.6	-45.4	177.6	174.7	0	0	0	0	110.6	N377 K382 M383 G384	N377-V380 HydrophobicContact CB-CB 4.41Å; N377-V380 HydrophobicContact CB-CG2 3.85Å; N377-V380 PolarHBondContact O-N 3.21Å; V380-K382 PolarHBondContact O-N 3.5Å; V380-K382 VanDerWaalsContact O-N 3.16Å; V380-M383 PolarHBondContact O-N 3.2Å; V380-G384 PolarHBondContact O-N 3.02Å
381	G	72.7	Confident	87.3	Confident	40 Å²	40	56.7 Å²	56.7	41%	0.412	30%	0.295	S	S	.	.	H	α-helix	trans	-62.7	-23.1	178.1	0	0	0	0	0	114.1
382	K	75.4	Confident	87.4	Confident	168 Å²	168	56.7 Å²	56.7	73%	0.73	30%	0.295	S	S	*	.	H	α-helix	trans	-81.4	-29.1	174.5	-66.7	176	-177	176	0	112.8	N379 V380	N379-K382 PolarHBondContact O-N 3.39Å; V380-K382 PolarHBondContact O-N 3.5Å; V380-K382 VanDerWaalsContact O-N 3.16Å
383	M	74.4	Confident	87.6	Confident	177 Å²	177	57.1 Å²	57.1	87%	0.872	30%	0.297	S	S	*	.	H	α-helix	trans	-91.7	-17.4	-176.9	-66.7	-154.9	176.8	0	0	113.6	N379 V380	N379-M383 PolarHBondContact O-N 3.03Å; V380-M383 PolarHBondContact O-N 3.2Å
384	G	77.7	Confident	87.9	Confident	41 Å²	41	60.2 Å²	60.2	42%	0.423	31%	0.314	S	S	.	.	S	Bend	trans	178	-172.3	178.5	0	0	0	0	0	114	V380	V380-G384 PolarHBondContact O-N 3.02Å
385	K	85.3	Confident	88.1	Confident	183 Å²	183	63.2 Å²	63.2	80%	0.796	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-74.1	128.8	175.2	-172.1	-178.9	177.8	179.3	0	109.2
386	R	89.7	Confident	88.3	Confident	108 Å²	108	62.8 Å²	62.8	41%	0.408	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-59.1	148.7	171	-65.8	-179.3	174.2	-174.2	-8.9	111.2	D374 L375 T388	D374-R386 WeakPolarHBondContact OD2-CA 3.1Å; L375-R386 HydrophobicContact CD2-CB 4.34Å; L375-R386 PolarHBondContact O-NH1 2.77Å; L375-R386 PolarHBondContact O-NH2 3.19Å; R386-T388 PolarHBondContact O-N 3.47Å
387	M	91.9	Very high	88.5	Confident	23 Å²	23	68 Å²	68	11%	0.113	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-55.9	124.9	176.9	-169.1	177.7	-50.6	0	0	109.5	Y134 L371 D374 F392 N395 Y414	Y134-M387 HydrophobicContact CE2-CE 4.4Å; Y134-M387 VanDerWaalsContact OH-CE 3.26Å; Y134-M387 WeakPolarHBondContact OH-CE 3.35Å; L371-M387 HydrophobicContact CD1-CB 4.43Å; L371-M387 HydrophobicContact CD1-SD 4.01Å; D374-M387 WeakPolarHBondContact OD2-CB 2.93Å; D374-M387 PolarHBondContact OD2-N 3.37Å; M387-F392 HydrophobicContact CG-CB 4.36Å; M387-F392 HydrophobicContact SD-CB 3.84Å; M387-F392 HydrophobicContact SD-CD2 4.02Å; M387-F392 HydrophobicContact SD-CG 4.46Å; M387-N395 WeakPolarHBondContact CE-ND2 3.31Å; M387-N395 PolarHBondContact SD-ND2 3.07Å; M387-Y414 PolarHBondContact O-OH 2.91Å
388	T	95.4	Very high	88.9	Confident	60 Å²	60	68.7 Å²	68.7	37%	0.368	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-79.5	161.9	174	60.5	0	0	0	0	110.1	R386 Q390 G391 F392	R386-T388 PolarHBondContact O-N 3.47Å; T388-Q390 VanDerWaalsContact C-N 3.28Å; T388-Q390 PolarHBondContact O-N 3.16Å; T388-G391 CarbonylContact O-C 3.32Å; T388-G391 VanDerWaalsContact O-CA 3.31Å; T388-G391 WeakPolarHBondContact O-CA 3.31Å; T388-G391 PolarHBondContact O-N 3.18Å; T388-G391 PolarHBondContact OG1-N 2.85Å; T388-G391 VanDerWaalsContact OG1-N 3.1Å; T388-F392 PolarHBondContact O-N 3.25Å
389	K	97	Very high	89.4	Confident	59 Å²	59	68.1 Å²	68.1	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-48.9	-49	171.7	-179.2	-176.8	-81.9	-160	0	112	G391 F392 I393 E411 Y414 D415	K389-G391 VanDerWaalsContact C-N 3.31Å; K389-G391 PolarHBondContact O-N 3.29Å; K389-F392 WeakPolarHBondContact O-CB 3.48Å; K389-F392 PolarHBondContact O-N 3.26Å; K389-I393 HydrophobicContact CG-CD1 4.35Å; K389-I393 WeakPolarHBondContact O-CG1 3.44Å; K389-I393 PolarHBondContact O-N 3.16Å; K389-E411 HydrophobicContact CD-CB 4.22Å; K389-E411 HydrophobicContact CD-CG 3.79Å; K389-E411 HydrophobicContact CG-CG 4.12Å; K389-E411 IonicContact NZ-OE2 3.05Å; K389-Y414 HydrophobicContact CB-CD1 3.79Å; K389-Y414 HydrophobicContact CB-CD2 4.33Å; K389-Y414 HydrophobicContact CB-CE1 3.84Å; K389-Y414 HydrophobicContact CB-CE2 4.34Å; K389-Y414 HydrophobicContact CB-CG 4.06Å; K389-Y414 HydrophobicContact CG-CD1 4.09Å; K389-Y414 HydrophobicContact CG-CG 4.18Å; K389-Y414 VanDerWaalsContact N-CZ 3.34Å; K389-Y414 PolarHBondContact N-OH 2.75Å; K389-D415 WeakPolarHBondContact CE-OD1 3.42Å; K389-D415 IonicContact NZ-OD1 3.51Å; K389-D415 PolarHBondContact NZ-OD1 3.49Å; K389-D415 IonicContact NZ-OD2 2.81Å; K389-D415 PolarHBondContact NZ-OD2 2.84Å
390	Q	96.7	Very high	90.1	Very high	99 Å²	99	64.2 Å²	64.2	46%	0.463	33%	0.33	S	S	.	.	H	α-helix	trans	-62.8	-36.1	175.2	-170.8	61	53.1	0	0	113	T388 I393 N394	T388-Q390 VanDerWaalsContact C-N 3.28Å; T388-Q390 PolarHBondContact O-N 3.16Å; Q390-I393 PolarHBondContact O-N 3.05Å; Q390-N394 PolarHBondContact NE2-OD1 2.81Å; Q390-N394 WeakPolarHBondContact O-CB 3.31Å; Q390-N394 PolarHBondContact O-N 3.36Å; Q390-N394 PolarHBondContact O-ND2 2.78Å; Q390-N394 PolarHBondContact O-OD1 2.88Å
391	G	96	Very high	90.8	Very high	18 Å²	18	65.7 Å²	65.7	19%	0.186	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-43.5	174.2	0	0	0	0	0	111.9	T388 K389 N394 N395	T388-G391 CarbonylContact O-C 3.32Å; T388-G391 VanDerWaalsContact O-CA 3.31Å; T388-G391 WeakPolarHBondContact O-CA 3.31Å; T388-G391 PolarHBondContact O-N 3.18Å; T388-G391 PolarHBondContact OG1-N 2.85Å; T388-G391 VanDerWaalsContact OG1-N 3.1Å; K389-G391 VanDerWaalsContact C-N 3.31Å; K389-G391 PolarHBondContact O-N 3.29Å; G391-N394 PolarHBondContact O-N 3.36Å; G391-N395 WeakPolarHBondContact O-CB 3.42Å; G391-N395 PolarHBondContact O-N 3.07Å; G391-N395 PolarHBondContact O-ND2 3.25Å; G391-N395 PolarHBondContact O-OD1 3.24Å
392	F	97.3	Very high	91.7	Very high	1 Å²	1	71.1 Å²	71.1	0%	0.004	36%	0.361	C	S	.	.	H	α-helix	trans	-62.5	-44	175.3	-179	-111	0	0	0	112	S367 L371 M387 T388 K389 N394 N395 N396 L410 I413 Y414	S367-F392 WeakPolarHBondContact OG-CE2 3.35Å; L371-F392 HydrophobicContact CB-CD2 4.06Å; L371-F392 HydrophobicContact CB-CE2 3.94Å; L371-F392 HydrophobicContact CD1-CB 4.41Å; L371-F392 HydrophobicContact CD1-CD2 4Å; L371-F392 HydrophobicContact CD1-CG 4.34Å; L371-F392 HydrophobicContact CD2-CD1 4.29Å; L371-F392 HydrophobicContact CD2-CD2 3.8Å; L371-F392 HydrophobicContact CD2-CE1 4.3Å; L371-F392 HydrophobicContact CD2-CE2 3.81Å; L371-F392 HydrophobicContact CD2-CG 4.04Å; L371-F392 HydrophobicContact CD2-CZ 4.07Å; L371-F392 HydrophobicContact CG-CD2 4.16Å; L371-F392 HydrophobicContact CG-CE2 4.33Å; M387-F392 HydrophobicContact CG-CB 4.36Å; M387-F392 HydrophobicContact SD-CB 3.84Å; M387-F392 HydrophobicContact SD-CD2 4.02Å; M387-F392 HydrophobicContact SD-CG 4.46Å; T388-F392 PolarHBondContact O-N 3.25Å; K389-F392 WeakPolarHBondContact O-CB 3.48Å; K389-F392 PolarHBondContact O-N 3.26Å; F392-N394 PolarHBondContact O-N 3.24Å; F392-N395 PolarHBondContact O-N 3.02Å; F392-N396 WeakPolarHBondContact CD2-ND2 3.42Å; F392-N396 WeakPolarHBondContact CE2-ND2 3.46Å; F392-N396 WeakPolarHBondContact CZ-ND2 3.19Å; F392-N396 PolarHBondContact O-N 3.05Å; F392-N396 PolarHBondContact O-ND2 3.38Å; F392-L410 HydrophobicContact CD1-CB 4.39Å; F392-L410 HydrophobicContact CE1-CB 4.2Å; F392-L410 HydrophobicContact CE1-CD2 3.96Å; F392-L410 HydrophobicContact CZ-CD2 4.46Å; F392-I413 HydrophobicContact CE1-CB 4.39Å; F392-I413 HydrophobicContact CE1-CG2 3.93Å; F392-I413 HydrophobicContact CZ-CG2 3.94Å; F392-Y414 HydrophobicContact CB-CD2 3.79Å; F392-Y414 HydrophobicContact CB-CE2 4.37Å; F392-Y414 HydrophobicContact CD1-CD2 4.37Å; F392-Y414 HydrophobicContact CG-CD2 4.19Å
393	I	97.4	Very high	92.6	Very high	12 Å²	12	67.8 Å²	67.8	6%	0.062	35%	0.348	C	S	.	.	H	α-helix	trans	-59.6	-48.7	174.9	-65.2	160.1	0	0	0	110.6	K389 Q390 N395 N396 R397 T407 L410 E411	K389-I393 HydrophobicContact CG-CD1 4.35Å; K389-I393 WeakPolarHBondContact O-CG1 3.44Å; K389-I393 PolarHBondContact O-N 3.16Å; Q390-I393 PolarHBondContact O-N 3.05Å; I393-N395 VanDerWaalsContact C-N 3.3Å; I393-N395 PolarHBondContact O-N 3.19Å; I393-N396 PolarHBondContact O-N 3.44Å; I393-N396 VanDerWaalsContact O-N 3.13Å; I393-R397 PolarHBondContact O-N 3.01Å; I393-T407 HydrophobicContact CD1-CG2 3.85Å; I393-L410 HydrophobicContact CG1-CB 4.08Å; I393-L410 HydrophobicContact CG1-CD1 4.43Å; I393-L410 HydrophobicContact CG2-CD1 4.35Å; I393-E411 HydrophobicContact CD1-CG 3.86Å
394	N	96.6	Very high	93.5	Very high	69 Å²	69	64 Å²	64	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-36.4	-178.9	-69.9	-11.8	0	0	0	112.8	Q390 G391 F392 N396 R397	Q390-N394 PolarHBondContact NE2-OD1 2.81Å; Q390-N394 WeakPolarHBondContact O-CB 3.31Å; Q390-N394 PolarHBondContact O-N 3.36Å; Q390-N394 PolarHBondContact O-ND2 2.78Å; Q390-N394 PolarHBondContact O-OD1 2.88Å; G391-N394 PolarHBondContact O-N 3.36Å; F392-N394 PolarHBondContact O-N 3.24Å; N394-N396 PolarHBondContact O-N 3.44Å; N394-R397 PolarHBondContact O-N 3.24Å; N394-R397 PolarHBondContact OD1-NE 2.91Å; N394-R397 PolarHBondContact OD1-NH2 3.41Å
395	N	95	Very high	94.4	Very high	73 Å²	73	62.2 Å²	62.2	39%	0.39	31%	0.312	S	S	.	.	H	α-helix	trans	-68.3	-23.9	177.5	-71.6	-12.2	0	0	0	113	F133 M387 G391 F392 I393	F133-N395 HydrophobicContact CE1-CB 4.39Å; F133-N395 VanDerWaalsContact CE1-O 3.29Å; F133-N395 WeakPolarHBondContact CE1-O 3.44Å; M387-N395 WeakPolarHBondContact CE-ND2 3.31Å; M387-N395 PolarHBondContact SD-ND2 3.07Å; G391-N395 WeakPolarHBondContact O-CB 3.42Å; G391-N395 PolarHBondContact O-N 3.07Å; G391-N395 PolarHBondContact O-ND2 3.25Å; G391-N395 PolarHBondContact O-OD1 3.24Å; F392-N395 PolarHBondContact O-N 3.02Å; I393-N395 VanDerWaalsContact C-N 3.3Å; I393-N395 PolarHBondContact O-N 3.19Å
396	N	96.3	Very high	94.9	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	18.6	-179.6	-69	-74.9	0	0	0	112.9	S367 F392 I393 N394 I399 L410	S367-N396 VanDerWaalsContact CB-OD1 3.23Å; S367-N396 WeakPolarHBondContact CB-OD1 3.45Å; S367-N396 VanDerWaalsContact OG-CG 3.29Å; S367-N396 PolarHBondContact OG-ND2 2.97Å; S367-N396 VanDerWaalsContact OG-ND2 3.08Å; S367-N396 PolarHBondContact OG-OD1 3.08Å; F392-N396 WeakPolarHBondContact CD2-ND2 3.42Å; F392-N396 WeakPolarHBondContact CE2-ND2 3.46Å; F392-N396 WeakPolarHBondContact CZ-ND2 3.19Å; F392-N396 PolarHBondContact O-N 3.05Å; F392-N396 PolarHBondContact O-ND2 3.38Å; I393-N396 PolarHBondContact O-N 3.44Å; I393-N396 VanDerWaalsContact O-N 3.13Å; N394-N396 PolarHBondContact O-N 3.44Å; N396-I399 HydrophobicContact CB-CD1 3.92Å; N396-I399 WeakPolarHBondContact O-CG1 3.43Å; N396-L410 HydrophobicContact CB-CD1 4.11Å; N396-L410 HydrophobicContact CB-CD2 4.23Å
397	R	95.9	Very high	95.2	Very high	147 Å²	147	54.5 Å²	54.5	56%	0.555	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	139.5	173.3	-71.4	-177.5	-175.9	-148.3	1.6	111.4	I393 N394 I399 D404	I393-R397 PolarHBondContact O-N 3.01Å; N394-R397 PolarHBondContact O-N 3.24Å; N394-R397 PolarHBondContact OD1-NE 2.91Å; N394-R397 PolarHBondContact OD1-NH2 3.41Å; R397-I399 PolarHBondContact O-N 2.91Å; R397-D404 WeakPolarHBondContact CA-OD1 3.5Å; R397-D404 WeakPolarHBondContact CB-OD1 3.36Å
398	G	94.1	Very high	95.4	Very high	23 Å²	23	60 Å²	60	24%	0.237	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	10.4	176.6	0	0	0	0	0	115.8	D400 D402 H403 D404	G398-D400 PolarHBondContact O-N 2.93Å; G398-D402 PolarHBondContact O-N 2.83Å; G398-H403 CarbonylContact C-O 3.56Å; G398-H403 VanDerWaalsContact CA-O 3.23Å; G398-H403 WeakPolarHBondContact CA-O 3.3Å; G398-D404 PolarHBondContact N-OD1 3.38Å
399	I	94.5	Very high	95.5	Very high	10 Å²	10	57.9 Å²	57.9	5%	0.051	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-12.3	-177.9	69.2	169.9	0	0	0	113.4	T360 V363 L364 N396 R397 H403 V405	T360-I399 HydrophobicContact CG2-CD1 4.15Å; T360-I399 HydrophobicContact CG2-CG1 4.02Å; T360-I399 PolarHBondContact OG1-O 3.18Å; V363-I399 HydrophobicContact CG1-CB 4.29Å; V363-I399 HydrophobicContact CG1-CG2 4.28Å; L364-I399 HydrophobicContact CB-CD1 4.32Å; L364-I399 HydrophobicContact CD1-CD1 4.24Å; N396-I399 HydrophobicContact CB-CD1 3.92Å; N396-I399 WeakPolarHBondContact O-CG1 3.43Å; R397-I399 PolarHBondContact O-N 2.91Å; I399-H403 PolarHBondContact N-O 2.9Å; I399-V405 HydrophobicContact CD1-CG2 3.81Å; I399-V405 HydrophobicContact CG1-CG2 3.7Å
400	D	95.2	Very high	95.6	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.011	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-104.6	67.9	-177.8	-169	20.8	0	0	0	111.4	F355 H356 S357 T360 G398 D402 H403 V405	F355-D400 WeakPolarHBondContact CA-OD2 3.4Å; H356-D400 WeakPolarHBondContact CA-OD1 3.49Å; H356-D400 WeakPolarHBondContact CB-OD1 3.37Å; H356-D400 IonicContact CE1-OD2 2.77Å; H356-D400 IonicContact CG-OD2 2.71Å; H356-D400 VanDerWaalsContact N-CG 3.27Å; H356-D400 PolarHBondContact N-OD1 2.89Å; H356-D400 PolarHBondContact N-OD2 2.98Å; H356-D400 IonicContact ND1-OD2 3.59Å; H356-D400 PolarHBondContact ND1-OD2 2.92Å; S357-D400 PolarHBondContact N-OD1 2.95Å; T360-D400 HydrophobicContact CG2-CB 3.91Å; T360-D400 WeakPolarHBondContact OG1-CA 3.45Å; T360-D400 PolarHBondContact OG1-OD1 3.2Å; T360-D400 VanDerWaalsContact OG1-OD1 3.06Å; G398-D400 PolarHBondContact O-N 2.93Å; D400-D402 PolarHBondContact O-N 3.18Å; D400-H403 HydrophobicContact CB-CB 4.45Å; D400-H403 WeakPolarHBondContact CB-O 3.34Å; D400-H403 PolarHBondContact N-O 3.33Å; D400-H403 VanDerWaalsContact N-O 3.08Å; D400-H403 WeakPolarHBondContact O-CA 3.37Å; D400-H403 VanDerWaalsContact O-CB 3.25Å; D400-H403 WeakPolarHBondContact O-CB 3.43Å; D400-H403 PolarHBondContact O-N 3.21Å; D400-H403 PolarHBondContact O-ND1 3.5Å; D400-V405 HydrophobicContact CB-CG2 4.08Å
401	S	92.1	Very high	95.6	Very high	66 Å²	66	53.6 Å²	53.6	46%	0.462	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	55.7	-175.4	-66.5	0	0	0	0	112.3	S357 H403	S357-S401 VanDerWaalsContact CB-OG 3.27Å; S357-S401 WeakPolarHBondContact CB-OG 3.5Å; S401-H403 PolarHBondContact O-N 2.71Å; S401-H403 PolarHBondContact O-ND1 2.89Å
402	D	90.8	Very high	95.7	Very high	154 Å²	154	53.7 Å²	53.7	82%	0.824	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	4.4	-175.7	-54.3	-50	0	0	0	115.3	G398 D400	G398-D402 PolarHBondContact O-N 2.83Å; D400-D402 PolarHBondContact O-N 3.18Å
403	H	94.3	Very high	95.7	Very high	98 Å²	98	53.6 Å²	53.6	45%	0.454	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-98.5	159.6	169.4	-55.7	71.7	0	0	0	111.1	G398 I399 D400 S401	G398-H403 CarbonylContact C-O 3.56Å; G398-H403 VanDerWaalsContact CA-O 3.23Å; G398-H403 WeakPolarHBondContact CA-O 3.3Å; I399-H403 PolarHBondContact N-O 2.9Å; D400-H403 HydrophobicContact CB-CB 4.45Å; D400-H403 WeakPolarHBondContact CB-O 3.34Å; D400-H403 PolarHBondContact N-O 3.33Å; D400-H403 VanDerWaalsContact N-O 3.08Å; D400-H403 WeakPolarHBondContact O-CA 3.37Å; D400-H403 VanDerWaalsContact O-CB 3.25Å; D400-H403 WeakPolarHBondContact O-CB 3.43Å; D400-H403 PolarHBondContact O-N 3.21Å; D400-H403 PolarHBondContact O-ND1 3.5Å; S401-H403 PolarHBondContact O-N 2.71Å; S401-H403 PolarHBondContact O-ND1 2.89Å
404	D	94.7	Very high	95.8	Very high	97 Å²	97	54.7 Å²	54.7	52%	0.519	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-87.9	135.1	175.3	-70.7	-22	0	0	0	110.3	R397 G398	R397-D404 WeakPolarHBondContact CA-OD1 3.5Å; R397-D404 WeakPolarHBondContact CB-OD1 3.36Å; G398-D404 PolarHBondContact N-OD1 3.38Å
405	V	95.5	Very high	95.9	Very high	3 Å²	3	55 Å²	55	2%	0.018	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-64.8	139.7	167	176.1	0	0	0	0	108.8	F355 T360 I399 D400 T407 L409 L410	F355-V405 HydrophobicContact CD1-CG2 4.2Å; F355-V405 HydrophobicContact CE1-CG1 3.97Å; F355-V405 HydrophobicContact CE1-CG2 4.11Å; T360-V405 HydrophobicContact CG2-CG2 3.84Å; I399-V405 HydrophobicContact CD1-CG2 3.81Å; I399-V405 HydrophobicContact CG1-CG2 3.7Å; D400-V405 HydrophobicContact CB-CG2 4.08Å; V405-T407 PolarHBondContact O-N 2.77Å; V405-L409 HydrophobicContact CG1-CB 4.47Å; V405-L409 HydrophobicContact CG1-CD2 3.79Å; V405-L409 HydrophobicContact CG1-CG 4.43Å; V405-L410 HydrophobicContact CB-CD1 4.24Å; V405-L410 HydrophobicContact CB-CD2 4.26Å; V405-L410 HydrophobicContact CB-CG 4.24Å; V405-L410 HydrophobicContact CG1-CD2 4Å; V405-L410 HydrophobicContact CG1-CG 4.03Å
406	S	96.1	Very high	96	Very high	60 Å²	60	55.3 Å²	55.3	42%	0.42	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-49.4	129.6	-177.3	63.8	0	0	0	0	112.2	D408 L409 L410	S406-D408 VanDerWaalsContact C-N 3.27Å; S406-D408 PolarHBondContact O-N 3.12Å; S406-L409 WeakPolarHBondContact O-CB 3.49Å; S406-L409 PolarHBondContact O-N 3.33Å; S406-L409 VanDerWaalsContact O-N 3.08Å; S406-L409 WeakPolarHBondContact OG-CB 3.18Å; S406-L410 PolarHBondContact O-N 3.23Å
407	T	96.4	Very high	96	Very high	70 Å²	70	55.2 Å²	55.2	43%	0.429	29%	0.293	S	S	.	.	H	α-helix	trans	-54.3	-43.6	-178.6	-50.8	0	0	0	0	112	I393 V405 L409 L410 E411	I393-T407 HydrophobicContact CD1-CG2 3.85Å; V405-T407 PolarHBondContact O-N 2.77Å; T407-L409 VanDerWaalsContact C-N 3.29Å; T407-L409 PolarHBondContact O-N 3.38Å; T407-L410 PolarHBondContact O-N 3.13Å; T407-L410 VanDerWaalsContact O-N 3.1Å; T407-E411 HydrophobicContact CG2-CG 4.17Å; T407-E411 WeakPolarHBondContact O-CG 3.46Å; T407-E411 PolarHBondContact O-N 2.85Å
408	D	97	Very high	96	Very high	138 Å²	138	50.3 Å²	50.3	74%	0.738	28%	0.284	S	S	*	.	H	α-helix	trans	-57.4	-40.1	179.7	-61.3	-19	0	0	0	112.7	S406 G412	S406-D408 VanDerWaalsContact C-N 3.27Å; S406-D408 PolarHBondContact O-N 3.12Å; D408-G412 PolarHBondContact O-N 3.01Å
409	L	96.8	Very high	96.2	Very high	15 Å²	15	53.4 Å²	53.4	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-66.3	-45.3	176.5	180	62.1	0	0	0	111.2	E311 F355 V405 S406 T407 G412 I413	E311-L409 HydrophobicContact CG-CD1 4.41Å; F355-L409 HydrophobicContact CE1-CD2 4Å; F355-L409 HydrophobicContact CZ-CD2 3.88Å; V405-L409 HydrophobicContact CG1-CB 4.47Å; V405-L409 HydrophobicContact CG1-CD2 3.79Å; V405-L409 HydrophobicContact CG1-CG 4.43Å; S406-L409 WeakPolarHBondContact O-CB 3.49Å; S406-L409 PolarHBondContact O-N 3.33Å; S406-L409 VanDerWaalsContact O-N 3.08Å; S406-L409 WeakPolarHBondContact OG-CB 3.18Å; T407-L409 VanDerWaalsContact C-N 3.29Å; T407-L409 PolarHBondContact O-N 3.38Å; L409-G412 PolarHBondContact O-N 2.98Å; L409-I413 HydrophobicContact CD1-CD1 4.2Å; L409-I413 HydrophobicContact CD1-CG1 4.46Å; L409-I413 HydrophobicContact CG-CD1 4.01Å; L409-I413 WeakPolarHBondContact O-CB 3.36Å; L409-I413 VanDerWaalsContact O-CG1 3.23Å; L409-I413 WeakPolarHBondContact O-CG1 3.47Å; L409-I413 PolarHBondContact O-N 3.31Å
410	L	98.1	Very high	96.1	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-66.6	-38.3	-180	-65.3	178	0	0	0	112	L364 F392 I393 N396 V405 S406 T407 Y414	L364-L410 HydrophobicContact CD1-CD2 3.82Å; F392-L410 HydrophobicContact CD1-CB 4.39Å; F392-L410 HydrophobicContact CE1-CB 4.2Å; F392-L410 HydrophobicContact CE1-CD2 3.96Å; F392-L410 HydrophobicContact CZ-CD2 4.46Å; I393-L410 HydrophobicContact CG1-CB 4.08Å; I393-L410 HydrophobicContact CG1-CD1 4.43Å; I393-L410 HydrophobicContact CG2-CD1 4.35Å; N396-L410 HydrophobicContact CB-CD1 4.11Å; N396-L410 HydrophobicContact CB-CD2 4.23Å; V405-L410 HydrophobicContact CB-CD1 4.24Å; V405-L410 HydrophobicContact CB-CD2 4.26Å; V405-L410 HydrophobicContact CB-CG 4.24Å; V405-L410 HydrophobicContact CG1-CD2 4Å; V405-L410 HydrophobicContact CG1-CG 4.03Å; S406-L410 PolarHBondContact O-N 3.23Å; T407-L410 PolarHBondContact O-N 3.13Å; T407-L410 VanDerWaalsContact O-N 3.1Å; L410-Y414 WeakPolarHBondContact O-CB 3.38Å; L410-Y414 PolarHBondContact O-N 2.99Å
411	E	98	Very high	96	Very high	66 Å²	66	57.8 Å²	57.8	31%	0.308	33%	0.334	S	S	.	.	H	α-helix	trans	-64.7	-45.9	174.2	-70	-160.9	-172.8	0	0	111.9	K389 I393 T407 I413 Y414 D415	K389-E411 HydrophobicContact CD-CB 4.22Å; K389-E411 HydrophobicContact CD-CG 3.79Å; K389-E411 HydrophobicContact CG-CG 4.12Å; K389-E411 IonicContact NZ-OE2 3.05Å; I393-E411 HydrophobicContact CD1-CG 3.86Å; T407-E411 HydrophobicContact CG2-CG 4.17Å; T407-E411 WeakPolarHBondContact O-CG 3.46Å; T407-E411 PolarHBondContact O-N 2.85Å; E411-I413 VanDerWaalsContact C-N 3.35Å; E411-I413 PolarHBondContact O-N 2.98Å; E411-Y414 PolarHBondContact O-N 2.91Å; E411-D415 PolarHBondContact O-N 3.45Å
412	G	97.8	Very high	96.1	Very high	19 Å²	19	55 Å²	55	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-42.3	176.9	0	0	0	0	0	112.6	D408 L409 R416	D408-G412 PolarHBondContact O-N 3.01Å; L409-G412 PolarHBondContact O-N 2.98Å; G412-R416 WeakPolarHBondContact O-CG 3.27Å; G412-R416 VanDerWaalsContact O-CZ 3.31Å; G412-R416 PolarHBondContact O-N 3.16Å; G412-R416 VanDerWaalsContact O-N 3.12Å
413	I	98.2	Very high	96.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-50.4	172.6	-73.7	169.4	0	0	0	110.2	D313 L364 V368 F392 L409 E411 D415 R416 I417	D313-I413 HydrophobicContact CB-CG1 4.2Å; D313-I413 HydrophobicContact CB-CG2 4.16Å; L364-I413 HydrophobicContact CD1-CD1 4.34Å; L364-I413 HydrophobicContact CD2-CD1 4.07Å; L364-I413 HydrophobicContact CG-CD1 4.44Å; V368-I413 HydrophobicContact CG2-CG2 3.61Å; F392-I413 HydrophobicContact CE1-CB 4.39Å; F392-I413 HydrophobicContact CE1-CG2 3.93Å; F392-I413 HydrophobicContact CZ-CG2 3.94Å; L409-I413 HydrophobicContact CD1-CD1 4.2Å; L409-I413 HydrophobicContact CD1-CG1 4.46Å; L409-I413 HydrophobicContact CG-CD1 4.01Å; L409-I413 WeakPolarHBondContact O-CB 3.36Å; L409-I413 VanDerWaalsContact O-CG1 3.23Å; L409-I413 WeakPolarHBondContact O-CG1 3.47Å; L409-I413 PolarHBondContact O-N 3.31Å; E411-I413 VanDerWaalsContact C-N 3.35Å; E411-I413 PolarHBondContact O-N 2.98Å; I413-D415 PolarHBondContact O-N 3.44Å; I413-R416 PolarHBondContact O-N 2.76Å; I413-I417 HydrophobicContact CG2-CG1 4.42Å; I413-I417 VanDerWaalsContact O-CG1 3.28Å; I413-I417 WeakPolarHBondContact O-CG1 3.48Å; I413-I417 PolarHBondContact O-N 2.89Å
414	Y	98.4	Very high	95.9	Very high	34 Å²	34	49.6 Å²	49.6	13%	0.133	29%	0.285	C	S	.	.	H	α-helix	trans	-58.8	-48	-178.8	-179.1	-81.4	0	0	0	111.8	L371 L375 M387 K389 F392 L410 E411 R416 I417 A418	L371-Y414 HydrophobicContact CD1-CD2 3.78Å; L371-Y414 HydrophobicContact CD1-CE2 3.82Å; L371-Y414 HydrophobicContact CD2-CD2 3.83Å; L371-Y414 HydrophobicContact CD2-CG 4.4Å; L371-Y414 HydrophobicContact CG-CD2 4.43Å; L375-Y414 HydrophobicContact CD1-CE2 4.23Å; L375-Y414 HydrophobicContact CD2-CE2 4.44Å; M387-Y414 PolarHBondContact O-OH 2.91Å; K389-Y414 HydrophobicContact CB-CD1 3.79Å; K389-Y414 HydrophobicContact CB-CD2 4.33Å; K389-Y414 HydrophobicContact CB-CE1 3.84Å; K389-Y414 HydrophobicContact CB-CE2 4.34Å; K389-Y414 HydrophobicContact CB-CG 4.06Å; K389-Y414 HydrophobicContact CG-CD1 4.09Å; K389-Y414 HydrophobicContact CG-CG 4.18Å; K389-Y414 VanDerWaalsContact N-CZ 3.34Å; K389-Y414 PolarHBondContact N-OH 2.75Å; F392-Y414 HydrophobicContact CB-CD2 3.79Å; F392-Y414 HydrophobicContact CB-CE2 4.37Å; F392-Y414 HydrophobicContact CD1-CD2 4.37Å; F392-Y414 HydrophobicContact CG-CD2 4.19Å; L410-Y414 WeakPolarHBondContact O-CB 3.38Å; L410-Y414 PolarHBondContact O-N 2.99Å; E411-Y414 PolarHBondContact O-N 2.91Å; Y414-R416 PolarHBondContact O-N 2.73Å; Y414-I417 PolarHBondContact O-N 2.75Å; Y414-A418 HydrophobicContact CD1-CB 4.45Å; Y414-A418 HydrophobicContact CE1-CB 4.19Å; Y414-A418 VanDerWaalsContact O-CB 3.26Å; Y414-A418 WeakPolarHBondContact O-CB 3.4Å; Y414-A418 PolarHBondContact O-N 3.36Å
415	D	98.1	Very high	95.7	Very high	76 Å²	76	48.7 Å²	48.7	41%	0.406	28%	0.28	S	S	.	.	H	α-helix	trans	-63.7	-40.7	-176.9	-70.9	-21.9	0	0	0	111.7	K389 E411 I413 A418 A419	K389-D415 WeakPolarHBondContact CE-OD1 3.42Å; K389-D415 IonicContact NZ-OD1 3.51Å; K389-D415 PolarHBondContact NZ-OD1 3.49Å; K389-D415 IonicContact NZ-OD2 2.81Å; K389-D415 PolarHBondContact NZ-OD2 2.84Å; E411-D415 PolarHBondContact O-N 3.45Å; I413-D415 PolarHBondContact O-N 3.44Å; D415-A418 PolarHBondContact O-N 3.13Å; D415-A419 WeakPolarHBondContact O-CB 3.47Å; D415-A419 PolarHBondContact O-N 3.16Å
416	R	98	Very high	95.3	Very high	79 Å²	79	53.5 Å²	53.5	30%	0.298	31%	0.311	S	S	.	.	H	α-helix	trans	-69.1	-39	176.9	-72	-174	-58.8	-97.3	-2.3	113.2	E311 D313 R317 G412 I413 Y414 S420	E311-R416 IonicContact OE2-CZ 2.78Å; E311-R416 IonicContact OE2-NH1 3.94Å; E311-R416 PolarHBondContact OE2-NH1 3.49Å; E311-R416 IonicContact OE2-NH2 2.97Å; E311-R416 PolarHBondContact OE2-NH2 3.4Å; D313-R416 VanDerWaalsContact CG-NH2 3.27Å; D313-R416 IonicContact OD1-CZ 3.03Å; D313-R416 IonicContact OD1-NE 2.77Å; D313-R416 IonicContact OD1-NH2 3.95Å; D313-R416 PolarHBondContact OD1-NH2 3.45Å; D313-R416 IonicContact OD2-CZ 3.12Å; D313-R416 IonicContact OD2-NE 3.4Å; D313-R416 PolarHBondContact OD2-NE 3.5Å; D313-R416 IonicContact OD2-NH2 3.5Å; D313-R416 PolarHBondContact OD2-NH2 2.95Å; R317-R416 PolarHBondContact NH2-O 3.4Å; G412-R416 WeakPolarHBondContact O-CG 3.27Å; G412-R416 VanDerWaalsContact O-CZ 3.31Å; G412-R416 PolarHBondContact O-N 3.16Å; G412-R416 VanDerWaalsContact O-N 3.12Å; I413-R416 PolarHBondContact O-N 2.76Å; Y414-R416 PolarHBondContact O-N 2.73Å; R416-S420 PolarHBondContact O-N 3Å; R416-S420 VanDerWaalsContact O-N 3.13Å
417	I	96.8	Very high	94.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.2	-43.4	175.5	-62.6	-65.3	0	0	0	110.1	D313 V368 L371 H372 L375 H376 I413 Y414 A419 S420 F422	D313-I417 HydrophobicContact CB-CD1 4.29Å; V368-I417 HydrophobicContact CG1-CD1 3.74Å; V368-I417 HydrophobicContact CG1-CG1 4.07Å; L371-I417 HydrophobicContact CD2-CB 4.14Å; L371-I417 HydrophobicContact CD2-CG1 4.41Å; L371-I417 HydrophobicContact CD2-CG2 4.22Å; L371-I417 HydrophobicContact CG-CG2 4.18Å; H372-I417 HydrophobicContact CB-CG2 4.09Å; L375-I417 HydrophobicContact CD1-CG2 4.18Å; H376-I417 PolarHBondContact NE2-O 3.28Å; I413-I417 HydrophobicContact CG2-CG1 4.42Å; I413-I417 VanDerWaalsContact O-CG1 3.28Å; I413-I417 WeakPolarHBondContact O-CG1 3.48Å; I413-I417 PolarHBondContact O-N 2.89Å; Y414-I417 PolarHBondContact O-N 2.75Å; I417-A419 VanDerWaalsContact C-N 3.33Å; I417-A419 PolarHBondContact O-N 3.01Å; I417-S420 CarbonylContact O-C 3.48Å; I417-S420 PolarHBondContact O-N 3.32Å; I417-F422 HydrophobicContact CD1-CD1 4.36Å; I417-F422 HydrophobicContact CD1-CE1 3.44Å; I417-F422 VanDerWaalsContact CD1-CE1 3.44Å; I417-F422 HydrophobicContact CD1-CE2 4.19Å; I417-F422 HydrophobicContact CD1-CZ 3.35Å
418	A	95.9	Very high	94.5	Very high	44 Å²	44	49.2 Å²	49.2	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-39.6	176.6	0	0	0	0	0	112.4	L375 Y414 D415	L375-A418 HydrophobicContact CD1-CB 3.9Å; Y414-A418 HydrophobicContact CD1-CB 4.45Å; Y414-A418 HydrophobicContact CE1-CB 4.19Å; Y414-A418 VanDerWaalsContact O-CB 3.26Å; Y414-A418 WeakPolarHBondContact O-CB 3.4Å; Y414-A418 PolarHBondContact O-N 3.36Å; D415-A418 PolarHBondContact O-N 3.13Å
419	A	96.6	Very high	94.2	Very high	88 Å²	88	42.9 Å²	42.9	73%	0.727	25%	0.249	S	C	*	.	H	α-helix	trans	-69.2	-35.6	179.3	0	0	0	0	0	113.4	D415 I417	D415-A419 WeakPolarHBondContact O-CB 3.47Å; D415-A419 PolarHBondContact O-N 3.16Å; I417-A419 VanDerWaalsContact C-N 3.33Å; I417-A419 PolarHBondContact O-N 3.01Å
420	S	93.9	Very high	93.9	Very high	58 Å²	58	44.6 Å²	44.6	41%	0.406	26%	0.258	S	S	.	.	S	Bend	trans	-143.7	120.9	-178.7	-177	0	0	0	0	112.3	R317 R416 I417	R317-S420 PolarHBondContact NH1-O 3.22Å; R317-S420 PolarHBondContact NH1-OG 3.01Å; R317-S420 PolarHBondContact NH2-O 2.88Å; R416-S420 PolarHBondContact O-N 3Å; R416-S420 VanDerWaalsContact O-N 3.13Å; I417-S420 CarbonylContact O-C 3.48Å; I417-S420 PolarHBondContact O-N 3.32Å
421	E	93.1	Very high	93.6	Very high	46 Å²	46	48 Å²	48	22%	0.215	27%	0.273	C	S	.	.			trans	-59.1	157.8	168.2	73.4	-176	160.6	0	0	111.7	R317 H376 K423	R317-E421 PolarHBondContact NH1-O 3.31Å; H376-E421 HydrophobicContact CB-CB 4.04Å; H376-E421 VanDerWaalsContact CG-CB 3.48Å; H376-E421 WeakPolarHBondContact NE2-CA 3.29Å; H376-E421 PolarHBondContact NE2-N 3.47Å; E421-K423 VanDerWaalsContact CD-CE 3.49Å; E421-K423 HydrophobicContact CG-CD 4.38Å; E421-K423 HydrophobicContact CG-CG 3.95Å; E421-K423 WeakPolarHBondContact OE1-CE 3.37Å; E421-K423 IonicContact OE1-NZ 3.93Å; E421-K423 PolarHBondContact OE1-NZ 3.31Å
422	F	93.2	Very high	93.3	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.031	26%	0.258	C	S	.	.			trans	-74.1	132.8	170.1	-67.9	-33.6	0	0	0	109.1	I105 L316 R317 I320 V368 L369 H372 I417	I105-F422 HydrophobicContact CD1-CB 3.87Å; L316-F422 HydrophobicContact CD2-CE2 4.19Å; L316-F422 HydrophobicContact CD2-CZ 4.19Å; L316-F422 HydrophobicContact CG-CE2 4.46Å; L316-F422 HydrophobicContact CG-CZ 4.33Å; R317-F422 HydrophobicContact CB-CD1 3.96Å; R317-F422 HydrophobicContact CB-CE1 3.7Å; R317-F422 HydrophobicContact CG-CD1 3.92Å; R317-F422 HydrophobicContact CG-CE1 4.13Å; I320-F422 HydrophobicContact CD1-CD2 3.58Å; I320-F422 HydrophobicContact CD1-CE2 3.75Å; I320-F422 HydrophobicContact CD1-CG 4.19Å; I320-F422 HydrophobicContact CD1-CZ 4.5Å; I320-F422 HydrophobicContact CG2-CB 4.01Å; V368-F422 HydrophobicContact CG1-CE2 4.18Å; V368-F422 HydrophobicContact CG1-CZ 3.78Å; L369-F422 HydrophobicContact CD1-CD2 4.31Å; L369-F422 HydrophobicContact CD1-CE2 4.39Å; H372-F422 HydrophobicContact CB-CD2 3.95Å; H372-F422 HydrophobicContact CB-CE2 4.04Å; H372-F422 AromaticContact CD2-CD2 3.56Å; H372-F422 AromaticContact CD2-CG 3.64Å; H372-F422 PolarHBondContact CD2-N 3.01Å; H372-F422 AromaticContact CG-CD2 3.64Å; H372-F422 PolarHBondContact NE2-N 3.35Å; I417-F422 HydrophobicContact CD1-CD1 4.36Å; I417-F422 HydrophobicContact CD1-CE1 3.44Å; I417-F422 VanDerWaalsContact CD1-CE1 3.44Å; I417-F422 HydrophobicContact CD1-CE2 4.19Å; I417-F422 HydrophobicContact CD1-CZ 3.35Å
423	K	90.5	Very high	93	Very high	94 Å²	94	48.6 Å²	48.6	41%	0.409	27%	0.266	S	S	.	.			trans	-130.6	139.8	176.4	-61.8	-169	-176.6	-149.7	0	109	T101 E421	T101-K423 HydrophobicContact CG2-CD 4.43Å; T101-K423 PolarHBondContact OG1-NZ 3.13Å; E421-K423 VanDerWaalsContact CD-CE 3.49Å; E421-K423 HydrophobicContact CG-CD 4.38Å; E421-K423 HydrophobicContact CG-CG 3.95Å; E421-K423 WeakPolarHBondContact OE1-CE 3.37Å; E421-K423 IonicContact OE1-NZ 3.93Å; E421-K423 PolarHBondContact OE1-NZ 3.31Å
424	T	90.7	Very high	92.6	Very high	45 Å²	45	50.7 Å²	50.7	28%	0.276	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-71.1	151.4	163.4	56.4	0	0	0	0	108.9	I320 G321 H324	I320-T424 WeakPolarHBondContact O-CG2 3.48Å; G321-T424 CarbonylContact O-C 3.57Å; G321-T424 WeakPolarHBondContact O-CA 3.45Å; H324-T424 HydrophobicContact CB-CG2 4.13Å
425	L	90	Very high	92.3	Very high	78 Å²	78	49.1 Å²	49.1	41%	0.408	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-58.8	165.2	167	-71.3	168.6	0	0	0	110.3	R279 G321 D427	R279-L425 VanDerWaalsContact CD-O 3.27Å; R279-L425 WeakPolarHBondContact CD-O 3.39Å; R279-L425 PolarHBondContact NE-O 3.15Å; G321-L425 VanDerWaalsContact O-CB 3.32Å; G321-L425 WeakPolarHBondContact O-CB 3.12Å; G321-L425 VanDerWaalsContact O-CG 3.28Å; G321-L425 WeakPolarHBondContact O-CG 3.05Å; G321-L425 PolarHBondContact O-N 3.19Å; L425-D427 PolarHBondContact O-N 2.99Å
426	P	88.4	Confident	92	Very high	103 Å²	103	47.7 Å²	47.7	67%	0.669	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-54.4	140.7	179	-27	35.6	0	0	0	112.8	R279 D430	R279-P426 PolarHBondContact NE-O 3.09Å; R279-P426 PolarHBondContact NH2-O 3.37Å; P426-D430 VanDerWaalsContact CA-OD2 3.22Å; P426-D430 WeakPolarHBondContact CA-OD2 3.27Å
427	D	87	Confident	91.6	Very high	13 Å²	13	47 Å²	47	7%	0.07	29%	0.287	C	S	.	.			trans	-123.3	150.2	-177.1	-179.1	79.8	0	0	0	110.3	N278 R279 L425 S429 D430	N278-D427 VanDerWaalsContact CA-OD1 3.23Å; N278-D427 WeakPolarHBondContact CA-OD1 2.97Å; N278-D427 PolarHBondContact ND2-OD2 3.05Å; R279-D427 HydrophobicContact CG-CB 4.31Å; R279-D427 PolarHBondContact N-OD1 3.46Å; L425-D427 PolarHBondContact O-N 2.99Å; D427-S429 PolarHBondContact O-N 3.36Å; D427-S429 WeakPolarHBondContact OD2-CB 3.41Å; D427-S429 PolarHBondContact OD2-N 3.04Å; D427-S429 PolarHBondContact OD2-OG 3.33Å; D427-D430 PolarHBondContact N-OD2 3.33Å; D427-D430 VanDerWaalsContact O-CB 3.28Å; D427-D430 WeakPolarHBondContact O-CB 3.41Å; D427-D430 PolarHBondContact O-N 3.42Å
428	P	87.9	Confident	91.3	Very high	28 Å²	28	47.3 Å²	47.3	18%	0.182	29%	0.289	C	S	.	.	H	α-helix	trans	-51.5	-29.3	175.2	-30.5	37.5	0	0	0	114.5	P275 D430	P275-P428 VanDerWaalsContact O-CG 3.28Å; P275-P428 WeakPolarHBondContact O-CG 3.37Å; P428-D430 VanDerWaalsContact C-N 3.26Å; P428-D430 PolarHBondContact O-N 2.79Å
429	S	91.4	Very high	91.1	Very high	4 Å²	4	45.4 Å²	45.4	3%	0.028	27%	0.273	C	S	.	.	H	α-helix	trans	-70.6	-18.7	177.8	-44.3	0	0	0	0	113.5	N278 D427 K431 L432 R433	N278-S429 PolarHBondContact ND2-OG 2.81Å; D427-S429 PolarHBondContact O-N 3.36Å; D427-S429 WeakPolarHBondContact OD2-CB 3.41Å; D427-S429 PolarHBondContact OD2-N 3.04Å; D427-S429 PolarHBondContact OD2-OG 3.33Å; S429-K431 VanDerWaalsContact C-N 3.32Å; S429-K431 PolarHBondContact O-N 2.88Å; S429-L432 CarbonylContact O-C 3.53Å; S429-L432 WeakPolarHBondContact O-CA 3.26Å; S429-L432 WeakPolarHBondContact O-CB 3.49Å; S429-L432 PolarHBondContact O-N 2.89Å; S429-R433 PolarHBondContact O-N 3.34Å
430	D	90.6	Very high	90.9	Very high	52 Å²	52	44.7 Å²	44.7	28%	0.278	26%	0.256	S	S	.	.	H	α-helix	trans	-63.2	-41.7	179.6	-63.7	-23	0	0	0	110.7	P426 D427 P428 L432 R433 A434	P426-D430 VanDerWaalsContact CA-OD2 3.22Å; P426-D430 WeakPolarHBondContact CA-OD2 3.27Å; D427-D430 PolarHBondContact N-OD2 3.33Å; D427-D430 VanDerWaalsContact O-CB 3.28Å; D427-D430 WeakPolarHBondContact O-CB 3.41Å; D427-D430 PolarHBondContact O-N 3.42Å; P428-D430 VanDerWaalsContact C-N 3.26Å; P428-D430 PolarHBondContact O-N 2.79Å; D430-L432 VanDerWaalsContact C-N 3.26Å; D430-L432 PolarHBondContact O-N 3.34Å; D430-R433 PolarHBondContact O-N 3.17Å; D430-R433 IonicContact OD1-CZ 3.65Å; D430-R433 IonicContact OD1-NH1 3.02Å; D430-R433 PolarHBondContact OD1-NH1 3.41Å; D430-R433 IonicContact OD1-NH2 2.71Å; D430-R433 PolarHBondContact OD1-NH2 2.88Å; D430-A434 PolarHBondContact O-N 2.92Å
431	K	90.5	Very high	90.7	Very high	75 Å²	75	43.5 Å²	43.5	33%	0.326	25%	0.253	S	S	.	.	H	α-helix	trans	-60.7	-36.8	172.5	-70.3	-171.8	170.2	-168.2	0	111.4	S429 L435 F455 E555 P556	S429-K431 VanDerWaalsContact C-N 3.32Å; S429-K431 PolarHBondContact O-N 2.88Å; K431-L435 WeakPolarHBondContact O-CG 3.22Å; K431-L435 PolarHBondContact O-N 3.46Å; K431-L435 VanDerWaalsContact O-N 3.12Å; K431-F455 HydrophobicContact CB-CB 4.48Å; K431-F455 HydrophobicContact CD-CD1 4.49Å; K431-E555 WeakPolarHBondContact CE-OE2 2.9Å; K431-E555 VanDerWaalsContact NZ-CD 3.35Å; K431-E555 IonicContact NZ-OE1 2.77Å; K431-E555 PolarHBondContact NZ-OE1 3.32Å; K431-E555 IonicContact NZ-OE2 3.15Å; K431-E555 PolarHBondContact NZ-OE2 3.14Å; K431-E555 VanDerWaalsContact NZ-OE2 3.15Å; K431-P556 HydrophobicContact CG-CG 4.44Å
432	L	93.1	Very high	90.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-42.3	176.1	-57	-174	0	0	0	112.3	S429 D430 A434 L435 D436 V449 R453 F455 F486	S429-L432 CarbonylContact O-C 3.53Å; S429-L432 WeakPolarHBondContact O-CA 3.26Å; S429-L432 WeakPolarHBondContact O-CB 3.49Å; S429-L432 PolarHBondContact O-N 2.89Å; D430-L432 VanDerWaalsContact C-N 3.26Å; D430-L432 PolarHBondContact O-N 3.34Å; L432-A434 VanDerWaalsContact C-N 3.32Å; L432-A434 PolarHBondContact O-N 3.42Å; L432-L435 PolarHBondContact O-N 3.17Å; L432-D436 WeakPolarHBondContact O-CB 3.09Å; L432-D436 PolarHBondContact O-N 2.82Å; L432-V449 HydrophobicContact CB-CG1 4.17Å; L432-V449 HydrophobicContact CB-CG2 4.16Å; L432-V449 HydrophobicContact CD1-CG1 4.44Å; L432-R453 HydrophobicContact CD1-CB 3.83Å; L432-R453 HydrophobicContact CD1-CG 4Å; L432-R453 WeakPolarHBondContact CD1-O 3.38Å; L432-R453 HydrophobicContact CD2-CG 4.13Å; L432-F455 HydrophobicContact CD2-CB 4.25Å; L432-F486 HydrophobicContact CD2-CD1 3.77Å; L432-F486 HydrophobicContact CD2-CE1 3.46Å; L432-F486 VanDerWaalsContact CD2-CE1 3.46Å
433	R	91.1	Very high	90.4	Very high	96 Å²	96	51.1 Å²	51.1	36%	0.362	30%	0.302	S	S	.	.	H	α-helix	trans	-64.1	-38.3	177.3	-67.6	-171	-139.5	108	10.6	111.5	S429 D430 D436 G437 V449	S429-R433 PolarHBondContact O-N 3.34Å; D430-R433 PolarHBondContact O-N 3.17Å; D430-R433 IonicContact OD1-CZ 3.65Å; D430-R433 IonicContact OD1-NH1 3.02Å; D430-R433 PolarHBondContact OD1-NH1 3.41Å; D430-R433 IonicContact OD1-NH2 2.71Å; D430-R433 PolarHBondContact OD1-NH2 2.88Å; R433-D436 PolarHBondContact O-N 2.91Å; R433-G437 PolarHBondContact O-N 3.24Å; R433-V449 HydrophobicContact CG-CG1 4.07Å; R433-V449 HydrophobicContact CG-CG2 4.23Å
434	A	89.4	Confident	90.3	Very high	45 Å²	45	49 Å²	49	37%	0.372	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-44.5	173.1	0	0	0	0	0	111.8	D430 L432	D430-A434 PolarHBondContact O-N 2.92Å; L432-A434 VanDerWaalsContact C-N 3.32Å; L432-A434 PolarHBondContact O-N 3.42Å
435	L	91.7	Very high	89.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-40.6	174.5	-73.4	170.6	0	0	0	112.1	K431 L432 G437 V438 L439 F448 F455 L484 F486 P556 F557	K431-L435 WeakPolarHBondContact O-CG 3.22Å; K431-L435 PolarHBondContact O-N 3.46Å; K431-L435 VanDerWaalsContact O-N 3.12Å; L432-L435 PolarHBondContact O-N 3.17Å; L435-G437 PolarHBondContact O-N 3.25Å; L435-V438 HydrophobicContact CD2-CG2 4.5Å; L435-V438 WeakPolarHBondContact O-CG2 3.42Å; L435-V438 PolarHBondContact O-N 3.22Å; L435-V438 VanDerWaalsContact O-N 3.08Å; L435-L439 HydrophobicContact CB-CD1 4.34Å; L435-L439 WeakPolarHBondContact O-CB 2.95Å; L435-L439 WeakPolarHBondContact O-CG 3.37Å; L435-L439 PolarHBondContact O-N 2.91Å; L435-F448 HydrophobicContact CB-CE1 4Å; L435-F448 HydrophobicContact CB-CZ 4.3Å; L435-F455 HydrophobicContact CD1-CB 4.48Å; L435-F455 HydrophobicContact CD1-CD2 3.54Å; L435-F455 HydrophobicContact CD1-CE2 3.82Å; L435-F455 HydrophobicContact CD1-CG 3.99Å; L435-F455 HydrophobicContact CD1-CZ 4.49Å; L435-L484 HydrophobicContact CD2-CD1 4.28Å; L435-F486 HydrophobicContact CD1-CE1 3.99Å; L435-F486 HydrophobicContact CD1-CZ 3.91Å; L435-P556 HydrophobicContact CD1-CB 4.17Å; L435-P556 HydrophobicContact CD2-CB 3.65Å; L435-P556 HydrophobicContact CG-CB 3.7Å; L435-F557 HydrophobicContact CD2-CD2 3.81Å; L435-F557 HydrophobicContact CD2-CE2 4.45Å
436	D	91.9	Very high	89.4	Confident	47 Å²	47	54 Å²	54	25%	0.251	32%	0.32	S	S	.	.	H	α-helix	trans	-56.9	-39.5	-179.6	-164.5	72	0	0	0	111.9	L432 R433 V438 K444 F448 V449	L432-D436 WeakPolarHBondContact O-CB 3.09Å; L432-D436 PolarHBondContact O-N 2.82Å; R433-D436 PolarHBondContact O-N 2.91Å; D436-V438 VanDerWaalsContact C-N 3.32Å; D436-V438 PolarHBondContact O-N 3.24Å; D436-K444 PolarHBondContact O-NZ 3.38Å; D436-K444 WeakPolarHBondContact OD1-CE 3.36Å; D436-K444 IonicContact OD1-NZ 3.05Å; D436-K444 PolarHBondContact OD1-NZ 3.16Å; D436-K444 IonicContact OD2-NZ 3.54Å; D436-K444 PolarHBondContact OD2-NZ 3.01Å; D436-F448 HydrophobicContact CB-CD1 3.98Å; D436-F448 HydrophobicContact CB-CE1 4.45Å; D436-F448 WeakPolarHBondContact OD1-CB 3.39Å; D436-F448 WeakPolarHBondContact OD1-CD1 3.44Å; D436-V449 HydrophobicContact CB-CG2 3.86Å
437	G	89.1	Confident	89.3	Confident	64 Å²	64	54.8 Å²	54.8	66%	0.66	32%	0.319	S	S	*	.	H	α-helix	trans	-67.3	-24.8	178.4	0	0	0	0	0	115.1	R433 L435	R433-G437 PolarHBondContact O-N 3.24Å; L435-G437 PolarHBondContact O-N 3.25Å
438	V	90.8	Very high	89.4	Confident	7 Å²	7	54.4 Å²	54.4	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-100.7	-18.7	-179.5	-61.2	0	0	0	0	113.5	L435 D436 F557 T562 F563	L435-V438 HydrophobicContact CD2-CG2 4.5Å; L435-V438 WeakPolarHBondContact O-CG2 3.42Å; L435-V438 PolarHBondContact O-N 3.22Å; L435-V438 VanDerWaalsContact O-N 3.08Å; D436-V438 VanDerWaalsContact C-N 3.32Å; D436-V438 PolarHBondContact O-N 3.24Å; V438-F557 HydrophobicContact CG2-CB 4.45Å; V438-F557 HydrophobicContact CG2-CD2 4.24Å; V438-T562 WeakPolarHBondContact O-CA 3.18Å; V438-F563 HydrophobicContact CB-CD2 4.43Å; V438-F563 HydrophobicContact CG2-CD2 4.36Å; V438-F563 PolarHBondContact O-N 3.38Å
439	L	92.6	Very high	89.7	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.1	179.3	-67.7	178.4	0	0	0	111.2	L435 K444 F448 L484 V493 F563 V565	L435-L439 HydrophobicContact CB-CD1 4.34Å; L435-L439 WeakPolarHBondContact O-CB 2.95Å; L435-L439 WeakPolarHBondContact O-CG 3.37Å; L435-L439 PolarHBondContact O-N 2.91Å; L439-K444 HydrophobicContact CB-CD 4.19Å; L439-K444 VanDerWaalsContact O-CD 3.3Å; L439-K444 WeakPolarHBondContact O-CD 3.31Å; L439-F448 HydrophobicContact CD1-CE1 4.01Å; L439-F448 HydrophobicContact CD1-CE2 3.91Å; L439-F448 HydrophobicContact CD1-CZ 3.58Å; L439-L484 HydrophobicContact CD1-CD1 4.14Å; L439-L484 HydrophobicContact CD2-CD1 3.97Å; L439-V493 HydrophobicContact CD2-CB 4.44Å; L439-V493 HydrophobicContact CD2-CG1 3.68Å; L439-F563 WeakPolarHBondContact CA-O 3.45Å; L439-F563 HydrophobicContact CD2-CB 4.02Å; L439-V565 HydrophobicContact CB-CG2 4.26Å; L439-V565 HydrophobicContact CD2-CG2 4.24Å
440	I	92.6	Very high	89.8	Confident	73 Å²	73	58 Å²	58	37%	0.374	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	165.7	177.8	71.6	170.2	0	0	0	112.2	L496 F563 Q564 V565	I440-L496 HydrophobicContact CD1-CD1 3.39Å; I440-L496 HydrophobicContact CG1-CD1 4.01Å; I440-F563 PolarHBondContact N-O 3.08Å; I440-Q564 CarbonylContact O-C 3.38Å; I440-Q564 WeakPolarHBondContact O-CA 3.45Å; I440-V565 PolarHBondContact O-N 2.85Å
441	G	89.5	Confident	89.9	Confident	33 Å²	33	58.3 Å²	58.3	34%	0.34	33%	0.331	S	S	.	.	S	Bend	trans	113.5	164.6	172.3	0	0	0	0	0	113.6	L443 K444	G441-L443 PolarHBondContact O-N 3.03Å; G441-L443 VanDerWaalsContact O-N 3.16Å; G441-K444 WeakPolarHBondContact O-CB 3.31Å; G441-K444 PolarHBondContact O-N 2.89Å; G441-K444 VanDerWaalsContact O-N 3.1Å
442	P	89.5	Confident	90.1	Very high	124 Å²	124	55.9 Å²	55.9	81%	0.805	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-16	-170.7	28.7	-36.5	0	0	0	113.9
443	L	89.8	Confident	90.3	Very high	88 Å²	88	56.5 Å²	56.5	46%	0.461	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-4.3	178.3	-63.5	175.8	0	0	0	112.9	G441 T445 V565 R566	G441-L443 PolarHBondContact O-N 3.03Å; G441-L443 VanDerWaalsContact O-N 3.16Å; L443-T445 PolarHBondContact O-N 2.71Å; L443-V565 HydrophobicContact CB-CB 4.29Å; L443-V565 HydrophobicContact CB-CG1 3.81Å; L443-R566 VanDerWaalsContact CD1-C 3.48Å; L443-R566 WeakPolarHBondContact CD1-O 3.23Å
444	K	88.7	Confident	90.5	Very high	51 Å²	51	53.8 Å²	53.8	22%	0.222	31%	0.313	C	S	.	.	S	Bend	trans	-68.6	120.6	169.7	-179.4	-178.2	170.8	-172.4	0	107.5	D436 L439 G441 V565	D436-K444 PolarHBondContact O-NZ 3.38Å; D436-K444 WeakPolarHBondContact OD1-CE 3.36Å; D436-K444 IonicContact OD1-NZ 3.05Å; D436-K444 PolarHBondContact OD1-NZ 3.16Å; D436-K444 IonicContact OD2-NZ 3.54Å; D436-K444 PolarHBondContact OD2-NZ 3.01Å; L439-K444 HydrophobicContact CB-CD 4.19Å; L439-K444 VanDerWaalsContact O-CD 3.3Å; L439-K444 WeakPolarHBondContact O-CD 3.31Å; G441-K444 WeakPolarHBondContact O-CB 3.31Å; G441-K444 PolarHBondContact O-N 2.89Å; G441-K444 VanDerWaalsContact O-N 3.1Å; K444-V565 HydrophobicContact CB-CG2 4.11Å
445	T	82.7	Confident	90.8	Very high	61 Å²	61	52.3 Å²	52.3	37%	0.374	30%	0.298	S	S	.	.			trans	-67.9	134	175.9	56.1	0	0	0	0	110	L443 N447 F448	L443-T445 PolarHBondContact O-N 2.71Å; T445-N447 PolarHBondContact O-N 2.6Å; T445-F448 WeakPolarHBondContact O-CB 3.42Å; T445-F448 PolarHBondContact O-N 2.81Å; T445-F448 WeakPolarHBondContact OG1-CA 3.36Å; T445-F448 PolarHBondContact OG1-N 3.08Å
446	D	79.3	Confident	90.9	Very high	165 Å²	165	54 Å²	54	88%	0.882	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-36.7	176	-62.6	-34.3	0	0	0	111.9	F448	D446-F448 VanDerWaalsContact C-N 3.34Å; D446-F448 PolarHBondContact O-N 3.28Å
447	N	85.6	Confident	91.1	Very high	120 Å²	120	51.7 Å²	51.7	64%	0.642	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	49.2	175.7	-64.1	-30.9	0	0	0	111.7	T445 Q450	T445-N447 PolarHBondContact O-N 2.6Å; N447-Q450 WeakPolarHBondContact O-CG 3.23Å; N447-Q450 PolarHBondContact O-NE2 3.47Å
448	F	90.7	Very high	91.4	Very high	6 Å²	6	51.1 Å²	51.1	3%	0.026	27%	0.273	C	S	.	.			trans	-66.2	-42.6	179	176.2	-102.1	0	0	0	112.2	L435 D436 L439 T445 D446 Q450 R453 F486 V491	L435-F448 HydrophobicContact CB-CE1 4Å; L435-F448 HydrophobicContact CB-CZ 4.3Å; D436-F448 HydrophobicContact CB-CD1 3.98Å; D436-F448 HydrophobicContact CB-CE1 4.45Å; D436-F448 WeakPolarHBondContact OD1-CB 3.39Å; D436-F448 WeakPolarHBondContact OD1-CD1 3.44Å; L439-F448 HydrophobicContact CD1-CE1 4.01Å; L439-F448 HydrophobicContact CD1-CE2 3.91Å; L439-F448 HydrophobicContact CD1-CZ 3.58Å; T445-F448 WeakPolarHBondContact O-CB 3.42Å; T445-F448 PolarHBondContact O-N 2.81Å; T445-F448 WeakPolarHBondContact OG1-CA 3.36Å; T445-F448 PolarHBondContact OG1-N 3.08Å; D446-F448 VanDerWaalsContact C-N 3.34Å; D446-F448 PolarHBondContact O-N 3.28Å; F448-Q450 PolarHBondContact O-N 2.96Å; F448-R453 PolarHBondContact O-NH1 3Å; F448-F486 HydrophobicContact CE2-CE2 4.27Å; F448-F486 AromaticContact CE2-CZ 3.95Å; F448-F486 HydrophobicContact CE2-CZ 3.95Å; F448-F486 AromaticContact CZ-CE1 3.94Å; F448-F486 HydrophobicContact CZ-CE1 3.94Å; F448-F486 HydrophobicContact CZ-CE2 4.27Å; F448-F486 AromaticContact CZ-CZ 3.52Å; F448-F486 HydrophobicContact CZ-CZ 3.52Å; F448-V491 HydrophobicContact CE2-CG2 4.41Å
449	V	92.6	Very high	91.6	Very high	53 Å²	53	50.9 Å²	50.9	32%	0.321	27%	0.271	S	S	.	.			trans	-81.7	102	176.9	-176.3	0	0	0	0	108.9	L432 R433 D436	L432-V449 HydrophobicContact CB-CG1 4.17Å; L432-V449 HydrophobicContact CB-CG2 4.16Å; L432-V449 HydrophobicContact CD1-CG1 4.44Å; R433-V449 HydrophobicContact CG-CG1 4.07Å; R433-V449 HydrophobicContact CG-CG2 4.23Å; D436-V449 HydrophobicContact CB-CG2 3.86Å
450	Q	93.6	Very high	91.6	Very high	55 Å²	55	52 Å²	52	26%	0.257	28%	0.277	S	S	.	.			trans	-118.3	139.8	177	-56.2	-173	-2.5	0	0	109.3	N447 F448 H452 R453	N447-Q450 WeakPolarHBondContact O-CG 3.23Å; N447-Q450 PolarHBondContact O-NE2 3.47Å; F448-Q450 PolarHBondContact O-N 2.96Å; Q450-H452 PolarHBondContact O-N 2.91Å; Q450-H452 VanDerWaalsContact O-N 3.08Å; Q450-H452 PolarHBondContact OE1-CE1 3.36Å; Q450-H452 PolarHBondContact OE1-NE2 3.19Å; Q450-R453 HydrophobicContact CB-CB 4.1Å; Q450-R453 PolarHBondContact O-N 2.97Å
451	R	93.9	Very high	91.6	Very high	58 Å²	58	48.6 Å²	48.6	22%	0.219	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-31.7	-176.9	-65.1	-169.3	-67.6	159	-10	113.9	N244 N278 E284	N244-R451 WeakPolarHBondContact CB-O 3.35Å; N244-R451 PolarHBondContact ND2-O 3.43Å; N244-R451 WeakPolarHBondContact O-CB 3.45Å; N278-R451 HydrophobicContact CB-CB 4.29Å; E284-R451 IonicContact OE1-CZ 2.97Å; E284-R451 VanDerWaalsContact OE1-CZ 3.23Å; E284-R451 IonicContact OE1-NH1 2.74Å; E284-R451 PolarHBondContact OE1-NH1 3.4Å; E284-R451 IonicContact OE1-NH2 2.9Å; E284-R451 PolarHBondContact OE1-NH2 3.43Å; E284-R451 IonicContact OE2-CZ 3.92Å; E284-R451 IonicContact OE2-NH1 3.36Å; E284-R451 PolarHBondContact OE2-NH1 3.39Å; E284-R451 IonicContact OE2-NH2 2.95Å; E284-R451 PolarHBondContact OE2-NH2 3.33Å
452	H	94.8	Very high	91.7	Very high	24 Å²	24	48.5 Å²	48.5	11%	0.111	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-2.3	-177	68.8	-93.7	0	0	0	114.1	T241 N244 R245 Q450 N487	T241-H452 HydrophobicContact CG2-CB 4.12Å; N244-H452 HydrophobicContact CB-CB 3.8Å; R245-H452 HydrophobicContact CG-CB 3.59Å; R245-H452 PolarHBondContact NE-CD2 2.85Å; R245-H452 PolarHBondContact NE-CE1 3.23Å; R245-H452 PolarHBondContact NE-NE2 3.33Å; R245-H452 VanDerWaalsContact NE-NE2 3.18Å; R245-H452 PolarHBondContact NH2-CD2 3.17Å; R245-H452 VanDerWaalsContact NH2-CD2 3.31Å; R245-H452 PolarHBondContact NH2-NE2 3.5Å; Q450-H452 PolarHBondContact O-N 2.91Å; Q450-H452 VanDerWaalsContact O-N 3.08Å; Q450-H452 PolarHBondContact OE1-CE1 3.36Å; Q450-H452 PolarHBondContact OE1-NE2 3.19Å; H452-N487 PolarHBondContact O-ND2 3.25Å
453	R	96	Very high	91.9	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.045	22%	0.224	C	C	.	.			trans	-85.8	135.4	175.6	179.8	167.9	-66.7	152.2	2.9	108.8	L432 F448 Q450 F486 N487 D488	L432-R453 HydrophobicContact CD1-CB 3.83Å; L432-R453 HydrophobicContact CD1-CG 4Å; L432-R453 WeakPolarHBondContact CD1-O 3.38Å; L432-R453 HydrophobicContact CD2-CG 4.13Å; F448-R453 PolarHBondContact O-NH1 3Å; Q450-R453 HydrophobicContact CB-CB 4.1Å; Q450-R453 PolarHBondContact O-N 2.97Å; R453-F486 HydrophobicContact CG-CB 4.06Å; R453-F486 HydrophobicContact CG-CD1 3.71Å; R453-F486 HydrophobicContact CG-CG 4.1Å; R453-N487 WeakPolarHBondContact CA-OD1 3.49Å; R453-D488 WeakPolarHBondContact CG-OD1 3.49Å; R453-D488 IonicContact CZ-OD1 2.76Å; R453-D488 IonicContact CZ-OD2 3.94Å; R453-D488 IonicContact NE-OD1 2.89Å; R453-D488 PolarHBondContact NE-OD1 3.25Å; R453-D488 IonicContact NE-OD2 3.57Å; R453-D488 PolarHBondContact NE-OD2 2.79Å; R453-D488 VanDerWaalsContact NE-OD2 3.12Å; R453-D488 IonicContact NH2-OD1 2.99Å; R453-D488 IonicContact NH2-OD2 2.91Å; R453-D488 PolarHBondContact NH2-OD2 2.96Å
454	R	94.9	Very high	91.9	Very high	39 Å²	39	41.4 Å²	41.4	15%	0.147	20%	0.204	C	C	.	.			trans	-128	130.4	178.3	-179.5	177.5	63.3	-124.3	-11.4	109.3	N276 F486 N487 E621	N276-R454 WeakPolarHBondContact OD1-CD 3.29Å; N276-R454 PolarHBondContact OD1-NH1 2.86Å; R454-F486 CarbonylContact O-C 3.25Å; R454-F486 WeakPolarHBondContact O-CA 3.39Å; R454-F486 WeakPolarHBondContact O-CB 3.44Å; R454-N487 PolarHBondContact N-OD1 3.02Å; R454-N487 PolarHBondContact O-N 3.23Å; R454-N487 VanDerWaalsContact O-N 3.1Å; R454-E621 IonicContact CZ-OE2 3.15Å; R454-E621 IonicContact NH2-OE2 3.97Å; R454-E621 PolarHBondContact NH2-OE2 3.49Å
455	F	95.7	Very high	91.8	Very high	15 Å²	15	45.9 Å²	45.9	7%	0.066	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	126.1	171.3	-178.4	-110.2	0	0	0	110	K431 L432 L435 G457 R458 L484 F486 T554 P556	K431-F455 HydrophobicContact CB-CB 4.48Å; K431-F455 HydrophobicContact CD-CD1 4.49Å; L432-F455 HydrophobicContact CD2-CB 4.25Å; L435-F455 HydrophobicContact CD1-CB 4.48Å; L435-F455 HydrophobicContact CD1-CD2 3.54Å; L435-F455 HydrophobicContact CD1-CE2 3.82Å; L435-F455 HydrophobicContact CD1-CG 3.99Å; L435-F455 HydrophobicContact CD1-CZ 4.49Å; F455-G457 VanDerWaalsContact CE2-O 3.27Å; F455-G457 WeakPolarHBondContact CE2-O 3.46Å; F455-G457 WeakPolarHBondContact CZ-O 3.41Å; F455-R458 HydrophobicContact CZ-CB 4.03Å; F455-R458 HydrophobicContact CZ-CG 4.35Å; F455-L484 HydrophobicContact CE2-CB 4.28Å; F455-L484 HydrophobicContact CE2-CD2 4.13Å; F455-F486 HydrophobicContact CB-CD1 4.19Å; F455-F486 HydrophobicContact CB-CE1 4.05Å; F455-F486 HydrophobicContact CD2-CD1 4.19Å; F455-F486 AromaticContact CD2-CE1 3.67Å; F455-F486 HydrophobicContact CD2-CE1 3.67Å; F455-F486 AromaticContact CD2-CZ 3.93Å; F455-F486 HydrophobicContact CD2-CZ 3.93Å; F455-F486 HydrophobicContact CG-CE1 4.35Å; F455-T554 WeakPolarHBondContact CE1-O 3.44Å; F455-P556 HydrophobicContact CE1-CB 4.35Å
456	I	95.6	Very high	91.9	Very high	34 Å²	34	49.3 Å²	49.3	17%	0.174	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-44.6	179.2	-63.5	178.6	0	0	0	110.2	I485 N487 W614 S618	I456-I485 HydrophobicContact CB-CB 4.41Å; I456-I485 HydrophobicContact CB-CG2 4.2Å; I456-I485 WeakPolarHBondContact CB-O 3.01Å; I456-I485 HydrophobicContact CD1-CG2 4.27Å; I456-I485 PolarHBondContact N-O 2.95Å; I456-N487 HydrophobicContact CD1-CB 4.39Å; I456-W614 HydrophobicContact CG2-CB 3.92Å; I456-W614 VanDerWaalsContact CG2-CD1 3.41Å; I456-W614 HydrophobicContact CG2-CD2 3.89Å; I456-W614 HydrophobicContact CG2-CG 3.48Å; I456-W614 VanDerWaalsContact CG2-CG 3.48Å; I456-S618 WeakPolarHBondContact CD1-OG 3.42Å
457	G	95.1	Very high	92.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.4	179.3	178.8	0	0	0	0	0	113.7	F455 I485 S553	F455-G457 VanDerWaalsContact CE2-O 3.27Å; F455-G457 WeakPolarHBondContact CE2-O 3.46Å; F455-G457 WeakPolarHBondContact CZ-O 3.41Å; G457-I485 PolarHBondContact N-O 3.19Å; G457-I485 WeakPolarHBondContact O-CD1 3.37Å; G457-I485 PolarHBondContact O-N 3.25Å; G457-S553 CarbonylContact C-O 3.55Å; G457-S553 VanDerWaalsContact CA-O 3.27Å; G457-S553 WeakPolarHBondContact CA-O 3.34Å
458	R	94.9	Very high	92.1	Very high	52 Å²	52	42 Å²	42	20%	0.196	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.9	177.2	62.8	-179.8	176.8	124	3.9	112.3	F455 L483 L484 C552 S553 E555 F557	F455-R458 HydrophobicContact CZ-CB 4.03Å; F455-R458 HydrophobicContact CZ-CG 4.35Å; R458-L483 CarbonylContact C-O 3.52Å; R458-L483 WeakPolarHBondContact CA-O 3.41Å; R458-L484 HydrophobicContact CB-CD2 3.62Å; R458-C552 WeakPolarHBondContact O-CA 3.47Å; R458-S553 PolarHBondContact N-O 3.14Å; R458-S553 PolarHBondContact O-N 3.28Å; R458-E555 WeakPolarHBondContact CD-O 3.27Å; R458-E555 PolarHBondContact NE-O 2.81Å; R458-F557 VanDerWaalsContact NH1-CE1 3.34Å
459	I	94.6	Very high	91.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132	178.2	-58.2	-173.4	0	0	0	110.4	H482 L483 I485 F551 C552 M602 F611 W614	I459-H482 CarbonylContact O-C 3.57Å; I459-H482 WeakPolarHBondContact O-CA 3.32Å; I459-L483 PolarHBondContact N-O 2.96Å; I459-L483 PolarHBondContact O-N 2.92Å; I459-I485 HydrophobicContact CD1-CD1 4.46Å; I459-I485 HydrophobicContact CG1-CD1 4.17Å; I459-F551 CarbonylContact C-O 3.54Å; I459-F551 VanDerWaalsContact CA-O 3.28Å; I459-F551 WeakPolarHBondContact CA-O 3.48Å; I459-C552 HydrophobicContact CG1-CB 4.39Å; I459-M602 HydrophobicContact CG2-SD 3.99Å; I459-F611 HydrophobicContact CD1-CB 3.49Å; I459-F611 VanDerWaalsContact CD1-CB 3.49Å; I459-F611 HydrophobicContact CD1-CD2 4.04Å; I459-F611 HydrophobicContact CD1-CG 4.25Å; I459-W614 HydrophobicContact CD1-CE3 3.76Å; I459-W614 HydrophobicContact CD1-CZ3 3.64Å; I459-W614 HydrophobicContact CG1-CE3 4.06Å; I459-W614 HydrophobicContact CG1-CH2 4.5Å; I459-W614 HydrophobicContact CG1-CZ3 3.51Å
460	L	93.7	Very high	90.8	Very high	29 Å²	29	51.9 Å²	51.9	15%	0.152	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.8	170.4	178.1	60.4	0	0	0	109.5	W480 R481 F551 P603	L460-W480 HydrophobicContact CD1-CB 4.21Å; L460-W480 HydrophobicContact CD1-CE3 3.76Å; L460-W480 HydrophobicContact CD2-CE3 4.13Å; L460-W480 HydrophobicContact CD2-CZ3 4.3Å; L460-W480 HydrophobicContact CG-CE3 3.61Å; L460-W480 HydrophobicContact CG-CZ3 3.93Å; L460-R481 WeakPolarHBondContact CD1-O 3.28Å; L460-F551 HydrophobicContact CB-CD1 4.21Å; L460-F551 HydrophobicContact CD2-CD1 4.03Å; L460-F551 HydrophobicContact CD2-CE1 4.15Å; L460-F551 HydrophobicContact CG-CD1 4.29Å; L460-F551 PolarHBondContact N-O 3.02Å; L460-P603 WeakPolarHBondContact O-CD 3.23Å
461	T	93.1	Very high	89.9	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	167.9	-173.6	-167.9	0	0	0	0	111.6	W480 R481 L483 L600 N601 M602	T461-W480 CarbonylContact O-C 3.51Å; T461-W480 WeakPolarHBondContact O-CA 3.43Å; T461-R481 HydrophobicContact CG2-CB 4.39Å; T461-R481 PolarHBondContact N-O 2.95Å; T461-R481 PolarHBondContact O-N 2.95Å; T461-L483 HydrophobicContact CG2-CD1 3.78Å; T461-L483 HydrophobicContact CG2-CD2 3.76Å; T461-L483 HydrophobicContact CG2-CG 3.56Å; T461-L600 HydrophobicContact CG2-CD2 3.76Å; T461-N601 PolarHBondContact OG1-O 3.36Å; T461-M602 PolarHBondContact OG1-SD 3.25Å; T461-M602 VanDerWaalsContact OG1-SD 3.41Å
462	Q	91.8	Very high	88.6	Confident	31 Å²	31	61.3 Å²	61.3	15%	0.145	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.4	170.6	-172.9	-178.2	22	0	0	110.5	R479 L600 N601	Q462-R479 HydrophobicContact CG-CB 3.71Å; Q462-L600 CarbonylContact O-C 3.54Å; Q462-L600 WeakPolarHBondContact O-CA 3.48Å; Q462-N601 HydrophobicContact CB-CB 4.31Å; Q462-N601 PolarHBondContact N-O 3.26Å; Q462-N601 PolarHBondContact O-N 3.17Å
463	E	92.7	Very high	87.1	Confident	57 Å²	57	61.8 Å²	61.8	27%	0.266	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.7	172.8	-170.6	-177.9	179.3	0	0	110.5	R479 R481 I598	E463-R479 PolarHBondContact N-O 3.41Å; E463-R481 HydrophobicContact CB-CG 3.93Å; E463-R481 IonicContact OE2-CZ 2.91Å; E463-R481 IonicContact OE2-NE 3.66Å; E463-R481 PolarHBondContact OE2-NE 2.7Å; E463-R481 IonicContact OE2-NH2 2.84Å; E463-R481 PolarHBondContact OE2-NH2 3.33Å; E463-I598 HydrophobicContact CG-CD1 4.45Å
464	I	90.6	Very high	85.6	Confident	7 Å²	7	63.6 Å²	63.6	4%	0.036	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.1	-178.2	-54.3	167.2	0	0	0	109.3	K466 F579 Y584 S599 L600 N601	I464-K466 WeakPolarHBondContact CG2-O 3.17Å; I464-F579 HydrophobicContact CD1-CE2 4.37Å; I464-F579 HydrophobicContact CD1-CZ 3.71Å; I464-Y584 HydrophobicContact CD1-CD1 3.91Å; I464-Y584 HydrophobicContact CD1-CD2 3.87Å; I464-Y584 HydrophobicContact CD1-CE1 4.18Å; I464-Y584 HydrophobicContact CD1-CE2 4.15Å; I464-Y584 HydrophobicContact CD1-CG 3.74Å; I464-Y584 HydrophobicContact CG1-CD1 4.16Å; I464-Y584 HydrophobicContact CG1-CD2 4.5Å; I464-Y584 HydrophobicContact CG1-CE1 3.95Å; I464-Y584 HydrophobicContact CG1-CE2 4.31Å; I464-Y584 HydrophobicContact CG1-CG 4.42Å; I464-Y584 HydrophobicContact CG2-CD2 4.22Å; I464-Y584 HydrophobicContact CG2-CE1 4.45Å; I464-Y584 HydrophobicContact CG2-CE2 3.54Å; I464-S599 PolarHBondContact N-O 3.16Å; I464-S599 WeakPolarHBondContact O-CB 3.46Å; I464-L600 WeakPolarHBondContact CD1-O 3.47Å; I464-N601 HydrophobicContact CD1-CB 3.77Å; I464-N601 HydrophobicContact CG1-CB 4.03Å
465	E	86.2	Confident	84	Confident	145 Å²	145	73.7 Å²	73.7	68%	0.678	35%	0.352	S	S	*	.	S	Bend	trans	-85	-40.6	174.5	-169.5	-172.3	162.4	0	0	112.4	R479	E465-R479 IonicContact OE2-NH2 3.33Å
466	K	85.3	Confident	82.4	Confident	132 Å²	132	78.5 Å²	78.5	57%	0.574	38%	0.379	S	S	*	.			trans	-137.7	132.7	179.4	-62.8	-175.3	-178.2	-178.4	0	110.3	I464 A468 Y584	I464-K466 WeakPolarHBondContact CG2-O 3.17Å; K466-A468 VanDerWaalsContact C-N 3.31Å; K466-A468 PolarHBondContact O-N 2.94Å; K466-Y584 WeakPolarHBondContact O-CE2 3.43Å
467	I	84	Confident	81	Confident	57 Å²	57	82.9 Å²	82.9	29%	0.292	40%	0.403	S	S	.	.	S	Bend	trans	-64.4	-35.1	-179	-66.5	174.9	0	0	0	112.2	F579 S581 Y584	I467-F579 HydrophobicContact CB-CE2 4.33Å; I467-F579 HydrophobicContact CD1-CD1 4.3Å; I467-F579 HydrophobicContact CD1-CE1 4.18Å; I467-F579 HydrophobicContact CD1-CZ 4.32Å; I467-F579 HydrophobicContact CG1-CE1 4.22Å; I467-F579 HydrophobicContact CG1-CE2 4.08Å; I467-F579 HydrophobicContact CG1-CZ 3.87Å; I467-F579 HydrophobicContact CG2-CD2 3.72Å; I467-F579 HydrophobicContact CG2-CE2 3.66Å; I467-F579 HydrophobicContact CG2-CG 4.44Å; I467-F579 HydrophobicContact CG2-CZ 4.33Å; I467-S581 PolarHBondContact O-OG 3.3Å; I467-Y584 WeakPolarHBondContact O-CD2 3.5Å; I467-Y584 WeakPolarHBondContact O-CE2 2.94Å
468	A	83.8	Confident	80	Confident	74 Å²	74	85.7 Å²	85.7	61%	0.612	43%	0.426	S	S	*	.	S	Bend	trans	-125.6	80.9	176.9	0	0	0	0	0	109.9	K466 Y583	K466-A468 VanDerWaalsContact C-N 3.31Å; K466-A468 PolarHBondContact O-N 2.94Å; A468-Y583 HydrophobicContact CB-CE2 4.44Å
469	P	80.9	Confident	79.4	Confident	18 Å²	18	86.6 Å²	86.6	12%	0.117	43%	0.429	C	S	.	.			trans	-73.2	145.9	178.8	32.6	-35.5	0	0	0	110.6	K471 Y583 Y584	P469-K471 WeakPolarHBondContact CB-O 3.23Å; P469-K471 PolarHBondContact O-N 3.49Å; P469-Y583 HydrophobicContact CG-CD1 4.5Å; P469-Y583 HydrophobicContact CG-CD2 4.38Å; P469-Y583 HydrophobicContact CG-CG 4.23Å; P469-Y584 HydrophobicContact CG-CE2 4.41Å
470	R	76.4	Confident	79.1	Confident	250 Å²	250	90.5 Å²	90.5	94%	0.943	44%	0.444	S	S	*	.	S	Bend	trans	-63.9	-22.9	175.9	-67.1	-176	-177.8	174	-0.2	113.4
471	K	73	Confident	79.1	Confident	182 Å²	182	90.3 Å²	90.3	79%	0.791	44%	0.441	S	S	*	.	S	Bend	trans	-135.1	140.9	176.6	-68	-174.5	178.8	-177.4	0	108.9	P469	P469-K471 WeakPolarHBondContact CB-O 3.23Å; P469-K471 PolarHBondContact O-N 3.49Å
472	L	67.4	Low	79.1	Confident	128 Å²	128	91.9 Å²	91.9	67%	0.67	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-57.5	135.4	174.2	-89.7	96.4	0	0	0	109.7	G474 Y583	L472-G474 PolarHBondContact O-N 2.58Å; L472-Y583 HydrophobicContact CD1-CD1 3.85Å; L472-Y583 HydrophobicContact CD1-CE1 3.75Å; L472-Y583 HydrophobicContact CG-CD1 3.81Å; L472-Y583 HydrophobicContact CG-CE1 4.18Å
473	P	63.9	Low	79.3	Confident	35 Å²	35	90.4 Å²	90.4	23%	0.227	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-58.2	134.1	170.8	-13.8	25.1	0	0	0	109.1	Y584	P473-Y584 HydrophobicContact CG-CE1 4.48Å; P473-Y584 WeakPolarHBondContact CG-OH 3.07Å
474	G	63.3	Low	79.4	Confident	49 Å²	49	87.7 Å²	87.7	51%	0.505	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-54.2	152.5	167.6	0	0	0	0	0	110.3	L472 N476	L472-G474 PolarHBondContact O-N 2.58Å; G474-N476 PolarHBondContact O-N 2.66Å
475	R	62.2	Low	79.7	Confident	252 Å²	252	87.3 Å²	87.3	95%	0.951	43%	0.427	S	S	*	.	S	Bend	trans	-66	41.1	176	-75.9	-172.2	171	-170.3	-0.8	113
476	N	61.8	Low	80.2	Confident	116 Å²	116	80.4 Å²	80.4	62%	0.62	40%	0.395	S	S	*	.			trans	-79.3	125.9	-179.2	-78.9	-3.1	0	0	0	110.2	G474 A478	G474-N476 PolarHBondContact O-N 2.66Å; N476-A478 HydrophobicContact CB-CB 4.33Å; N476-A478 PolarHBondContact O-N 3.1Å
477	N	66.3	Low	80.8	Confident	126 Å²	126	74.1 Å²	74.1	67%	0.674	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-60.3	-11.2	173	-74.2	-20.3	0	0	0	113.3	R479 W480	N477-R479 PolarHBondContact O-N 3.16Å; N477-R479 VanDerWaalsContact O-N 3.11Å; N477-W480 PolarHBondContact O-N 3.5Å
478	A	73.4	Confident	81.3	Confident	59 Å²	59	72.1 Å²	72.1	49%	0.488	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-60.9	-19.1	-178.4	0	0	0	0	0	115	N476 R481	N476-A478 HydrophobicContact CB-CB 4.33Å; N476-A478 PolarHBondContact O-N 3.1Å; A478-R481 PolarHBondContact O-NH1 3.37Å
479	R	83	Confident	81.9	Confident	70 Å²	70	69.4 Å²	69.4	26%	0.264	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-95.7	-5.6	-179.6	-67.6	-173.1	175.6	-166.9	-4.8	114.5	Q462 E463 E465 N477	Q462-R479 HydrophobicContact CG-CB 3.71Å; E463-R479 PolarHBondContact N-O 3.41Å; E465-R479 IonicContact OE2-NH2 3.33Å; N477-R479 PolarHBondContact O-N 3.16Å; N477-R479 VanDerWaalsContact O-N 3.11Å
480	W	89	Confident	82.6	Confident	84 Å²	84	68.6 Å²	68.6	32%	0.318	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	137.9	177.1	-68.5	82.5	0	0	0	110.7	L460 T461 N477 F551	L460-W480 HydrophobicContact CD1-CB 4.21Å; L460-W480 HydrophobicContact CD1-CE3 3.76Å; L460-W480 HydrophobicContact CD2-CE3 4.13Å; L460-W480 HydrophobicContact CD2-CZ3 4.3Å; L460-W480 HydrophobicContact CG-CE3 3.61Å; L460-W480 HydrophobicContact CG-CZ3 3.93Å; T461-W480 CarbonylContact O-C 3.51Å; T461-W480 WeakPolarHBondContact O-CA 3.43Å; N477-W480 PolarHBondContact O-N 3.5Å; W480-F551 HydrophobicContact CH2-CE1 4.17Å; W480-F551 HydrophobicContact CZ3-CD1 4.48Å; W480-F551 HydrophobicContact CZ3-CE1 4.05Å
481	R	92.3	Very high	83.6	Confident	24 Å²	24	56.8 Å²	56.8	9%	0.091	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.7	178.1	-59.9	-64.7	-179.8	-91	-11.4	108.9	L460 T461 E463 A478 V492 V493	L460-R481 WeakPolarHBondContact CD1-O 3.28Å; T461-R481 HydrophobicContact CG2-CB 4.39Å; T461-R481 PolarHBondContact N-O 2.95Å; T461-R481 PolarHBondContact O-N 2.95Å; E463-R481 HydrophobicContact CB-CG 3.93Å; E463-R481 IonicContact OE2-CZ 2.91Å; E463-R481 IonicContact OE2-NE 3.66Å; E463-R481 PolarHBondContact OE2-NE 2.7Å; E463-R481 IonicContact OE2-NH2 2.84Å; E463-R481 PolarHBondContact OE2-NH2 3.33Å; A478-R481 PolarHBondContact O-NH1 3.37Å; R481-V492 HydrophobicContact CB-CG1 3.77Å; R481-V492 HydrophobicContact CG-CG1 3.8Å; R481-V493 WeakPolarHBondContact CA-O 3.45Å
482	H	93.6	Very high	84.6	Confident	33 Å²	33	48.1 Å²	48.1	15%	0.153	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.2	160.7	-65.8	-90.5	0	0	0	108.5	I459 V493 F557 F563	I459-H482 CarbonylContact O-C 3.57Å; I459-H482 WeakPolarHBondContact O-CA 3.32Å; H482-V493 HydrophobicContact CB-CG2 3.64Å; H482-V493 PolarHBondContact N-O 3.25Å; H482-V493 PolarHBondContact O-N 3.23Å; H482-F557 HydrophobicContact CB-CE1 4.23Å; H482-F557 HydrophobicContact CB-CZ 3.64Å; H482-F557 AromaticContact CE1-CE1 3.98Å; H482-F557 AromaticContact CG-CE1 3.8Å; H482-F557 AromaticContact CG-CZ 3.7Å; H482-F557 AromaticContact ND1-CE1 3.68Å; H482-F557 AromaticContact ND1-CZ 4Å; H482-F563 AromaticContact CD2-CE1 3.61Å; H482-F563 AromaticContact NE2-CE1 3.85Å
483	L	95.9	Very high	85.9	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.3	167.3	-53	-177.1	0	0	0	107.5	R458 I459 T461 I485 L490 V492 L600 M602 F611	R458-L483 CarbonylContact C-O 3.52Å; R458-L483 WeakPolarHBondContact CA-O 3.41Å; I459-L483 PolarHBondContact N-O 2.96Å; I459-L483 PolarHBondContact O-N 2.92Å; T461-L483 HydrophobicContact CG2-CD1 3.78Å; T461-L483 HydrophobicContact CG2-CD2 3.76Å; T461-L483 HydrophobicContact CG2-CG 3.56Å; L483-I485 HydrophobicContact CB-CD1 4.18Å; L483-L490 HydrophobicContact CB-CD1 4.07Å; L483-V492 HydrophobicContact CD2-CG1 4.24Å; L483-V492 HydrophobicContact CD2-CG2 3.92Å; L483-L600 HydrophobicContact CD1-CD1 3.62Å; L483-L600 HydrophobicContact CD2-CD1 4.31Å; L483-L600 HydrophobicContact CD2-CD2 4.37Å; L483-M602 HydrophobicContact CD1-CE 4.06Å; L483-F611 HydrophobicContact CD1-CD2 3.84Å; L483-F611 HydrophobicContact CD1-CE2 3.47Å; L483-F611 VanDerWaalsContact CD1-CE2 3.47Å; L483-F611 HydrophobicContact CD1-CZ 4.1Å
484	L	96.1	Very high	87.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.5	168.4	-53.8	179.8	0	0	0	107.5	L435 L439 F455 R458 F486 V491 V493 F557	L435-L484 HydrophobicContact CD2-CD1 4.28Å; L439-L484 HydrophobicContact CD1-CD1 4.14Å; L439-L484 HydrophobicContact CD2-CD1 3.97Å; F455-L484 HydrophobicContact CE2-CB 4.28Å; F455-L484 HydrophobicContact CE2-CD2 4.13Å; R458-L484 HydrophobicContact CB-CD2 3.62Å; L484-F486 HydrophobicContact CB-CE2 3.61Å; L484-F486 HydrophobicContact CB-CZ 4.04Å; L484-V491 HydrophobicContact CB-CB 4.2Å; L484-V491 PolarHBondContact N-O 3.04Å; L484-V491 PolarHBondContact O-N 3.03Å; L484-V493 HydrophobicContact CD1-CG1 4.09Å; L484-V493 HydrophobicContact CG-CG1 4.49Å; L484-V493 HydrophobicContact CG-CG2 4.48Å; L484-F557 HydrophobicContact CD1-CE2 4.07Å; L484-F557 HydrophobicContact CD2-CD2 4.41Å; L484-F557 HydrophobicContact CD2-CE2 3.57Å; L484-F557 HydrophobicContact CD2-CZ 3.82Å; L484-F557 HydrophobicContact CG-CE2 4.27Å
485	I	97	Very high	88.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.8	-178.6	-55	84.9	0	0	0	108.2	I456 G457 I459 L483 L490 F571 F611 W614	I456-I485 HydrophobicContact CB-CB 4.41Å; I456-I485 HydrophobicContact CB-CG2 4.2Å; I456-I485 WeakPolarHBondContact CB-O 3.01Å; I456-I485 HydrophobicContact CD1-CG2 4.27Å; I456-I485 PolarHBondContact N-O 2.95Å; G457-I485 PolarHBondContact N-O 3.19Å; G457-I485 WeakPolarHBondContact O-CD1 3.37Å; G457-I485 PolarHBondContact O-N 3.25Å; I459-I485 HydrophobicContact CD1-CD1 4.46Å; I459-I485 HydrophobicContact CG1-CD1 4.17Å; L483-I485 HydrophobicContact CB-CD1 4.18Å; I485-L490 HydrophobicContact CG1-CD1 4Å; I485-F571 HydrophobicContact CG2-CE2 3.93Å; I485-F571 HydrophobicContact CG2-CZ 3.81Å; I485-F611 HydrophobicContact CD1-CD2 4.37Å; I485-F611 HydrophobicContact CG1-CD2 4.38Å; I485-F611 HydrophobicContact CG1-CE2 4.31Å; I485-W614 HydrophobicContact CD1-CE3 3.75Å; I485-W614 HydrophobicContact CD1-CZ3 4.14Å; I485-W614 HydrophobicContact CG1-CE3 4.3Å; I485-W614 HydrophobicContact CG2-CB 4.14Å
486	F	96.7	Very high	89.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	173.2	168.9	-55	-93.6	0	0	0	109.6	L432 L435 F448 R453 R454 F455 L484 D488 I489 V491 F571 S618	L432-F486 HydrophobicContact CD2-CD1 3.77Å; L432-F486 HydrophobicContact CD2-CE1 3.46Å; L432-F486 VanDerWaalsContact CD2-CE1 3.46Å; L435-F486 HydrophobicContact CD1-CE1 3.99Å; L435-F486 HydrophobicContact CD1-CZ 3.91Å; F448-F486 HydrophobicContact CE2-CE2 4.27Å; F448-F486 AromaticContact CE2-CZ 3.95Å; F448-F486 HydrophobicContact CE2-CZ 3.95Å; F448-F486 AromaticContact CZ-CE1 3.94Å; F448-F486 HydrophobicContact CZ-CE1 3.94Å; F448-F486 HydrophobicContact CZ-CE2 4.27Å; F448-F486 AromaticContact CZ-CZ 3.52Å; F448-F486 HydrophobicContact CZ-CZ 3.52Å; R453-F486 HydrophobicContact CG-CB 4.06Å; R453-F486 HydrophobicContact CG-CD1 3.71Å; R453-F486 HydrophobicContact CG-CG 4.1Å; R454-F486 CarbonylContact O-C 3.25Å; R454-F486 WeakPolarHBondContact O-CA 3.39Å; R454-F486 WeakPolarHBondContact O-CB 3.44Å; F455-F486 HydrophobicContact CB-CD1 4.19Å; F455-F486 HydrophobicContact CB-CE1 4.05Å; F455-F486 HydrophobicContact CD2-CD1 4.19Å; F455-F486 AromaticContact CD2-CE1 3.67Å; F455-F486 HydrophobicContact CD2-CE1 3.67Å; F455-F486 AromaticContact CD2-CZ 3.93Å; F455-F486 HydrophobicContact CD2-CZ 3.93Å; F455-F486 HydrophobicContact CG-CE1 4.35Å; L484-F486 HydrophobicContact CB-CE2 3.61Å; L484-F486 HydrophobicContact CB-CZ 4.04Å; F486-D488 VanDerWaalsContact C-N 3.3Å; F486-D488 PolarHBondContact O-N 3.16Å; F486-I489 WeakPolarHBondContact CA-O 3.42Å; F486-I489 HydrophobicContact CB-CG1 4.07Å; F486-I489 WeakPolarHBondContact CB-O 3.26Å; F486-I489 HydrophobicContact CD2-CD1 4.37Å; F486-I489 HydrophobicContact CD2-CG1 3.83Å; F486-I489 WeakPolarHBondContact CD2-O 3.35Å; F486-I489 HydrophobicContact CG-CG1 4.16Å; F486-I489 PolarHBondContact N-O 3.02Å; F486-V491 HydrophobicContact CD2-CG2 4.08Å; F486-V491 HydrophobicContact CE2-CB 4.14Å; F486-V491 HydrophobicContact CE2-CG2 3.68Å; F486-F571 WeakPolarHBondContact O-CE2 3.38Å; F486-S618 PolarHBondContact O-OG 3.45Å
487	N	95.9	Very high	89.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-65.3	-33	174.2	63.9	-42.8	0	0	0	113	T241 H452 R453 R454 I456 S618 E621	T241-N487 PolarHBondContact OG1-ND2 3.25Å; H452-N487 PolarHBondContact O-ND2 3.25Å; R453-N487 WeakPolarHBondContact CA-OD1 3.49Å; R454-N487 PolarHBondContact N-OD1 3.02Å; R454-N487 PolarHBondContact O-N 3.23Å; R454-N487 VanDerWaalsContact O-N 3.1Å; I456-N487 HydrophobicContact CD1-CB 4.39Å; N487-S618 WeakPolarHBondContact O-CB 3.32Å; N487-E621 PolarHBondContact ND2-OE1 2.88Å
488	D	95.8	Very high	88.7	Confident	15 Å²	15	35.6 Å²	35.6	8%	0.08	19%	0.188	C	C	.	.	S	Bend	trans	-107.7	-28.9	-174.3	67.2	-35.9	0	0	0	114.6	R453 F486 F571 M622	R453-D488 WeakPolarHBondContact CG-OD1 3.49Å; R453-D488 IonicContact CZ-OD1 2.76Å; R453-D488 IonicContact CZ-OD2 3.94Å; R453-D488 IonicContact NE-OD1 2.89Å; R453-D488 PolarHBondContact NE-OD1 3.25Å; R453-D488 IonicContact NE-OD2 3.57Å; R453-D488 PolarHBondContact NE-OD2 2.79Å; R453-D488 VanDerWaalsContact NE-OD2 3.12Å; R453-D488 IonicContact NH2-OD1 2.99Å; R453-D488 IonicContact NH2-OD2 2.91Å; R453-D488 PolarHBondContact NH2-OD2 2.96Å; F486-D488 VanDerWaalsContact C-N 3.3Å; F486-D488 PolarHBondContact O-N 3.16Å; D488-F571 PolarHBondContact O-N 3.29Å; D488-M622 HydrophobicContact CB-CE 4.45Å; D488-M622 HydrophobicContact CB-SD 3.82Å
489	I	96	Very high	87.1	Confident	17 Å²	17	38.6 Å²	38.6	9%	0.087	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.8	-176.5	63.2	169.7	0	0	0	113.3	F486 V491 V568 Y569 F571	F486-I489 WeakPolarHBondContact CA-O 3.42Å; F486-I489 HydrophobicContact CB-CG1 4.07Å; F486-I489 WeakPolarHBondContact CB-O 3.26Å; F486-I489 HydrophobicContact CD2-CD1 4.37Å; F486-I489 HydrophobicContact CD2-CG1 3.83Å; F486-I489 WeakPolarHBondContact CD2-O 3.35Å; F486-I489 HydrophobicContact CG-CG1 4.16Å; F486-I489 PolarHBondContact N-O 3.02Å; I489-V491 HydrophobicContact CD1-CG2 3.65Å; I489-V491 HydrophobicContact CG1-CG2 4.17Å; I489-V568 HydrophobicContact CB-CG1 4.19Å; I489-V568 HydrophobicContact CD1-CG1 3.96Å; I489-V568 HydrophobicContact CG2-CG1 4.42Å; I489-Y569 CarbonylContact C-O 3.47Å; I489-Y569 WeakPolarHBondContact CA-O 2.87Å; I489-F571 VanDerWaalsContact O-CE2 3.28Å; I489-F571 WeakPolarHBondContact O-CE2 3.46Å
490	L	96.5	Very high	84.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.3	164.9	175.9	66.8	0	0	0	109.2	L483 I485 V568 Y569 F571 L590 F611	L483-L490 HydrophobicContact CB-CD1 4.07Å; I485-L490 HydrophobicContact CG1-CD1 4Å; L490-V568 CarbonylContact O-C 3.5Å; L490-V568 WeakPolarHBondContact O-CA 3.36Å; L490-Y569 HydrophobicContact CD2-CD2 4.2Å; L490-Y569 PolarHBondContact N-O 3.41Å; L490-Y569 PolarHBondContact O-N 3.29Å; L490-F571 HydrophobicContact CB-CE1 4.39Å; L490-F571 HydrophobicContact CB-CE2 4.06Å; L490-F571 HydrophobicContact CB-CZ 3.81Å; L490-L590 HydrophobicContact CD2-CD1 3.32Å; L490-F611 HydrophobicContact CD1-CE2 4.43Å
491	V	96	Very high	81.9	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.9	176.8	-176.1	0	0	0	0	109.8	F448 L484 F486 I489 V493 V565 V568	F448-V491 HydrophobicContact CE2-CG2 4.41Å; L484-V491 HydrophobicContact CB-CB 4.2Å; L484-V491 PolarHBondContact N-O 3.04Å; L484-V491 PolarHBondContact O-N 3.03Å; F486-V491 HydrophobicContact CD2-CG2 4.08Å; F486-V491 HydrophobicContact CE2-CB 4.14Å; F486-V491 HydrophobicContact CE2-CG2 3.68Å; I489-V491 HydrophobicContact CD1-CG2 3.65Å; I489-V491 HydrophobicContact CG1-CG2 4.17Å; V491-V493 HydrophobicContact CG1-CG1 3.71Å; V491-V565 HydrophobicContact CG1-CG1 3.91Å; V491-V565 HydrophobicContact CG1-CG2 4.35Å; V491-V568 HydrophobicContact CG1-CG2 4.27Å; V491-V568 HydrophobicContact CG2-CG1 4.26Å; V491-V568 HydrophobicContact CG2-CG2 4.27Å
492	V	95.7	Very high	79	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.7	177.1	-174.2	0	0	0	0	109	R481 L483 R566 S567 Y569 I598	R481-V492 HydrophobicContact CB-CG1 3.77Å; R481-V492 HydrophobicContact CG-CG1 3.8Å; L483-V492 HydrophobicContact CD2-CG1 4.24Å; L483-V492 HydrophobicContact CD2-CG2 3.92Å; V492-R566 PolarHBondContact O-N 3.02Å; V492-S567 WeakPolarHBondContact CB-OG 3.25Å; V492-S567 WeakPolarHBondContact CG2-OG 3.37Å; V492-S567 PolarHBondContact N-O 3.27Å; V492-S567 PolarHBondContact O-N 3.38Å; V492-Y569 HydrophobicContact CG2-CD2 4.24Å; V492-Y569 HydrophobicContact CG2-CE2 3.83Å; V492-I598 HydrophobicContact CG1-CD1 4.49Å; V492-I598 HydrophobicContact CG2-CD1 3.84Å
493	V	94.3	Very high	75.9	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.6	-176.2	-47.8	0	0	0	0	112.3	L439 R481 H482 L484 V491 F557 F563 Q564 V565	L439-V493 HydrophobicContact CD2-CB 4.44Å; L439-V493 HydrophobicContact CD2-CG1 3.68Å; R481-V493 WeakPolarHBondContact CA-O 3.45Å; H482-V493 HydrophobicContact CB-CG2 3.64Å; H482-V493 PolarHBondContact N-O 3.25Å; H482-V493 PolarHBondContact O-N 3.23Å; L484-V493 HydrophobicContact CD1-CG1 4.09Å; L484-V493 HydrophobicContact CG-CG1 4.49Å; L484-V493 HydrophobicContact CG-CG2 4.48Å; V491-V493 HydrophobicContact CG1-CG1 3.71Å; V493-F557 HydrophobicContact CG2-CE2 4.13Å; V493-F557 HydrophobicContact CG2-CZ 4.08Å; V493-F563 HydrophobicContact CB-CB 4Å; V493-F563 HydrophobicContact CG2-CB 3.85Å; V493-F563 HydrophobicContact CG2-CD1 3.88Å; V493-F563 HydrophobicContact CG2-CG 4.12Å; V493-Q564 CarbonylContact C-O 3.6Å; V493-Q564 VanDerWaalsContact CA-O 3.27Å; V493-Q564 WeakPolarHBondContact CA-O 3.42Å; V493-V565 HydrophobicContact CG1-CG2 4.34Å
494	K	91.2	Very high	72.7	Confident	83 Å²	83	69.5 Å²	69.5	36%	0.361	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.4	174.2	-176.6	-177	174.8	-174.9	0	108.8	L496 F563 Q564 R566	K494-L496 PolarHBondContact O-N 3.03Å; K494-F563 WeakPolarHBondContact O-CA 3.4Å; K494-Q564 PolarHBondContact N-O 3.32Å; K494-Q564 PolarHBondContact O-N 3.49Å; K494-R566 HydrophobicContact CB-CG 3.94Å
495	S	86.6	Confident	69.5	Low	46 Å²	46	74.4 Å²	74.4	32%	0.322	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	131.9	171.6	-167.1	0	0	0	0	109.4	T561	S495-T561 WeakPolarHBondContact OG-CG2 3.39Å
496	L	84.1	Confident	66.3	Low	52 Å²	52	83.1 Å²	83.1	27%	0.272	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-91.5	130.7	165.2	-61.8	175.7	0	0	0	107	I440 K494 T498 T562 Q564	I440-L496 HydrophobicContact CD1-CD1 3.39Å; I440-L496 HydrophobicContact CG1-CD1 4.01Å; K494-L496 PolarHBondContact O-N 3.03Å; L496-T498 PolarHBondContact O-N 3.24Å; L496-T562 PolarHBondContact N-O 3.1Å; L496-Q564 HydrophobicContact CD1-CB 4.13Å; L496-Q564 HydrophobicContact CD2-CB 4.11Å; L496-Q564 HydrophobicContact CG-CB 4.12Å
497	N	64.8	Low	63.4	Low	141 Å²	141	89.6 Å²	89.6	75%	0.754	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-60.2	132.5	170.9	-74.6	-3.9	0	0	0	107.1	T499	N497-T499 VanDerWaalsContact C-N 3.3Å; N497-T499 PolarHBondContact O-N 3.41Å
498	T	49.3	Very low	60.3	Low	121 Å²	121	96.8 Å²	96.8	74%	0.742	53%	0.525	S	S	*	.			trans	-60	94.4	175.7	-173.9	0	0	0	0	109.4	L496	L496-T498 PolarHBondContact O-N 3.24Å
499	T	38.9	Very low	57.3	Low	122 Å²	122	102 Å²	102	75%	0.748	56%	0.563	S	S	*	*			trans	-94.2	100	170.1	49.7	0	0	0	0	107	N497 L501	N497-T499 VanDerWaalsContact C-N 3.3Å; N497-T499 PolarHBondContact O-N 3.41Å; T499-L501 PolarHBondContact O-N 3.24Å
500	R	30.1	Very low	54.1	Low	232 Å²	232	107.1 Å²	107.1	88%	0.875	59%	0.594	S	S	*	*			trans	36.3	84.8	156.5	-66.6	-176.5	-175.4	-163.6	0.9	115
501	L	33.8	Very low	51	Low	175 Å²	175	111.4 Å²	111.4	92%	0.916	63%	0.63	S	S	*	*			trans	-67.8	132.6	141	-78.5	169.5	0	0	0	107.8	T499	T499-L501 PolarHBondContact O-N 3.24Å
502	R	31.9	Very low	48.1	Very low	238 Å²	238	117.9 Å²	117.9	90%	0.898	67%	0.669	S	S	*	*			trans	-56.6	151.1	-164.4	-65.8	170.6	169.8	179.1	-5.3	113.2	G504	R502-G504 PolarHBondContact O-N 2.77Å
503	S	27.8	Very low	45.2	Very low	135 Å²	135	124.9 Å²	124.9	94%	0.944	71%	0.711	S	S	*	*	S	Bend	trans	-23.4	123	168.9	-68.3	0	0	0	0	114.4
504	G	28.1	Very low	42.2	Very low	80 Å²	80	128.7 Å²	128.7	83%	0.825	74%	0.743	S	S	*	*			trans	155.8	20.3	170	0	0	0	0	0	117.6	R502	R502-G504 PolarHBondContact O-N 2.77Å
505	S	29.3	Very low	39.3	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	77%	0.772	S	S	*	*			trans	-171.3	97.2	158.7	-167.3	0	0	0	0	110.8	I507	S505-I507 PolarHBondContact O-N 3.08Å
506	L	29.9	Very low	36.7	Very low	184 Å²	184	136.3 Å²	136.3	96%	0.963	79%	0.791	S	S	*	*			trans	-91.4	69.7	167.9	-76.6	170.3	0	0	0	108.9
507	I	35.4	Very low	34.6	Very low	135 Å²	135	142 Å²	142	69%	0.692	82%	0.821	S	S	*	*			trans	-136.8	-23	171.5	-56.3	-178.1	0	0	0	115.8	S505	S505-I507 PolarHBondContact O-N 3.08Å
508	N	31.3	Very low	33.2	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	83%	0.827	S	S	*	*	S	Bend	trans	-109.3	32.3	-171	-76	-1.8	0	0	0	117.1
509	S	31.7	Very low	32.7	Very low	126 Å²	126	146.1 Å²	146.1	88%	0.881	83%	0.833	S	S	*	*	S	Bend	trans	-109.5	15.6	174.1	-49.4	0	0	0	0	114.4
510	V	30.3	Very low	32.5	Very low	123 Å²	123	143.6 Å²	143.6	75%	0.745	83%	0.831	S	S	*	*			trans	-126.5	82.1	174.7	-174.4	0	0	0	0	108.9
511	A	31.1	Very low	32.8	Very low	91 Å²	91	139.6 Å²	139.6	75%	0.752	83%	0.832	S	S	*	*	S	Bend	trans	-149	28.4	172.4	0	0	0	0	0	113.9
512	V	34.1	Very low	32.7	Very low	138 Å²	138	141.2 Å²	141.2	84%	0.836	83%	0.826	S	S	*	*	S	Bend	trans	-152.7	42.6	165.5	-159.6	0	0	0	0	112.2
513	V	34.5	Very low	32.8	Very low	147 Å²	147	137.2 Å²	137.2	89%	0.891	82%	0.818	S	S	*	*			trans	-171.1	82	158.6	-113	0	0	0	0	108.2
514	A	31	Very low	32.9	Very low	80 Å²	80	140.6 Å²	140.6	66%	0.661	81%	0.811	S	S	*	*			trans	-153	54.8	170.4	0	0	0	0	0	110.1
515	F	32	Very low	33.4	Very low	220 Å²	220	142.2 Å²	142.2	97%	0.965	81%	0.805	S	S	*	*			trans	-124.1	75.8	156.6	-73	-72.2	0	0	0	106.5
516	G	32.3	Very low	33.7	Very low	70 Å²	70	142.7 Å²	142.7	72%	0.722	81%	0.806	S	S	*	*			trans	-106.6	94.3	165.6	0	0	0	0	0	107.2	Q518	G516-Q518 PolarHBondContact O-N 3.27Å
517	D	38.5	Very low	33.7	Very low	170 Å²	170	144.7 Å²	144.7	91%	0.909	80%	0.8	S	S	*	*			trans	-55.1	119.7	165	-96.1	-29	0	0	0	108.8
518	Q	36.2	Very low	33.7	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	80%	0.8	S	S	*	*			trans	-94.4	102.1	161.4	-69.6	-130.7	23.9	0	0	107.4	G516	G516-Q518 PolarHBondContact O-N 3.27Å
519	N	37.5	Very low	33.8	Very low	163 Å²	163	141.8 Å²	141.8	87%	0.872	79%	0.794	S	S	*	*			trans	-127.8	121	152.3	-115.6	-7.1	0	0	0	107.9
520	G	35.5	Very low	34.1	Very low	68 Å²	68	141.8 Å²	141.8	70%	0.701	79%	0.789	S	S	*	*			trans	-69	162.9	-170.5	0	0	0	0	0	113.5
521	T	36.2	Very low	34.4	Very low	148 Å²	148	140.6 Å²	140.6	91%	0.908	79%	0.786	S	S	*	*				-170.6	150.7	116.6	-66.7	0	0	0	0	108.5
522	R	32	Very low	34.5	Very low	209 Å²	209	147.1 Å²	147.1	79%	0.789	79%	0.791	S	S	*	*			trans	-75.6	168.9	-160.1	-66.9	168.5	167.2	167	-4.7	116.2
523	H	35	Very low	34.6	Very low	155 Å²	155	147.2 Å²	147.2	72%	0.718	79%	0.786	S	S	*	*			trans	109	102.9	149.5	-62.9	-66.7	0	0	0	116
524	Y	29.8	Very low	34.6	Very low	206 Å²	206	147 Å²	147	81%	0.808	78%	0.781	S	S	*	*				62.8	127.5	89.5	-97.3	-103.9	0	0	0	112
525	T	37.3	Very low	34.7	Very low	114 Å²	114	148.3 Å²	148.3	70%	0.699	79%	0.785	S	S	*	*			cis	-170.2	166.6	7.3	9.2	0	0	0	0	108.7
526	P	35.2	Very low	34.6	Very low	112 Å²	112	143.2 Å²	143.2	73%	0.727	78%	0.776	S	S	*	*			trans	-109.2	160.5	-168.9	39.6	-30	0	0	0	114.6
527	R	31.8	Very low	34.6	Very low	225 Å²	225	146 Å²	146	85%	0.849	78%	0.783	S	S	*	*				168	150.3	128.5	-103.1	-176.3	-174.8	-170.3	1.4	115
528	N	35	Very low	34.1	Very low	127 Å²	127	143 Å²	143	68%	0.679	78%	0.776	S	S	*	*			trans	88.3	96.1	144.8	-71.3	4.9	0	0	0	121.2
529	S	33.4	Very low	34.1	Very low	99 Å²	99	138.6 Å²	138.6	69%	0.692	76%	0.764	S	S	*	*				57.9	133.7	107.6	70.7	0	0	0	0	122.6
530	V	37.3	Very low	33.7	Very low	126 Å²	126	140.8 Å²	140.8	76%	0.764	77%	0.765	S	S	*	*			trans	118	129.8	137.2	-164.3	0	0	0	0	116.8
531	S	36.1	Very low	33.2	Very low	98 Å²	98	141 Å²	141	69%	0.685	77%	0.768	S	S	*	*			trans	63.1	115.7	152.9	52.6	0	0	0	0	120.2
532	R	34.4	Very low	33	Very low	228 Å²	228	139.9 Å²	139.9	86%	0.86	76%	0.763	S	S	*	*				72.8	103.7	87	-90.5	-169.5	-174.4	169.7	0.4	113.6
533	D	35.3	Very low	32.8	Very low	139 Å²	139	137 Å²	137	74%	0.743	77%	0.768	S	S	*	*				155.1	140.9	108.9	-78.2	-22.4	0	0	0	113
534	D	34.7	Very low	32.5	Very low	144 Å²	144	137.8 Å²	137.8	77%	0.77	77%	0.772	S	S	*	*			trans	59.2	109	149.7	-71.9	-22.6	0	0	0	124
535	S	32.5	Very low	32.3	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	78%	0.776	S	S	*	*				89.9	133.2	117.5	76.2	0	0	0	0	120.9
536	S	30.6	Very low	31.8	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	78%	0.775	S	S	*	*			trans	90.1	136.6	158.9	77.5	0	0	0	0	119.5
537	C	32.1	Very low	31.8	Very low	128 Å²	128	136.2 Å²	136.2	87%	0.865	78%	0.776	S	S	*	*			trans	86.2	102.9	168.3	-63.7	0	0	0	0	119
538	S	29.1	Very low	32.2	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	78%	0.775	S	S	*	*			trans	-77.6	177.1	148.2	68.6	0	0	0	0	109.4
539	P	34.4	Very low	33.4	Very low	94 Å²	94	134.8 Å²	134.8	61%	0.61	77%	0.773	S	S	*	*			cis	-141.2	178.6	7.2	25.8	1.1	0	0	0	115.4
540	F	29.5	Very low	35.1	Very low	208 Å²	208	134.6 Å²	134.6	91%	0.912	77%	0.767	S	S	*	*			trans	87.2	115.4	162.1	-62.5	-78.2	0	0	0	120.6
541	G	25.8	Very low	37.2	Very low	73 Å²	73	131.8 Å²	131.8	75%	0.753	75%	0.745	S	S	*	*			trans	129.1	114.1	154.3	0	0	0	0	0	113.6
542	P	30.9	Very low	39.7	Very low	124 Å²	124	128.9 Å²	128.9	81%	0.805	72%	0.724	S	S	*	*				-131.5	136.1	125.9	35	-24.5	0	0	0	112.3	Q544	P542-Q544 PolarHBondContact O-N 3.06Å
543	V	28.6	Very low	42.4	Very low	149 Å²	149	119.3 Å²	119.3	90%	0.903	69%	0.692	S	S	*	*			trans	-33.9	122	168.2	177.9	0	0	0	0	112.1
544	Q	27.9	Very low	45	Very low	171 Å²	171	116.4 Å²	116.4	80%	0.799	68%	0.679	S	S	*	*			trans	-93.1	119.5	170.7	-93.6	179.2	-0.1	0	0	110.1	P542 V546	P542-Q544 PolarHBondContact O-N 3.06Å; Q544-V546 PolarHBondContact O-N 3.01Å
545	D	26.8	Very low	47.6	Very low	166 Å²	166	114.1 Å²	114.1	89%	0.888	66%	0.664	S	S	*	*			trans	-74.7	110.2	165.8	-142.3	-7.3	0	0	0	108.5	T547	D545-T547 PolarHBondContact O-N 3.23Å
546	V	27.2	Very low	50.1	Low	110 Å²	110	110.1 Å²	110.1	67%	0.667	64%	0.636	S	S	*	*			trans	-85.1	93.8	-170.3	179.8	0	0	0	0	110.2	Q544 Q548	Q544-V546 PolarHBondContact O-N 3.01Å; V546-Q548 HydrophobicContact CG1-CG 4.12Å
547	T	35.5	Very low	52.6	Low	124 Å²	124	105.5 Å²	105.5	76%	0.761	60%	0.601	S	S	*	*			trans	-97.7	99.9	150.5	42.7	0	0	0	0	107.7	D545 K549	D545-T547 PolarHBondContact O-N 3.23Å; T547-K549 PolarHBondContact O-N 3.1Å
548	Q	40	Very low	54.5	Low	175 Å²	175	102.9 Å²	102.9	82%	0.818	59%	0.589	S	S	*	*			trans	-59.9	97.5	173.7	-91.5	179.9	-22.4	0	0	109.3	V546 V550	V546-Q548 HydrophobicContact CG1-CG 4.12Å; Q548-V550 PolarHBondContact O-N 3.12Å
549	K	59.9	Low	56.3	Low	147 Å²	147	101.8 Å²	101.8	64%	0.639	58%	0.578	S	S	*	*			trans	-66	104.7	167.5	-80.8	-178.9	179	174.3	0	108	T547 F551	T547-K549 PolarHBondContact O-N 3.1Å; K549-F551 HydrophobicContact CB-CE1 4.4Å; K549-F551 HydrophobicContact CB-CE2 4.01Å; K549-F551 HydrophobicContact CB-CZ 3.93Å; K549-F551 HydrophobicContact CD-CZ 4.45Å; K549-F551 WeakPolarHBondContact O-CD2 3.31Å; K549-F551 WeakPolarHBondContact O-CE2 3.34Å; K549-F551 PolarHBondContact O-N 3.28Å
550	V	69	Low	58.2	Low	94 Å²	94	103.6 Å²	103.6	57%	0.57	58%	0.582	S	S	*	*			trans	-67.7	105	172.3	-179.2	0	0	0	0	108.2	Q548 C552	Q548-V550 PolarHBondContact O-N 3.12Å; V550-C552 VanDerWaalsContact CG1-O 3.32Å; V550-C552 WeakPolarHBondContact CG1-O 3.47Å
551	F	81.5	Confident	60.8	Low	67 Å²	67	96 Å²	96	29%	0.294	55%	0.553	S	S	.	*			trans	-83.3	-25.3	-178.8	-70.8	-74.4	0	0	0	113.4	I459 L460 W480 K549 P603 C607	I459-F551 CarbonylContact C-O 3.54Å; I459-F551 VanDerWaalsContact CA-O 3.28Å; I459-F551 WeakPolarHBondContact CA-O 3.48Å; L460-F551 HydrophobicContact CB-CD1 4.21Å; L460-F551 HydrophobicContact CD2-CD1 4.03Å; L460-F551 HydrophobicContact CD2-CE1 4.15Å; L460-F551 HydrophobicContact CG-CD1 4.29Å; L460-F551 PolarHBondContact N-O 3.02Å; W480-F551 HydrophobicContact CH2-CE1 4.17Å; W480-F551 HydrophobicContact CZ3-CD1 4.48Å; W480-F551 HydrophobicContact CZ3-CE1 4.05Å; K549-F551 HydrophobicContact CB-CE1 4.4Å; K549-F551 HydrophobicContact CB-CE2 4.01Å; K549-F551 HydrophobicContact CB-CZ 3.93Å; K549-F551 HydrophobicContact CD-CZ 4.45Å; K549-F551 WeakPolarHBondContact O-CD2 3.31Å; K549-F551 WeakPolarHBondContact O-CE2 3.34Å; K549-F551 PolarHBondContact O-N 3.28Å; F551-P603 HydrophobicContact CB-CG 3.78Å; F551-P603 HydrophobicContact CD1-CB 3.66Å; F551-P603 HydrophobicContact CD1-CG 3.56Å; F551-P603 HydrophobicContact CD2-CB 4.46Å; F551-P603 HydrophobicContact CD2-CG 4.49Å; F551-P603 HydrophobicContact CE1-CB 3.83Å; F551-P603 HydrophobicContact CE1-CG 4.26Å; F551-P603 HydrophobicContact CG-CB 3.99Å; F551-P603 HydrophobicContact CG-CG 3.7Å; F551-P603 HydrophobicContact CZ-CB 4.32Å; F551-C607 VanDerWaalsContact CB-SG 3.58Å
552	C	87.8	Confident	63.9	Low	37 Å²	37	95.6 Å²	95.6	25%	0.25	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	132	-175.9	-71.8	0	0	0	0	109.1	R458 I459 V550 C607	R458-C552 WeakPolarHBondContact O-CA 3.47Å; I459-C552 HydrophobicContact CG1-CB 4.39Å; V550-C552 VanDerWaalsContact CG1-O 3.32Å; V550-C552 WeakPolarHBondContact CG1-O 3.47Å; C552-C607 WeakPolarHBondContact CB-SG 3.48Å; C552-C607 WeakPolarHBondContact SG-CA 3.48Å; C552-C607 WeakPolarHBondContact SG-CB 3.2Å; C552-C607 CovalentContact SG-SG 2.07Å; C552-C607 PolarHBondContact SG-SG 3.41Å
553	S	90.4	Very high	66.8	Low	27 Å²	27	90.1 Å²	90.1	19%	0.189	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	144.7	-178.9	-179.9	0	0	0	0	111.8	G457 R458 E555	G457-S553 CarbonylContact C-O 3.55Å; G457-S553 VanDerWaalsContact CA-O 3.27Å; G457-S553 WeakPolarHBondContact CA-O 3.34Å; R458-S553 PolarHBondContact N-O 3.14Å; R458-S553 PolarHBondContact O-N 3.28Å; S553-E555 VanDerWaalsContact C-N 3.35Å; S553-E555 PolarHBondContact OG-N 3.32Å; S553-E555 VanDerWaalsContact OG-N 3.17Å
554	T	90.8	Very high	69.9	Low	78 Å²	78	85.8 Å²	85.8	48%	0.479	47%	0.469	S	S	.	.	S	Bend	trans	-87.9	-4.3	172.3	49.2	0	0	0	0	113.1	F455 W614	F455-T554 WeakPolarHBondContact CE1-O 3.44Å; T554-W614 HydrophobicContact CG2-CH2 4.42Å; T554-W614 HydrophobicContact CG2-CZ2 3.78Å
555	E	88.9	Confident	73	Confident	97 Å²	97	77.9 Å²	77.9	45%	0.453	43%	0.433	S	S	.	.	S	Bend	trans	-99.9	143.2	177.4	-66.8	-52.3	132.8	0	0	111.3	K431 R458 S553	K431-E555 WeakPolarHBondContact CE-OE2 2.9Å; K431-E555 VanDerWaalsContact NZ-CD 3.35Å; K431-E555 IonicContact NZ-OE1 2.77Å; K431-E555 PolarHBondContact NZ-OE1 3.32Å; K431-E555 IonicContact NZ-OE2 3.15Å; K431-E555 PolarHBondContact NZ-OE2 3.14Å; K431-E555 VanDerWaalsContact NZ-OE2 3.15Å; R458-E555 WeakPolarHBondContact CD-O 3.27Å; R458-E555 PolarHBondContact NE-O 2.81Å; S553-E555 VanDerWaalsContact C-N 3.35Å; S553-E555 PolarHBondContact OG-N 3.32Å; S553-E555 VanDerWaalsContact OG-N 3.17Å
556	P	85.4	Confident	76.3	Confident	22 Å²	22	76 Å²	76	14%	0.143	41%	0.413	C	S	.	.			trans	-65.3	177.6	178.4	29.2	-34.2	0	0	0	111.7	K431 L435 F455	K431-P556 HydrophobicContact CG-CG 4.44Å; L435-P556 HydrophobicContact CD1-CB 4.17Å; L435-P556 HydrophobicContact CD2-CB 3.65Å; L435-P556 HydrophobicContact CG-CB 3.7Å; F455-P556 HydrophobicContact CE1-CB 4.35Å
557	F	83.8	Confident	79.5	Confident	15 Å²	15	71.6 Å²	71.6	7%	0.066	39%	0.388	C	S	.	.			trans	-63.7	147.4	176.2	-62.7	-68	0	0	0	111.8	L435 V438 R458 H482 L484 V493 F563	L435-F557 HydrophobicContact CD2-CD2 3.81Å; L435-F557 HydrophobicContact CD2-CE2 4.45Å; V438-F557 HydrophobicContact CG2-CB 4.45Å; V438-F557 HydrophobicContact CG2-CD2 4.24Å; R458-F557 VanDerWaalsContact NH1-CE1 3.34Å; H482-F557 HydrophobicContact CB-CE1 4.23Å; H482-F557 HydrophobicContact CB-CZ 3.64Å; H482-F557 AromaticContact CE1-CE1 3.98Å; H482-F557 AromaticContact CG-CE1 3.8Å; H482-F557 AromaticContact CG-CZ 3.7Å; H482-F557 AromaticContact ND1-CE1 3.68Å; H482-F557 AromaticContact ND1-CZ 4Å; L484-F557 HydrophobicContact CD1-CE2 4.07Å; L484-F557 HydrophobicContact CD2-CD2 4.41Å; L484-F557 HydrophobicContact CD2-CE2 3.57Å; L484-F557 HydrophobicContact CD2-CZ 3.82Å; L484-F557 HydrophobicContact CG-CE2 4.27Å; V493-F557 HydrophobicContact CG2-CE2 4.13Å; V493-F557 HydrophobicContact CG2-CZ 4.08Å; F557-F563 HydrophobicContact CB-CE2 3.78Å; F557-F563 HydrophobicContact CB-CZ 4.4Å; F557-F563 HydrophobicContact CD1-CD2 4.34Å; F557-F563 HydrophobicContact CD1-CE1 4Å; F557-F563 AromaticContact CD1-CE2 3.47Å; F557-F563 HydrophobicContact CD1-CE2 3.47Å; F557-F563 VanDerWaalsContact CD1-CE2 3.47Å; F557-F563 AromaticContact CD1-CZ 3.27Å; F557-F563 HydrophobicContact CD1-CZ 3.27Å; F557-F563 AromaticContact CD2-CD2 3.61Å; F557-F563 HydrophobicContact CD2-CD2 3.61Å; F557-F563 AromaticContact CD2-CE2 3.52Å; F557-F563 HydrophobicContact CD2-CE2 3.52Å; F557-F563 HydrophobicContact CD2-CG 4.23Å; F557-F563 HydrophobicContact CD2-CZ 4.06Å; F557-F563 HydrophobicContact CE1-CD1 4.23Å; F557-F563 HydrophobicContact CE1-CD2 4.49Å; F557-F563 AromaticContact CE1-CE1 3.54Å; F557-F563 HydrophobicContact CE1-CE1 3.54Å; F557-F563 AromaticContact CE1-CE2 3.84Å; F557-F563 HydrophobicContact CE1-CE2 3.84Å; F557-F563 AromaticContact CE1-CZ 3.32Å; F557-F563 HydrophobicContact CE1-CZ 3.32Å; F557-F563 HydrophobicContact CE2-CD1 4.06Å; F557-F563 AromaticContact CE2-CD2 3.73Å; F557-F563 HydrophobicContact CE2-CD2 3.73Å; F557-F563 HydrophobicContact CE2-CE1 4.16Å; F557-F563 AromaticContact CE2-CE2 3.84Å; F557-F563 HydrophobicContact CE2-CE2 3.84Å; F557-F563 AromaticContact CE2-CG 3.86Å; F557-F563 HydrophobicContact CE2-CG 3.86Å; F557-F563 HydrophobicContact CE2-CZ 4.06Å; F557-F563 AromaticContact CG-CD2 3.93Å; F557-F563 HydrophobicContact CG-CD2 3.93Å; F557-F563 AromaticContact CG-CE2 3.31Å; F557-F563 HydrophobicContact CG-CE2 3.31Å; F557-F563 AromaticContact CG-CZ 3.68Å; F557-F563 HydrophobicContact CG-CZ 3.68Å; F557-F563 AromaticContact CZ-CD1 3.83Å; F557-F563 HydrophobicContact CZ-CD1 3.83Å; F557-F563 HydrophobicContact CZ-CD2 4.2Å; F557-F563 AromaticContact CZ-CE1 3.63Å; F557-F563 HydrophobicContact CZ-CE1 3.63Å; F557-F563 HydrophobicContact CZ-CE2 4.01Å; F557-F563 HydrophobicContact CZ-CG 4.13Å; F557-F563 AromaticContact CZ-CZ 3.73Å; F557-F563 HydrophobicContact CZ-CZ 3.73Å
558	A	71.1	Confident	82.3	Confident	73 Å²	73	68 Å²	68	60%	0.603	37%	0.366	S	S	*	.			trans	-66.4	149	162.2	0	0	0	0	0	109.7	D560	A558-D560 PolarHBondContact O-N 3.33Å
559	T	66.5	Low	84.9	Confident	86 Å²	86	61.9 Å²	61.9	53%	0.528	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.1	-166.5	43.5	0	0	0	0	116.1
560	D	75.2	Confident	86.6	Confident	132 Å²	132	58.6 Å²	58.6	71%	0.706	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-5.3	-163.3	-56	-11.3	0	0	0	113.7	A558	A558-D560 PolarHBondContact O-N 3.33Å
561	T	83.6	Confident	87.8	Confident	50 Å²	50	54.1 Å²	54.1	31%	0.307	30%	0.302	S	S	.	.			trans	-123.5	132	-178.3	-53.7	0	0	0	0	111	S495 F563	S495-T561 WeakPolarHBondContact OG-CG2 3.39Å; T561-F563 HydrophobicContact CG2-CD2 4.44Å; T561-F563 HydrophobicContact CG2-CE1 4.17Å; T561-F563 HydrophobicContact CG2-CE2 3.77Å; T561-F563 HydrophobicContact CG2-CZ 3.6Å; T561-F563 WeakPolarHBondContact O-CD2 3.44Å; T561-F563 VanDerWaalsContact O-CE2 3.23Å; T561-F563 WeakPolarHBondContact O-CE2 3.22Å
562	T	90.5	Very high	88.3	Confident	64 Å²	64	54.6 Å²	54.6	39%	0.393	31%	0.307	S	S	.	.			trans	-92.9	145	173.1	58.2	0	0	0	0	111.3	V438 L496	V438-T562 WeakPolarHBondContact O-CA 3.18Å; L496-T562 PolarHBondContact N-O 3.1Å
563	F	92.1	Very high	88.5	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.035	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.9	-175.3	-64.5	-90.7	0	0	0	110.3	V438 L439 I440 H482 V493 K494 F557 T561	V438-F563 HydrophobicContact CB-CD2 4.43Å; V438-F563 HydrophobicContact CG2-CD2 4.36Å; V438-F563 PolarHBondContact O-N 3.38Å; L439-F563 WeakPolarHBondContact CA-O 3.45Å; L439-F563 HydrophobicContact CD2-CB 4.02Å; I440-F563 PolarHBondContact N-O 3.08Å; H482-F563 AromaticContact CD2-CE1 3.61Å; H482-F563 AromaticContact NE2-CE1 3.85Å; V493-F563 HydrophobicContact CB-CB 4Å; V493-F563 HydrophobicContact CG2-CB 3.85Å; V493-F563 HydrophobicContact CG2-CD1 3.88Å; V493-F563 HydrophobicContact CG2-CG 4.12Å; K494-F563 WeakPolarHBondContact O-CA 3.4Å; F557-F563 HydrophobicContact CB-CE2 3.78Å; F557-F563 HydrophobicContact CB-CZ 4.4Å; F557-F563 HydrophobicContact CD1-CD2 4.34Å; F557-F563 HydrophobicContact CD1-CE1 4Å; F557-F563 AromaticContact CD1-CE2 3.47Å; F557-F563 HydrophobicContact CD1-CE2 3.47Å; F557-F563 VanDerWaalsContact CD1-CE2 3.47Å; F557-F563 AromaticContact CD1-CZ 3.27Å; F557-F563 HydrophobicContact CD1-CZ 3.27Å; F557-F563 AromaticContact CD2-CD2 3.61Å; F557-F563 HydrophobicContact CD2-CD2 3.61Å; F557-F563 AromaticContact CD2-CE2 3.52Å; F557-F563 HydrophobicContact CD2-CE2 3.52Å; F557-F563 HydrophobicContact CD2-CG 4.23Å; F557-F563 HydrophobicContact CD2-CZ 4.06Å; F557-F563 HydrophobicContact CE1-CD1 4.23Å; F557-F563 HydrophobicContact CE1-CD2 4.49Å; F557-F563 AromaticContact CE1-CE1 3.54Å; F557-F563 HydrophobicContact CE1-CE1 3.54Å; F557-F563 AromaticContact CE1-CE2 3.84Å; F557-F563 HydrophobicContact CE1-CE2 3.84Å; F557-F563 AromaticContact CE1-CZ 3.32Å; F557-F563 HydrophobicContact CE1-CZ 3.32Å; F557-F563 HydrophobicContact CE2-CD1 4.06Å; F557-F563 AromaticContact CE2-CD2 3.73Å; F557-F563 HydrophobicContact CE2-CD2 3.73Å; F557-F563 HydrophobicContact CE2-CE1 4.16Å; F557-F563 AromaticContact CE2-CE2 3.84Å; F557-F563 HydrophobicContact CE2-CE2 3.84Å; F557-F563 AromaticContact CE2-CG 3.86Å; F557-F563 HydrophobicContact CE2-CG 3.86Å; F557-F563 HydrophobicContact CE2-CZ 4.06Å; F557-F563 AromaticContact CG-CD2 3.93Å; F557-F563 HydrophobicContact CG-CD2 3.93Å; F557-F563 AromaticContact CG-CE2 3.31Å; F557-F563 HydrophobicContact CG-CE2 3.31Å; F557-F563 AromaticContact CG-CZ 3.68Å; F557-F563 HydrophobicContact CG-CZ 3.68Å; F557-F563 AromaticContact CZ-CD1 3.83Å; F557-F563 HydrophobicContact CZ-CD1 3.83Å; F557-F563 HydrophobicContact CZ-CD2 4.2Å; F557-F563 AromaticContact CZ-CE1 3.63Å; F557-F563 HydrophobicContact CZ-CE1 3.63Å; F557-F563 HydrophobicContact CZ-CE2 4.01Å; F557-F563 HydrophobicContact CZ-CG 4.13Å; F557-F563 AromaticContact CZ-CZ 3.73Å; F557-F563 HydrophobicContact CZ-CZ 3.73Å; T561-F563 HydrophobicContact CG2-CD2 4.44Å; T561-F563 HydrophobicContact CG2-CE1 4.17Å; T561-F563 HydrophobicContact CG2-CE2 3.77Å; T561-F563 HydrophobicContact CG2-CZ 3.6Å; T561-F563 WeakPolarHBondContact O-CD2 3.44Å; T561-F563 VanDerWaalsContact O-CE2 3.23Å; T561-F563 WeakPolarHBondContact O-CE2 3.22Å
564	Q	93.3	Very high	88.7	Confident	58 Å²	58	55.8 Å²	55.8	27%	0.271	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	124.4	175.8	-170.1	-179.1	20.9	0	0	110.3	I440 V493 K494 L496 R566	I440-Q564 CarbonylContact O-C 3.38Å; I440-Q564 WeakPolarHBondContact O-CA 3.45Å; V493-Q564 CarbonylContact C-O 3.6Å; V493-Q564 VanDerWaalsContact CA-O 3.27Å; V493-Q564 WeakPolarHBondContact CA-O 3.42Å; K494-Q564 PolarHBondContact N-O 3.32Å; K494-Q564 PolarHBondContact O-N 3.49Å; L496-Q564 HydrophobicContact CD1-CB 4.13Å; L496-Q564 HydrophobicContact CD2-CB 4.11Å; L496-Q564 HydrophobicContact CG-CB 4.12Å; Q564-R566 PolarHBondContact O-N 3.42Å
565	V	94.9	Very high	88.9	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	123.4	172.1	-176.4	0	0	0	0	109.6	L439 I440 L443 K444 V491 V493 V568	L439-V565 HydrophobicContact CB-CG2 4.26Å; L439-V565 HydrophobicContact CD2-CG2 4.24Å; I440-V565 PolarHBondContact O-N 2.85Å; L443-V565 HydrophobicContact CB-CB 4.29Å; L443-V565 HydrophobicContact CB-CG1 3.81Å; K444-V565 HydrophobicContact CB-CG2 4.11Å; V491-V565 HydrophobicContact CG1-CG1 3.91Å; V491-V565 HydrophobicContact CG1-CG2 4.35Å; V493-V565 HydrophobicContact CG1-CG2 4.34Å; V565-V568 HydrophobicContact CG1-CG2 3.88Å
566	R	94.2	Very high	89.3	Confident	126 Å²	126	55.2 Å²	55.2	48%	0.475	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-35.5	-177.3	-67.9	-64.1	-63.8	175	0.9	113	L443 V492 K494 Q564	L443-R566 VanDerWaalsContact CD1-C 3.48Å; L443-R566 WeakPolarHBondContact CD1-O 3.23Å; V492-R566 PolarHBondContact O-N 3.02Å; K494-R566 HydrophobicContact CB-CG 3.94Å; Q564-R566 PolarHBondContact O-N 3.42Å
567	S	94.4	Very high	89.7	Confident	19 Å²	19	58.3 Å²	58.3	13%	0.133	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	157.2	173.7	51.4	0	0	0	0	110.6	V492 Y569	V492-S567 WeakPolarHBondContact CB-OG 3.25Å; V492-S567 WeakPolarHBondContact CG2-OG 3.37Å; V492-S567 PolarHBondContact N-O 3.27Å; V492-S567 PolarHBondContact O-N 3.38Å; S567-Y569 WeakPolarHBondContact CB-OH 3.36Å; S567-Y569 WeakPolarHBondContact OG-CE2 3.26Å; S567-Y569 PolarHBondContact OG-OH 2.82Å
568	V	94.9	Very high	90.3	Very high	49 Å²	49	61.2 Å²	61.2	30%	0.297	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130	175.7	-177.9	0	0	0	0	107.3	I489 L490 V491 V565	I489-V568 HydrophobicContact CB-CG1 4.19Å; I489-V568 HydrophobicContact CD1-CG1 3.96Å; I489-V568 HydrophobicContact CG2-CG1 4.42Å; L490-V568 CarbonylContact O-C 3.5Å; L490-V568 WeakPolarHBondContact O-CA 3.36Å; V491-V568 HydrophobicContact CG1-CG2 4.27Å; V491-V568 HydrophobicContact CG2-CG1 4.26Å; V491-V568 HydrophobicContact CG2-CG2 4.27Å; V565-V568 HydrophobicContact CG1-CG2 3.88Å
569	Y	94.9	Very high	91.4	Very high	45 Å²	45	59.3 Å²	59.3	18%	0.176	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123	179.9	-54.2	-69.9	0	0	0	109.8	I489 L490 V492 S567 V597 I598	I489-Y569 CarbonylContact C-O 3.47Å; I489-Y569 WeakPolarHBondContact CA-O 2.87Å; L490-Y569 HydrophobicContact CD2-CD2 4.2Å; L490-Y569 PolarHBondContact N-O 3.41Å; L490-Y569 PolarHBondContact O-N 3.29Å; V492-Y569 HydrophobicContact CG2-CD2 4.24Å; V492-Y569 HydrophobicContact CG2-CE2 3.83Å; S567-Y569 WeakPolarHBondContact CB-OH 3.36Å; S567-Y569 WeakPolarHBondContact OG-CE2 3.26Å; S567-Y569 PolarHBondContact OG-OH 2.82Å; Y569-V597 HydrophobicContact CD1-CG1 3.15Å; Y569-V597 HydrophobicContact CD2-CG1 4.45Å; Y569-V597 HydrophobicContact CE1-CG1 3.11Å; Y569-V597 HydrophobicContact CE2-CG1 4.42Å; Y569-V597 HydrophobicContact CG-CG1 3.85Å; Y569-I598 HydrophobicContact CD2-CG2 4.46Å; Y569-I598 HydrophobicContact CE2-CB 4.15Å; Y569-I598 HydrophobicContact CE2-CD1 4.06Å; Y569-I598 HydrophobicContact CE2-CG2 4.08Å
570	P	94.8	Very high	92.7	Very high	79 Å²	79	61.5 Å²	61.5	51%	0.513	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	142.2	169.8	29.3	-33	0	0	0	109.8	L572 L574	P570-L572 PolarHBondContact O-N 3.09Å; P570-L574 WeakPolarHBondContact O-CD1 3.29Å; P570-L574 VanDerWaalsContact O-CG 3.24Å; P570-L574 WeakPolarHBondContact O-CG 3.42Å
571	F	95.3	Very high	93.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-73.1	-15.7	175.6	-83.6	-65.9	0	0	0	113.6	I485 F486 D488 I489 L490 D573 L574 A615 S618 I619 M622	I485-F571 HydrophobicContact CG2-CE2 3.93Å; I485-F571 HydrophobicContact CG2-CZ 3.81Å; F486-F571 WeakPolarHBondContact O-CE2 3.38Å; D488-F571 PolarHBondContact O-N 3.29Å; I489-F571 VanDerWaalsContact O-CE2 3.28Å; I489-F571 WeakPolarHBondContact O-CE2 3.46Å; L490-F571 HydrophobicContact CB-CE1 4.39Å; L490-F571 HydrophobicContact CB-CE2 4.06Å; L490-F571 HydrophobicContact CB-CZ 3.81Å; F571-D573 PolarHBondContact O-N 3.29Å; F571-L574 HydrophobicContact CD1-CD1 4.09Å; F571-L574 PolarHBondContact O-N 3.18Å; F571-A615 HydrophobicContact CE1-CB 4.1Å; F571-S618 VanDerWaalsContact CD2-CB 3.42Å; F571-I619 HydrophobicContact CB-CG1 4.28Å; F571-I619 HydrophobicContact CD1-CD1 4.36Å; F571-I619 HydrophobicContact CD1-CG1 3.72Å; F571-I619 HydrophobicContact CG-CG1 4.4Å; F571-M622 HydrophobicContact CB-CG 4.03Å
572	L	92.4	Very high	93.5	Very high	77 Å²	77	62.2 Å²	62.2	40%	0.403	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	131.2	173.9	-166	69.2	0	0	0	110.7	P570 L574 M622 Q626	P570-L572 PolarHBondContact O-N 3.09Å; L572-L574 PolarHBondContact O-N 3.45Å; L572-M622 HydrophobicContact CD1-CB 4.43Å; L572-Q626 HydrophobicContact CD1-CB 4Å; L572-Q626 HydrophobicContact CD1-CG 4.23Å
573	D	91.4	Very high	93.3	Very high	82 Å²	82	63.5 Å²	63.5	44%	0.439	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	12.3	-176.5	-168	44.8	0	0	0	115.1	F571 N592 S593	F571-D573 PolarHBondContact O-N 3.29Å; D573-N592 WeakPolarHBondContact O-CA 3.24Å; D573-S593 VanDerWaalsContact OD2-CB 3.29Å; D573-S593 WeakPolarHBondContact OD2-CB 3.13Å; D573-S593 PolarHBondContact OD2-N 2.78Å; D573-S593 VanDerWaalsContact OD2-N 3.12Å; D573-S593 PolarHBondContact OD2-OG 2.97Å
574	L	94.7	Very high	93.2	Very high	7 Å²	7	63.3 Å²	63.3	4%	0.037	31%	0.313	C	S	.	.			trans	-86.2	143.5	173	-66.5	-171.8	0	0	0	112.3	P570 F571 L572 L590 C591 N592 V597 I619	P570-L574 WeakPolarHBondContact O-CD1 3.29Å; P570-L574 VanDerWaalsContact O-CG 3.24Å; P570-L574 WeakPolarHBondContact O-CG 3.42Å; F571-L574 HydrophobicContact CD1-CD1 4.09Å; F571-L574 PolarHBondContact O-N 3.18Å; L572-L574 PolarHBondContact O-N 3.45Å; L574-L590 HydrophobicContact CD1-CD1 4.3Å; L574-C591 CarbonylContact C-O 3.56Å; L574-C591 WeakPolarHBondContact CA-O 3.31Å; L574-N592 HydrophobicContact CD2-CB 4.09Å; L574-V597 HydrophobicContact CD2-CG2 4.12Å; L574-I619 HydrophobicContact CB-CD1 4.21Å; L574-I619 HydrophobicContact CB-CG1 4.33Å; L574-I619 WeakPolarHBondContact O-CD1 3.41Å
575	R	95	Very high	93.1	Very high	153 Å²	153	68 Å²	68	58%	0.577	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.2	170.5	-67.3	-177	-73.7	-157.1	-2.8	109.4	L590 C591	R575-L590 WeakPolarHBondContact O-CA 3.26Å; R575-C591 PolarHBondContact N-O 3.34Å; R575-C591 PolarHBondContact O-N 2.95Å
576	V	96.1	Very high	93.1	Very high	9 Å²	9	70.1 Å²	70.1	6%	0.055	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.7	177.8	-172.4	0	0	0	0	108.9	V588 L590 I612 A615 Y616 I619	V576-V588 HydrophobicContact CG1-CG1 3.66Å; V576-L590 HydrophobicContact CB-CD2 4.37Å; V576-L590 HydrophobicContact CG1-CD2 4.39Å; V576-L590 HydrophobicContact CG2-CD2 3.79Å; V576-I612 HydrophobicContact CG1-CG1 4.2Å; V576-A615 HydrophobicContact CG2-CB 3.96Å; V576-Y616 HydrophobicContact CB-CE2 4.22Å; V576-I619 HydrophobicContact CG2-CD1 3.83Å
577	L	95.4	Very high	93.1	Very high	88 Å²	88	64.1 Å²	64.1	46%	0.461	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.9	170.3	-62	-178.8	0	0	0	109.2	V588 Q589 C591	L577-V588 CarbonylContact O-C 3.58Å; L577-V588 WeakPolarHBondContact O-CA 3.33Å; L577-Q589 HydrophobicContact CB-CB 4.34Å; L577-Q589 PolarHBondContact N-O 2.99Å; L577-Q589 PolarHBondContact O-N 3.46Å; L577-C591 HydrophobicContact CD1-CB 4.46Å; L577-C591 WeakPolarHBondContact CD1-SG 3.43Å
578	V	95.7	Very high	93.2	Very high	76 Å²	76	63.2 Å²	63.2	46%	0.461	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	136.1	175.3	-176.6	0	0	0	0	108.3	I612	V578-I612 HydrophobicContact CG2-CD1 3.51Å; V578-I612 HydrophobicContact CG2-CG1 4.37Å
579	F	94.4	Very high	93.3	Very high	33 Å²	33	62.2 Å²	62.2	15%	0.145	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	157.7	175.8	69.5	-90.3	0	0	0	111.3	I464 I467 Y584 G587 Q589	I464-F579 HydrophobicContact CD1-CE2 4.37Å; I464-F579 HydrophobicContact CD1-CZ 3.71Å; I467-F579 HydrophobicContact CB-CE2 4.33Å; I467-F579 HydrophobicContact CD1-CD1 4.3Å; I467-F579 HydrophobicContact CD1-CE1 4.18Å; I467-F579 HydrophobicContact CD1-CZ 4.32Å; I467-F579 HydrophobicContact CG1-CE1 4.22Å; I467-F579 HydrophobicContact CG1-CE2 4.08Å; I467-F579 HydrophobicContact CG1-CZ 3.87Å; I467-F579 HydrophobicContact CG2-CD2 3.72Å; I467-F579 HydrophobicContact CG2-CE2 3.66Å; I467-F579 HydrophobicContact CG2-CG 4.44Å; I467-F579 HydrophobicContact CG2-CZ 4.33Å; F579-Y584 HydrophobicContact CE2-CD2 4.39Å; F579-G587 PolarHBondContact N-O 3.44Å; F579-G587 CarbonylContact O-C 3.57Å; F579-G587 VanDerWaalsContact O-CA 3.23Å; F579-G587 WeakPolarHBondContact O-CA 3.41Å; F579-G587 PolarHBondContact O-N 3.21Å; F579-G587 VanDerWaalsContact O-N 3.08Å; F579-G587 VanDerWaalsContact O-O 3.06Å; F579-Q589 HydrophobicContact CD1-CB 4.26Å; F579-Q589 HydrophobicContact CE1-CB 4.08Å
580	E	93.7	Very high	93.3	Very high	132 Å²	132	60 Å²	60	62%	0.617	29%	0.29	S	S	*	.			trans	-132.4	134.1	171.1	-179.3	162.6	-176.5	0	0	107.6
581	S	88.5	Confident	93.4	Very high	29 Å²	29	56.9 Å²	56.9	20%	0.203	27%	0.269	C	S	.	.			trans	-136.6	164.8	175.9	82	0	0	0	0	110.1	I467 Y583 Y584	I467-S581 PolarHBondContact O-OG 3.3Å; S581-Y583 PolarHBondContact O-N 3.25Å; S581-Y583 PolarHBondContact OG-N 3.3Å; S581-Y584 PolarHBondContact N-O 2.9Å; S581-Y584 CarbonylContact O-C 3.44Å; S581-Y584 PolarHBondContact O-N 2.99Å; S581-Y584 VanDerWaalsContact O-N 3.09Å; S581-Y584 PolarHBondContact OG-N 3.29Å; S581-Y584 VanDerWaalsContact OG-N 3.14Å
582	N	87.8	Confident	93.3	Very high	168 Å²	168	58.8 Å²	58.8	90%	0.898	28%	0.28	S	S	*	.	S	Bend	trans	-55.3	-17.1	174	-64.6	-20.8	0	0	0	113.4
583	Y	86	Confident	93.2	Very high	90 Å²	90	58.8 Å²	58.8	35%	0.353	29%	0.286	S	S	.	.	S	Bend	trans	-103.3	-30	179.9	-53	-70.6	0	0	0	113.2	A468 P469 L472 S581	A468-Y583 HydrophobicContact CB-CE2 4.44Å; P469-Y583 HydrophobicContact CG-CD1 4.5Å; P469-Y583 HydrophobicContact CG-CD2 4.38Å; P469-Y583 HydrophobicContact CG-CG 4.23Å; L472-Y583 HydrophobicContact CD1-CD1 3.85Å; L472-Y583 HydrophobicContact CD1-CE1 3.75Å; L472-Y583 HydrophobicContact CG-CD1 3.81Å; L472-Y583 HydrophobicContact CG-CE1 4.18Å; S581-Y583 PolarHBondContact O-N 3.25Å; S581-Y583 PolarHBondContact OG-N 3.3Å
584	Y	89.6	Confident	93.3	Very high	5 Å²	5	62 Å²	62	2%	0.02	30%	0.303	C	S	.	.			trans	-136.4	102.6	-172.5	-55.2	-64.6	0	0	0	110.2	I464 K466 I467 P469 P473 F579 S581 N601	I464-Y584 HydrophobicContact CD1-CD1 3.91Å; I464-Y584 HydrophobicContact CD1-CD2 3.87Å; I464-Y584 HydrophobicContact CD1-CE1 4.18Å; I464-Y584 HydrophobicContact CD1-CE2 4.15Å; I464-Y584 HydrophobicContact CD1-CG 3.74Å; I464-Y584 HydrophobicContact CG1-CD1 4.16Å; I464-Y584 HydrophobicContact CG1-CD2 4.5Å; I464-Y584 HydrophobicContact CG1-CE1 3.95Å; I464-Y584 HydrophobicContact CG1-CE2 4.31Å; I464-Y584 HydrophobicContact CG1-CG 4.42Å; I464-Y584 HydrophobicContact CG2-CD2 4.22Å; I464-Y584 HydrophobicContact CG2-CE1 4.45Å; I464-Y584 HydrophobicContact CG2-CE2 3.54Å; K466-Y584 WeakPolarHBondContact O-CE2 3.43Å; I467-Y584 WeakPolarHBondContact O-CD2 3.5Å; I467-Y584 WeakPolarHBondContact O-CE2 2.94Å; P469-Y584 HydrophobicContact CG-CE2 4.41Å; P473-Y584 HydrophobicContact CG-CE1 4.48Å; P473-Y584 WeakPolarHBondContact CG-OH 3.07Å; F579-Y584 HydrophobicContact CE2-CD2 4.39Å; S581-Y584 PolarHBondContact N-O 2.9Å; S581-Y584 CarbonylContact O-C 3.44Å; S581-Y584 PolarHBondContact O-N 2.99Å; S581-Y584 VanDerWaalsContact O-N 3.09Å; S581-Y584 PolarHBondContact OG-N 3.29Å; S581-Y584 VanDerWaalsContact OG-N 3.14Å; Y584-N601 HydrophobicContact CD1-CB 3.81Å; Y584-N601 HydrophobicContact CG-CB 4.42Å
585	R	91.7	Very high	93.2	Very high	157 Å²	157	62.8 Å²	62.8	59%	0.592	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-33.5	-176.9	-165.8	173.9	-179	-179.1	-2.5	113.3	R608	R585-R608 PolarHBondContact O-NH1 3.49Å
586	Y	94.4	Very high	93.1	Very high	48 Å²	48	59.8 Å²	59.8	19%	0.188	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	50.8	-173.8	-48.8	-57.2	0	0	0	110.8	N601 M602 E605	Y586-N601 PolarHBondContact N-OD1 2.9Å; Y586-M602 WeakPolarHBondContact CD2-O 2.95Å; Y586-M602 PolarHBondContact O-N 3.29Å; Y586-E605 HydrophobicContact CD1-CB 4.06Å; Y586-E605 HydrophobicContact CE1-CB 3.78Å; Y586-E605 HydrophobicContact CE1-CG 4.44Å
587	G	94.9	Very high	92.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	136.6	-178.6	0	0	0	0	0	113.3	F579 L600	F579-G587 PolarHBondContact N-O 3.44Å; F579-G587 CarbonylContact O-C 3.57Å; F579-G587 VanDerWaalsContact O-CA 3.23Å; F579-G587 WeakPolarHBondContact O-CA 3.41Å; F579-G587 PolarHBondContact O-N 3.21Å; F579-G587 VanDerWaalsContact O-N 3.08Å; F579-G587 VanDerWaalsContact O-O 3.06Å; G587-L600 CarbonylContact C-O 3.56Å; G587-L600 WeakPolarHBondContact CA-O 3.46Å
588	V	96.5	Very high	92.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137	169.5	-174.4	0	0	0	0	108.8	V576 L577 L600 M602 R608 F611	V576-V588 HydrophobicContact CG1-CG1 3.66Å; L577-V588 CarbonylContact O-C 3.58Å; L577-V588 WeakPolarHBondContact O-CA 3.33Å; V588-L600 PolarHBondContact N-O 3.15Å; V588-L600 PolarHBondContact O-N 3.41Å; V588-M602 HydrophobicContact CB-CE 4.44Å; V588-M602 HydrophobicContact CG2-CE 4.36Å; V588-M602 HydrophobicContact CG2-CG 4.17Å; V588-R608 HydrophobicContact CG2-CG 3.6Å; V588-F611 HydrophobicContact CB-CD1 4.49Å; V588-F611 HydrophobicContact CB-CE1 4.45Å; V588-F611 HydrophobicContact CG1-CD1 3.97Å; V588-F611 HydrophobicContact CG1-CE1 3.71Å; V588-F611 HydrophobicContact CG2-CD1 4.47Å
589	Q	95.5	Very high	92.9	Very high	28 Å²	28	54.4 Å²	54.4	13%	0.131	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.1	175.9	-172.5	174.9	61.4	0	0	109.1	L577 F579 P596 I598 S599	L577-Q589 HydrophobicContact CB-CB 4.34Å; L577-Q589 PolarHBondContact N-O 2.99Å; L577-Q589 PolarHBondContact O-N 3.46Å; F579-Q589 HydrophobicContact CD1-CB 4.26Å; F579-Q589 HydrophobicContact CE1-CB 4.08Å; Q589-P596 VanDerWaalsContact CD-CB 3.48Å; Q589-P596 HydrophobicContact CG-CB 3.98Å; Q589-P596 VanDerWaalsContact NE2-CB 3.27Å; Q589-I598 WeakPolarHBondContact CA-O 3.16Å; Q589-S599 PolarHBondContact NE2-OG 3.09Å
590	L	96	Very high	92.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.1	168.5	-59.9	-178.9	0	0	0	108.5	L490 L574 R575 V576 V597 I598 F611	L490-L590 HydrophobicContact CD2-CD1 3.32Å; L574-L590 HydrophobicContact CD1-CD1 4.3Å; R575-L590 WeakPolarHBondContact O-CA 3.26Å; V576-L590 HydrophobicContact CB-CD2 4.37Å; V576-L590 HydrophobicContact CG1-CD2 4.39Å; V576-L590 HydrophobicContact CG2-CD2 3.79Å; L590-V597 WeakPolarHBondContact O-CB 3.42Å; L590-V597 PolarHBondContact O-N 3.37Å; L590-I598 HydrophobicContact CB-CG2 3.88Å; L590-I598 HydrophobicContact CD1-CG2 3.84Å; L590-I598 HydrophobicContact CG-CG2 4.04Å; L590-I598 PolarHBondContact N-O 3.38Å; L590-I598 PolarHBondContact O-N 3.18Å; L590-F611 HydrophobicContact CD1-CZ 4.17Å; L590-F611 HydrophobicContact CD2-CE1 4.2Å; L590-F611 HydrophobicContact CD2-CZ 4.27Å; L590-F611 HydrophobicContact CG-CZ 4.43Å
591	C	95.5	Very high	92.9	Very high	12 Å²	12	48 Å²	48	8%	0.081	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.9	-178.6	-61.4	0	0	0	0	110.1	L574 R575 L577 G595	L574-C591 CarbonylContact C-O 3.56Å; L574-C591 WeakPolarHBondContact CA-O 3.31Å; R575-C591 PolarHBondContact N-O 3.34Å; R575-C591 PolarHBondContact O-N 2.95Å; L577-C591 HydrophobicContact CD1-CB 4.46Å; L577-C591 WeakPolarHBondContact CD1-SG 3.43Å; C591-G595 CarbonylContact C-O 3.59Å; C591-G595 VanDerWaalsContact CA-O 3.24Å; C591-G595 WeakPolarHBondContact CA-O 3.48Å
592	N	93.9	Very high	93.2	Very high	41 Å²	41	46.7 Å²	46.7	22%	0.219	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-171.8	166.1	63.3	7.9	0	0	0	110.3	D573 L574 N594 G595 V597	D573-N592 WeakPolarHBondContact O-CA 3.24Å; L574-N592 HydrophobicContact CD2-CB 4.09Å; N592-N594 PolarHBondContact O-N 3.41Å; N592-N594 WeakPolarHBondContact OD1-CA 3.38Å; N592-N594 WeakPolarHBondContact OD1-CB 3.15Å; N592-N594 PolarHBondContact OD1-N 2.87Å; N592-G595 PolarHBondContact N-O 3.42Å; N592-G595 PolarHBondContact O-N 3.47Å; N592-G595 VanDerWaalsContact O-N 3.14Å; N592-G595 PolarHBondContact OD1-N 3.15Å; N592-G595 VanDerWaalsContact OD1-N 3.14Å; N592-G595 PolarHBondContact OD1-O 3.37Å; N592-G595 VanDerWaalsContact OD1-O 3.04Å; N592-V597 HydrophobicContact CB-CG2 3.92Å; N592-V597 VanDerWaalsContact CG-CG2 3.48Å
593	S	91.5	Very high	93.4	Very high	77 Å²	77	40.5 Å²	40.5	54%	0.538	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-29.5	171.7	47.2	0	0	0	0	114.1	D573	D573-S593 VanDerWaalsContact OD2-CB 3.29Å; D573-S593 WeakPolarHBondContact OD2-CB 3.13Å; D573-S593 PolarHBondContact OD2-N 2.78Å; D573-S593 VanDerWaalsContact OD2-N 3.12Å; D573-S593 PolarHBondContact OD2-OG 2.97Å
594	N	92.4	Very high	93.7	Very high	149 Å²	149	38.1 Å²	38.1	80%	0.797	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.8	179.8	-61.4	-31.6	0	0	0	114	N592	N592-N594 PolarHBondContact O-N 3.41Å; N592-N594 WeakPolarHBondContact OD1-CA 3.38Å; N592-N594 WeakPolarHBondContact OD1-CB 3.15Å; N592-N594 PolarHBondContact OD1-N 2.87Å
595	G	92.1	Very high	93.9	Very high	24 Å²	24	41.9 Å²	41.9	25%	0.247	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	115.5	-155.6	179.7	0	0	0	0	0	113.7	C591 N592 V597	C591-G595 CarbonylContact C-O 3.59Å; C591-G595 VanDerWaalsContact CA-O 3.24Å; C591-G595 WeakPolarHBondContact CA-O 3.48Å; N592-G595 PolarHBondContact N-O 3.42Å; N592-G595 PolarHBondContact O-N 3.47Å; N592-G595 VanDerWaalsContact O-N 3.14Å; N592-G595 PolarHBondContact OD1-N 3.15Å; N592-G595 VanDerWaalsContact OD1-N 3.14Å; N592-G595 PolarHBondContact OD1-O 3.37Å; N592-G595 VanDerWaalsContact OD1-O 3.04Å; G595-V597 PolarHBondContact O-N 3.04Å
596	P	92.8	Very high	94	Very high	89 Å²	89	37.1 Å²	37.1	58%	0.578	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	128.7	-173.2	29.6	-34.6	0	0	0	112.2	Q589	Q589-P596 VanDerWaalsContact CD-CB 3.48Å; Q589-P596 HydrophobicContact CG-CB 3.98Å; Q589-P596 VanDerWaalsContact NE2-CB 3.27Å
597	V	93.3	Very high	94	Very high	38 Å²	38	35.2 Å²	35.2	23%	0.23	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-45.8	-177.3	177	0	0	0	0	111.3	Y569 L574 L590 N592 G595	Y569-V597 HydrophobicContact CD1-CG1 3.15Å; Y569-V597 HydrophobicContact CD2-CG1 4.45Å; Y569-V597 HydrophobicContact CE1-CG1 3.11Å; Y569-V597 HydrophobicContact CE2-CG1 4.42Å; Y569-V597 HydrophobicContact CG-CG1 3.85Å; L574-V597 HydrophobicContact CD2-CG2 4.12Å; L590-V597 WeakPolarHBondContact O-CB 3.42Å; L590-V597 PolarHBondContact O-N 3.37Å; N592-V597 HydrophobicContact CB-CG2 3.92Å; N592-V597 VanDerWaalsContact CG-CG2 3.48Å; G595-V597 PolarHBondContact O-N 3.04Å
598	I	94.9	Very high	94.1	Very high	8 Å²	8	37 Å²	37	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	138.9	175.9	-174	167.4	0	0	0	110.3	E463 V492 Y569 Q589 L590 L600	E463-I598 HydrophobicContact CG-CD1 4.45Å; V492-I598 HydrophobicContact CG1-CD1 4.49Å; V492-I598 HydrophobicContact CG2-CD1 3.84Å; Y569-I598 HydrophobicContact CD2-CG2 4.46Å; Y569-I598 HydrophobicContact CE2-CB 4.15Å; Y569-I598 HydrophobicContact CE2-CD1 4.06Å; Y569-I598 HydrophobicContact CE2-CG2 4.08Å; Q589-I598 WeakPolarHBondContact CA-O 3.16Å; L590-I598 HydrophobicContact CB-CG2 3.88Å; L590-I598 HydrophobicContact CD1-CG2 3.84Å; L590-I598 HydrophobicContact CG-CG2 4.04Å; L590-I598 PolarHBondContact N-O 3.38Å; L590-I598 PolarHBondContact O-N 3.18Å; I598-L600 HydrophobicContact CD1-CD2 3.71Å; I598-L600 HydrophobicContact CD1-CG 4.41Å; I598-L600 HydrophobicContact CG1-CD2 3.78Å; I598-L600 HydrophobicContact CG1-CG 4.11Å
599	S	95	Very high	94	Very high	15 Å²	15	42.2 Å²	42.2	11%	0.105	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.8	175.7	-50.2	0	0	0	0	109.6	I464 Q589	I464-S599 PolarHBondContact N-O 3.16Å; I464-S599 WeakPolarHBondContact O-CB 3.46Å; Q589-S599 PolarHBondContact NE2-OG 3.09Å
600	L	95.1	Very high	94	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.2	-167.6	-59.9	172	0	0	0	110.6	T461 Q462 I464 L483 G587 V588 I598 M602 F611	T461-L600 HydrophobicContact CG2-CD2 3.76Å; Q462-L600 CarbonylContact O-C 3.54Å; Q462-L600 WeakPolarHBondContact O-CA 3.48Å; I464-L600 WeakPolarHBondContact CD1-O 3.47Å; L483-L600 HydrophobicContact CD1-CD1 3.62Å; L483-L600 HydrophobicContact CD2-CD1 4.31Å; L483-L600 HydrophobicContact CD2-CD2 4.37Å; G587-L600 CarbonylContact C-O 3.56Å; G587-L600 WeakPolarHBondContact CA-O 3.46Å; V588-L600 PolarHBondContact N-O 3.15Å; V588-L600 PolarHBondContact O-N 3.41Å; I598-L600 HydrophobicContact CD1-CD2 3.71Å; I598-L600 HydrophobicContact CD1-CG 4.41Å; I598-L600 HydrophobicContact CG1-CD2 3.78Å; I598-L600 HydrophobicContact CG1-CG 4.11Å; L600-M602 HydrophobicContact CB-CE 4.14Å; L600-M602 HydrophobicContact CD1-CE 3.91Å; L600-F611 HydrophobicContact CD1-CE1 4.42Å; L600-F611 HydrophobicContact CD1-CZ 4.15Å
601	N	94.1	Very high	94	Very high	30 Å²	30	44.4 Å²	44.4	16%	0.16	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	116.1	167	-175.3	48.8	0	0	0	108.6	T461 Q462 I464 Y584 Y586	T461-N601 PolarHBondContact OG1-O 3.36Å; Q462-N601 HydrophobicContact CB-CB 4.31Å; Q462-N601 PolarHBondContact N-O 3.26Å; Q462-N601 PolarHBondContact O-N 3.17Å; I464-N601 HydrophobicContact CD1-CB 3.77Å; I464-N601 HydrophobicContact CG1-CB 4.03Å; Y584-N601 HydrophobicContact CD1-CB 3.81Å; Y584-N601 HydrophobicContact CG-CB 4.42Å; Y586-N601 PolarHBondContact N-OD1 2.9Å
602	M	94.1	Very high	94.1	Very high	1 Å²	1	45 Å²	45	1%	0.005	26%	0.257	C	S	.	.			trans	-76.7	151.1	178.4	-62	-63.9	171.9	0	0	110.8	I459 T461 L483 Y586 V588 L600 S604 R608 F611	I459-M602 HydrophobicContact CG2-SD 3.99Å; T461-M602 PolarHBondContact OG1-SD 3.25Å; T461-M602 VanDerWaalsContact OG1-SD 3.41Å; L483-M602 HydrophobicContact CD1-CE 4.06Å; Y586-M602 WeakPolarHBondContact CD2-O 2.95Å; Y586-M602 PolarHBondContact O-N 3.29Å; V588-M602 HydrophobicContact CB-CE 4.44Å; V588-M602 HydrophobicContact CG2-CE 4.36Å; V588-M602 HydrophobicContact CG2-CG 4.17Å; L600-M602 HydrophobicContact CB-CE 4.14Å; L600-M602 HydrophobicContact CD1-CE 3.91Å; M602-S604 VanDerWaalsContact C-N 3.31Å; M602-S604 PolarHBondContact O-N 3.1Å; M602-R608 HydrophobicContact CB-CB 3.93Å; M602-R608 HydrophobicContact CG-CB 4Å; M602-R608 HydrophobicContact CG-CG 4.38Å; M602-F611 HydrophobicContact CE-CB 3.86Å; M602-F611 HydrophobicContact CE-CD1 3.45Å; M602-F611 VanDerWaalsContact CE-CD1 3.45Å; M602-F611 HydrophobicContact CE-CD2 3.98Å; M602-F611 HydrophobicContact CE-CE1 3.94Å; M602-F611 HydrophobicContact CE-CE2 4.41Å; M602-F611 HydrophobicContact CE-CG 3.45Å; M602-F611 VanDerWaalsContact CE-CG 3.45Å; M602-F611 HydrophobicContact CE-CZ 4.37Å; M602-F611 HydrophobicContact SD-CB 4.44Å
603	P	91.3	Very high	94.1	Very high	38 Å²	38	46.6 Å²	46.6	25%	0.247	27%	0.265	C	S	.	.	S	Bend	trans	-71.4	-26.7	-178.3	26.6	-33.8	0	0	0	113.1	L460 F551 C607	L460-P603 WeakPolarHBondContact O-CD 3.23Å; F551-P603 HydrophobicContact CB-CG 3.78Å; F551-P603 HydrophobicContact CD1-CB 3.66Å; F551-P603 HydrophobicContact CD1-CG 3.56Å; F551-P603 HydrophobicContact CD2-CB 4.46Å; F551-P603 HydrophobicContact CD2-CG 4.49Å; F551-P603 HydrophobicContact CE1-CB 3.83Å; F551-P603 HydrophobicContact CE1-CG 4.26Å; F551-P603 HydrophobicContact CG-CB 3.99Å; F551-P603 HydrophobicContact CG-CG 3.7Å; F551-P603 HydrophobicContact CZ-CB 4.32Å; P603-C607 HydrophobicContact CG-CB 4.01Å
604	S	92.8	Very high	94.4	Very high	40 Å²	40	44.4 Å²	44.4	28%	0.28	25%	0.246	S	C	.	.	S	Bend	trans	-150.5	162.3	-179.6	69.1	0	0	0	0	110.9	M602 A606 C607 R608	M602-S604 VanDerWaalsContact C-N 3.31Å; M602-S604 PolarHBondContact O-N 3.1Å; S604-A606 VanDerWaalsContact C-N 3.27Å; S604-A606 PolarHBondContact O-N 3.1Å; S604-C607 PolarHBondContact O-N 3.42Å; S604-C607 PolarHBondContact OG-N 2.9Å; S604-C607 VanDerWaalsContact OG-N 3.17Å; S604-R608 PolarHBondContact O-N 3.04Å
605	E	94.2	Very high	94.6	Very high	84 Å²	84	37.3 Å²	37.3	39%	0.393	21%	0.208	S	C	.	.	H	α-helix	trans	-62.5	-35.4	173.7	-162.1	-158.7	126.5	0	0	112.2	Y586 R608 R609	Y586-E605 HydrophobicContact CD1-CB 4.06Å; Y586-E605 HydrophobicContact CE1-CB 3.78Å; Y586-E605 HydrophobicContact CE1-CG 4.44Å; E605-R608 WeakPolarHBondContact O-CB 3.11Å; E605-R608 PolarHBondContact O-N 2.75Å; E605-R609 PolarHBondContact O-N 2.68Å; E605-R609 IonicContact OE1-CZ 2.9Å; E605-R609 IonicContact OE1-NE 3.23Å; E605-R609 PolarHBondContact OE1-NE 3.08Å; E605-R609 IonicContact OE1-NH2 3.44Å; E605-R609 PolarHBondContact OE1-NH2 3.29Å
606	A	93.9	Very high	94.7	Very high	57 Å²	57	41.8 Å²	41.8	47%	0.471	22%	0.218	S	C	.	.	H	α-helix	trans	-62.2	-46.3	176	0	0	0	0	0	111.5	S604 R608 R609 Q610	S604-A606 VanDerWaalsContact C-N 3.27Å; S604-A606 PolarHBondContact O-N 3.1Å; A606-R608 VanDerWaalsContact C-N 3.32Å; A606-R608 PolarHBondContact O-N 3.31Å; A606-R609 PolarHBondContact O-N 3.46Å; A606-Q610 WeakPolarHBondContact O-CB 3.32Å; A606-Q610 PolarHBondContact O-N 3.17Å
607	C	94.1	Very high	94.8	Very high	9 Å²	9	39.5 Å²	39.5	6%	0.061	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-32.2	174.9	-87.2	0	0	0	0	112.4	F551 C552 P603 S604 F611	F551-C607 VanDerWaalsContact CB-SG 3.58Å; C552-C607 WeakPolarHBondContact CB-SG 3.48Å; C552-C607 WeakPolarHBondContact SG-CA 3.48Å; C552-C607 WeakPolarHBondContact SG-CB 3.2Å; C552-C607 CovalentContact SG-SG 2.07Å; C552-C607 PolarHBondContact SG-SG 3.41Å; P603-C607 HydrophobicContact CG-CB 4.01Å; S604-C607 PolarHBondContact O-N 3.42Å; S604-C607 PolarHBondContact OG-N 2.9Å; S604-C607 VanDerWaalsContact OG-N 3.17Å; C607-F611 WeakPolarHBondContact O-CB 3.4Å; C607-F611 PolarHBondContact O-N 3.47Å
608	R	96	Very high	95	Very high	38 Å²	38	37.7 Å²	37.7	14%	0.143	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-50.4	171.4	-175.9	172.1	71.7	174.1	-2.2	111.6	R585 V588 M602 S604 E605 A606 F611 I612	R585-R608 PolarHBondContact O-NH1 3.49Å; V588-R608 HydrophobicContact CG2-CG 3.6Å; M602-R608 HydrophobicContact CB-CB 3.93Å; M602-R608 HydrophobicContact CG-CB 4Å; M602-R608 HydrophobicContact CG-CG 4.38Å; S604-R608 PolarHBondContact O-N 3.04Å; E605-R608 WeakPolarHBondContact O-CB 3.11Å; E605-R608 PolarHBondContact O-N 2.75Å; A606-R608 VanDerWaalsContact C-N 3.32Å; A606-R608 PolarHBondContact O-N 3.31Å; R608-F611 PolarHBondContact O-N 2.8Å; R608-I612 HydrophobicContact CG-CD1 3.75Å; R608-I612 WeakPolarHBondContact O-CB 3.26Å; R608-I612 WeakPolarHBondContact O-CD1 3.35Å; R608-I612 WeakPolarHBondContact O-CG1 3.36Å; R608-I612 PolarHBondContact O-N 3.33Å
609	R	95.8	Very high	95	Very high	108 Å²	108	37.8 Å²	37.8	41%	0.408	20%	0.2	S	C	.	.	H	α-helix	trans	-60.5	-47.2	177.4	-77.1	-172.6	-97.2	110.7	-8.1	111.7	E605 A606 F611 I612 D613	E605-R609 PolarHBondContact O-N 2.68Å; E605-R609 IonicContact OE1-CZ 2.9Å; E605-R609 IonicContact OE1-NE 3.23Å; E605-R609 PolarHBondContact OE1-NE 3.08Å; E605-R609 IonicContact OE1-NH2 3.44Å; E605-R609 PolarHBondContact OE1-NH2 3.29Å; A606-R609 PolarHBondContact O-N 3.46Å; R609-F611 PolarHBondContact O-N 3.45Å; R609-I612 WeakPolarHBondContact O-CB 3.31Å; R609-I612 PolarHBondContact O-N 3.08Å; R609-I612 VanDerWaalsContact O-N 3.17Å; R609-D613 PolarHBondContact O-N 3.47Å
610	Q	95.4	Very high	95	Very high	74 Å²	74	38.2 Å²	38.2	35%	0.346	20%	0.204	S	C	.	.	H	α-helix	trans	-61	-43.1	178.7	-168.3	64	58.6	0	0	112.8	A606 I612 D613 W614	A606-Q610 WeakPolarHBondContact O-CB 3.32Å; A606-Q610 PolarHBondContact O-N 3.17Å; Q610-I612 VanDerWaalsContact C-N 3.33Å; Q610-D613 PolarHBondContact O-N 3.1Å; Q610-W614 HydrophobicContact CG-CD2 4.11Å; Q610-W614 HydrophobicContact CG-CE3 4.3Å; Q610-W614 HydrophobicContact CG-CH2 3.91Å; Q610-W614 HydrophobicContact CG-CZ2 3.67Å; Q610-W614 HydrophobicContact CG-CZ3 4.24Å; Q610-W614 PolarHBondContact O-N 3.29Å; Q610-W614 VanDerWaalsContact O-N 3.08Å
611	F	96.3	Very high	95.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-46.2	175.3	177	-107.6	0	0	0	111.5	I459 L483 I485 L490 V588 L590 L600 M602 C607 R608 R609 W614 A615	I459-F611 HydrophobicContact CD1-CB 3.49Å; I459-F611 VanDerWaalsContact CD1-CB 3.49Å; I459-F611 HydrophobicContact CD1-CD2 4.04Å; I459-F611 HydrophobicContact CD1-CG 4.25Å; L483-F611 HydrophobicContact CD1-CD2 3.84Å; L483-F611 HydrophobicContact CD1-CE2 3.47Å; L483-F611 VanDerWaalsContact CD1-CE2 3.47Å; L483-F611 HydrophobicContact CD1-CZ 4.1Å; I485-F611 HydrophobicContact CD1-CD2 4.37Å; I485-F611 HydrophobicContact CG1-CD2 4.38Å; I485-F611 HydrophobicContact CG1-CE2 4.31Å; L490-F611 HydrophobicContact CD1-CE2 4.43Å; V588-F611 HydrophobicContact CB-CD1 4.49Å; V588-F611 HydrophobicContact CB-CE1 4.45Å; V588-F611 HydrophobicContact CG1-CD1 3.97Å; V588-F611 HydrophobicContact CG1-CE1 3.71Å; V588-F611 HydrophobicContact CG2-CD1 4.47Å; L590-F611 HydrophobicContact CD1-CZ 4.17Å; L590-F611 HydrophobicContact CD2-CE1 4.2Å; L590-F611 HydrophobicContact CD2-CZ 4.27Å; L590-F611 HydrophobicContact CG-CZ 4.43Å; L600-F611 HydrophobicContact CD1-CE1 4.42Å; L600-F611 HydrophobicContact CD1-CZ 4.15Å; M602-F611 HydrophobicContact CE-CB 3.86Å; M602-F611 HydrophobicContact CE-CD1 3.45Å; M602-F611 VanDerWaalsContact CE-CD1 3.45Å; M602-F611 HydrophobicContact CE-CD2 3.98Å; M602-F611 HydrophobicContact CE-CE1 3.94Å; M602-F611 HydrophobicContact CE-CE2 4.41Å; M602-F611 HydrophobicContact CE-CG 3.45Å; M602-F611 VanDerWaalsContact CE-CG 3.45Å; M602-F611 HydrophobicContact CE-CZ 4.37Å; M602-F611 HydrophobicContact SD-CB 4.44Å; C607-F611 WeakPolarHBondContact O-CB 3.4Å; C607-F611 PolarHBondContact O-N 3.47Å; R608-F611 PolarHBondContact O-N 2.8Å; R609-F611 PolarHBondContact O-N 3.45Å; F611-W614 PolarHBondContact O-N 3.19Å; F611-A615 HydrophobicContact CE1-CB 4.46Å; F611-A615 HydrophobicContact CZ-CB 4.45Å; F611-A615 VanDerWaalsContact O-CB 3.29Å; F611-A615 WeakPolarHBondContact O-CB 3.48Å; F611-A615 PolarHBondContact O-N 3.31Å
612	I	96.6	Very high	95.1	Very high	25 Å²	25	37.7 Å²	37.7	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-47.5	180	-72.9	167.5	0	0	0	110.1	V576 V578 R608 R609 Q610 W614 A615 Y616	V576-I612 HydrophobicContact CG1-CG1 4.2Å; V578-I612 HydrophobicContact CG2-CD1 3.51Å; V578-I612 HydrophobicContact CG2-CG1 4.37Å; R608-I612 HydrophobicContact CG-CD1 3.75Å; R608-I612 WeakPolarHBondContact O-CB 3.26Å; R608-I612 WeakPolarHBondContact O-CD1 3.35Å; R608-I612 WeakPolarHBondContact O-CG1 3.36Å; R608-I612 PolarHBondContact O-N 3.33Å; R609-I612 WeakPolarHBondContact O-CB 3.31Å; R609-I612 PolarHBondContact O-N 3.08Å; R609-I612 VanDerWaalsContact O-N 3.17Å; Q610-I612 VanDerWaalsContact C-N 3.33Å; I612-W614 PolarHBondContact O-N 3.12Å; I612-A615 PolarHBondContact O-N 3.35Å; I612-Y616 HydrophobicContact CG2-CD2 3.36Å; I612-Y616 HydrophobicContact CG2-CE2 3.39Å; I612-Y616 WeakPolarHBondContact O-CB 3.2Å; I612-Y616 VanDerWaalsContact O-CD2 3.3Å; I612-Y616 WeakPolarHBondContact O-CD2 3.41Å; I612-Y616 PolarHBondContact O-N 3.38Å
613	D	94.9	Very high	95.2	Very high	74 Å²	74	41.5 Å²	41.5	40%	0.396	22%	0.219	S	C	.	.	H	α-helix	trans	-60.6	-44.4	179.3	-69.4	-17.6	0	0	0	111.8	R609 Q610 G617	R609-D613 PolarHBondContact O-N 3.47Å; Q610-D613 PolarHBondContact O-N 3.1Å; D613-G617 PolarHBondContact O-N 2.89Å
614	W	96.2	Very high	95.3	Very high	32 Å²	32	40.9 Å²	40.9	12%	0.121	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-45.7	176	-69.4	-19.8	0	0	0	112.6	I456 I459 I485 T554 Q610 F611 I612 G617 S618	I456-W614 HydrophobicContact CG2-CB 3.92Å; I456-W614 VanDerWaalsContact CG2-CD1 3.41Å; I456-W614 HydrophobicContact CG2-CD2 3.89Å; I456-W614 HydrophobicContact CG2-CG 3.48Å; I456-W614 VanDerWaalsContact CG2-CG 3.48Å; I459-W614 HydrophobicContact CD1-CE3 3.76Å; I459-W614 HydrophobicContact CD1-CZ3 3.64Å; I459-W614 HydrophobicContact CG1-CE3 4.06Å; I459-W614 HydrophobicContact CG1-CH2 4.5Å; I459-W614 HydrophobicContact CG1-CZ3 3.51Å; I485-W614 HydrophobicContact CD1-CE3 3.75Å; I485-W614 HydrophobicContact CD1-CZ3 4.14Å; I485-W614 HydrophobicContact CG1-CE3 4.3Å; I485-W614 HydrophobicContact CG2-CB 4.14Å; T554-W614 HydrophobicContact CG2-CH2 4.42Å; T554-W614 HydrophobicContact CG2-CZ2 3.78Å; Q610-W614 HydrophobicContact CG-CD2 4.11Å; Q610-W614 HydrophobicContact CG-CE3 4.3Å; Q610-W614 HydrophobicContact CG-CH2 3.91Å; Q610-W614 HydrophobicContact CG-CZ2 3.67Å; Q610-W614 HydrophobicContact CG-CZ3 4.24Å; Q610-W614 PolarHBondContact O-N 3.29Å; Q610-W614 VanDerWaalsContact O-N 3.08Å; F611-W614 PolarHBondContact O-N 3.19Å; I612-W614 PolarHBondContact O-N 3.12Å; W614-G617 PolarHBondContact O-N 3.22Å; W614-S618 PolarHBondContact O-N 2.89Å; W614-S618 PolarHBondContact O-OG 3.39Å
615	A	96.7	Very high	95.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-45.8	-179.7	0	0	0	0	0	111.8	F571 V576 F611 I612 G617 S618 I619	F571-A615 HydrophobicContact CE1-CB 4.1Å; V576-A615 HydrophobicContact CG2-CB 3.96Å; F611-A615 HydrophobicContact CE1-CB 4.46Å; F611-A615 HydrophobicContact CZ-CB 4.45Å; F611-A615 VanDerWaalsContact O-CB 3.29Å; F611-A615 WeakPolarHBondContact O-CB 3.48Å; F611-A615 PolarHBondContact O-N 3.31Å; I612-A615 PolarHBondContact O-N 3.35Å; A615-G617 VanDerWaalsContact C-N 3.33Å; A615-G617 PolarHBondContact O-N 3.12Å; A615-S618 PolarHBondContact O-N 3.36Å; A615-I619 WeakPolarHBondContact O-CB 3.42Å; A615-I619 WeakPolarHBondContact O-CD1 3.09Å; A615-I619 WeakPolarHBondContact O-CG1 3.39Å; A615-I619 PolarHBondContact O-N 2.98Å
616	Y	95.2	Very high	95.4	Very high	118 Å²	118	39 Å²	39	46%	0.463	20%	0.199	S	C	.	.	H	α-helix	trans	-63.1	-39.9	175.5	-84.9	-62.5	0	0	0	112	V576 I612 S618 I619 A620	V576-Y616 HydrophobicContact CB-CE2 4.22Å; I612-Y616 HydrophobicContact CG2-CD2 3.36Å; I612-Y616 HydrophobicContact CG2-CE2 3.39Å; I612-Y616 WeakPolarHBondContact O-CB 3.2Å; I612-Y616 VanDerWaalsContact O-CD2 3.3Å; I612-Y616 WeakPolarHBondContact O-CD2 3.41Å; I612-Y616 PolarHBondContact O-N 3.38Å; Y616-S618 PolarHBondContact O-N 3.33Å; Y616-I619 PolarHBondContact O-N 2.85Å; Y616-A620 VanDerWaalsContact O-CB 3.25Å; Y616-A620 WeakPolarHBondContact O-CB 3.43Å; Y616-A620 PolarHBondContact O-N 3.46Å
617	G	94.7	Very high	95.3	Very high	41 Å²	41	41 Å²	41	42%	0.423	20%	0.199	S	C	.	.	H	α-helix	trans	-57.4	-48.1	174	0	0	0	0	0	112.3	D613 W614 A615 E621	D613-G617 PolarHBondContact O-N 2.89Å; W614-G617 PolarHBondContact O-N 3.22Å; A615-G617 VanDerWaalsContact C-N 3.33Å; A615-G617 PolarHBondContact O-N 3.12Å; G617-E621 PolarHBondContact O-N 3.09Å
618	S	96.9	Very high	95.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-44.4	177.5	-63.5	0	0	0	0	113.1	I456 F486 N487 F571 W614 A615 Y616 A620 E621 M622	I456-S618 WeakPolarHBondContact CD1-OG 3.42Å; F486-S618 PolarHBondContact O-OG 3.45Å; N487-S618 WeakPolarHBondContact O-CB 3.32Å; F571-S618 VanDerWaalsContact CD2-CB 3.42Å; W614-S618 PolarHBondContact O-N 2.89Å; W614-S618 PolarHBondContact O-OG 3.39Å; A615-S618 PolarHBondContact O-N 3.36Å; Y616-S618 PolarHBondContact O-N 3.33Å; S618-A620 PolarHBondContact O-N 2.92Å; S618-E621 PolarHBondContact O-N 3.22Å; S618-M622 WeakPolarHBondContact O-CG 3.46Å; S618-M622 PolarHBondContact O-N 2.89Å
619	I	96.5	Very high	94.9	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.046	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-48.2	177.8	-68.6	161.4	0	0	0	110.1	F571 L574 V576 A615 Y616 E621 M622 E623	F571-I619 HydrophobicContact CB-CG1 4.28Å; F571-I619 HydrophobicContact CD1-CD1 4.36Å; F571-I619 HydrophobicContact CD1-CG1 3.72Å; F571-I619 HydrophobicContact CG-CG1 4.4Å; L574-I619 HydrophobicContact CB-CD1 4.21Å; L574-I619 HydrophobicContact CB-CG1 4.33Å; L574-I619 WeakPolarHBondContact O-CD1 3.41Å; V576-I619 HydrophobicContact CG2-CD1 3.83Å; A615-I619 WeakPolarHBondContact O-CB 3.42Å; A615-I619 WeakPolarHBondContact O-CD1 3.09Å; A615-I619 WeakPolarHBondContact O-CG1 3.39Å; A615-I619 PolarHBondContact O-N 2.98Å; Y616-I619 PolarHBondContact O-N 2.85Å; I619-E621 PolarHBondContact O-N 3.49Å; I619-M622 PolarHBondContact O-N 2.96Å; I619-M622 VanDerWaalsContact O-N 3.15Å; I619-E623 HydrophobicContact CG2-CG 4.35Å; I619-E623 WeakPolarHBondContact O-CG 3.35Å; I619-E623 PolarHBondContact O-N 3.06Å
620	A	94.9	Very high	94.5	Very high	24 Å²	24	44.5 Å²	44.5	20%	0.198	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-43.9	178.5	0	0	0	0	0	111.6	R234 Y616 S618 M622 E623 E624	R234-A620 HydrophobicContact CG-CB 4.42Å; R234-A620 PolarHBondContact NE-O 3.08Å; R234-A620 PolarHBondContact NH2-O 3.38Å; Y616-A620 VanDerWaalsContact O-CB 3.25Å; Y616-A620 WeakPolarHBondContact O-CB 3.43Å; Y616-A620 PolarHBondContact O-N 3.46Å; S618-A620 PolarHBondContact O-N 2.92Å; A620-M622 VanDerWaalsContact C-N 3.32Å; A620-M622 PolarHBondContact O-N 3.23Å; A620-E623 PolarHBondContact O-N 3.31Å; A620-E624 WeakPolarHBondContact O-CB 3.5Å; A620-E624 PolarHBondContact O-N 3.02Å
621	E	95.9	Very high	94	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.019	23%	0.226	C	C	.	.	H	α-helix	trans	-58.8	-43.6	174.9	-166.8	-175.7	132.3	0	0	111.4	L237 A238 T241 R454 N487 G617 S618 I619 E624 L625	L237-E621 HydrophobicContact CB-CG 4.34Å; A238-E621 HydrophobicContact CB-CG 4.48Å; T241-E621 PolarHBondContact OG1-OE1 3.05Å; R454-E621 IonicContact CZ-OE2 3.15Å; R454-E621 IonicContact NH2-OE2 3.97Å; R454-E621 PolarHBondContact NH2-OE2 3.49Å; N487-E621 PolarHBondContact ND2-OE1 2.88Å; G617-E621 PolarHBondContact O-N 3.09Å; S618-E621 PolarHBondContact O-N 3.22Å; I619-E621 PolarHBondContact O-N 3.49Å; E621-E624 WeakPolarHBondContact O-CB 3.43Å; E621-E624 PolarHBondContact O-N 3.29Å; E621-L625 WeakPolarHBondContact O-CG 2.72Å; E621-L625 PolarHBondContact O-N 3.1Å; E621-L625 VanDerWaalsContact O-N 3.14Å
622	M	95.8	Very high	93.3	Very high	16 Å²	16	48.4 Å²	48.4	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-70.2	-38.1	-179.2	-69.5	-53.1	93.5	0	0	113.8	D488 F571 L572 S618 I619 A620 E624 L625 Q626	D488-M622 HydrophobicContact CB-CE 4.45Å; D488-M622 HydrophobicContact CB-SD 3.82Å; F571-M622 HydrophobicContact CB-CG 4.03Å; L572-M622 HydrophobicContact CD1-CB 4.43Å; S618-M622 WeakPolarHBondContact O-CG 3.46Å; S618-M622 PolarHBondContact O-N 2.89Å; I619-M622 PolarHBondContact O-N 2.96Å; I619-M622 VanDerWaalsContact O-N 3.15Å; A620-M622 VanDerWaalsContact C-N 3.32Å; A620-M622 PolarHBondContact O-N 3.23Å; M622-E624 VanDerWaalsContact C-N 3.33Å; M622-L625 HydrophobicContact CE-CD1 3.31Å; M622-L625 HydrophobicContact CE-CG 4.35Å; M622-L625 PolarHBondContact O-N 3.15Å; M622-L625 HydrophobicContact SD-CD1 4.12Å; M622-Q626 WeakPolarHBondContact O-CB 2.79Å; M622-Q626 PolarHBondContact O-N 3.26Å
623	E	94.5	Very high	92.4	Very high	81 Å²	81	53.9 Å²	53.9	38%	0.379	27%	0.265	S	S	.	.	H	α-helix	trans	-61.6	-41.4	172.5	-76.7	175.4	175.7	0	0	111.8	R234 I619 A620 L625 Q626 Q627	R234-E623 IonicContact NH2-OE2 2.79Å; R234-E623 PolarHBondContact NH2-OE2 2.86Å; I619-E623 HydrophobicContact CG2-CG 4.35Å; I619-E623 WeakPolarHBondContact O-CG 3.35Å; I619-E623 PolarHBondContact O-N 3.06Å; A620-E623 PolarHBondContact O-N 3.31Å; E623-L625 PolarHBondContact O-N 3.46Å; E623-Q626 PolarHBondContact O-N 3.01Å; E623-Q627 WeakPolarHBondContact O-CG 3.29Å; E623-Q627 PolarHBondContact O-N 3.27Å
624	E	94.5	Very high	91.3	Very high	25 Å²	25	52.2 Å²	52.2	12%	0.117	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-45.8	177.4	-174.8	65.2	-151	0	0	110.9	R234 A238 Y253 A620 E621 M622 Q626 Q627 H628	R234-E624 HydrophobicContact CG-CB 4.34Å; R234-E624 IonicContact CZ-OE2 2.83Å; R234-E624 IonicContact NE-OE2 2.8Å; A238-E624 HydrophobicContact CB-CB 4.06Å; A238-E624 HydrophobicContact CB-CG 3.59Å; Y253-E624 WeakPolarHBondContact OH-CG 3.39Å; Y253-E624 PolarHBondContact OH-OE1 3.19Å; A620-E624 WeakPolarHBondContact O-CB 3.5Å; A620-E624 PolarHBondContact O-N 3.02Å; E621-E624 WeakPolarHBondContact O-CB 3.43Å; E621-E624 PolarHBondContact O-N 3.29Å; M622-E624 VanDerWaalsContact C-N 3.33Å; E624-Q626 VanDerWaalsContact C-N 3.33Å; E624-Q626 PolarHBondContact O-N 3.07Å; E624-Q627 PolarHBondContact O-N 3.45Å; E624-H628 PolarHBondContact O-N 2.77Å
625	L	94.7	Very high	90.2	Very high	5 Å²	5	54.7 Å²	54.7	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-38.2	176.1	-68.1	178.3	0	0	0	112.5	A238 T241 L242 E621 M622 E623 H628 Q629	A238-L625 HydrophobicContact CB-CD2 3.92Å; A238-L625 HydrophobicContact CB-CG 4.25Å; A238-L625 WeakPolarHBondContact O-CD2 3.35Å; T241-L625 HydrophobicContact CG2-CD1 3.5Å; T241-L625 VanDerWaalsContact CG2-CD1 3.5Å; L242-L625 HydrophobicContact CD1-CD2 4.07Å; L242-L625 HydrophobicContact CD2-CD2 3.78Å; L242-L625 HydrophobicContact CG-CD2 3.53Å; E621-L625 WeakPolarHBondContact O-CG 2.72Å; E621-L625 PolarHBondContact O-N 3.1Å; E621-L625 VanDerWaalsContact O-N 3.14Å; M622-L625 HydrophobicContact CE-CD1 3.31Å; M622-L625 HydrophobicContact CE-CG 4.35Å; M622-L625 PolarHBondContact O-N 3.15Å; M622-L625 HydrophobicContact SD-CD1 4.12Å; E623-L625 PolarHBondContact O-N 3.46Å; L625-H628 PolarHBondContact O-N 3.06Å; L625-Q629 WeakPolarHBondContact O-CG 3.38Å; L625-Q629 PolarHBondContact O-N 2.85Å
626	Q	94	Very high	88.6	Confident	78 Å²	78	58 Å²	58	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-65.8	-43.5	177.8	-172	-179.3	34	0	0	111.3	L572 M622 E623 E624 H628 Q629 Q630	L572-Q626 HydrophobicContact CD1-CB 4Å; L572-Q626 HydrophobicContact CD1-CG 4.23Å; M622-Q626 WeakPolarHBondContact O-CB 2.79Å; M622-Q626 PolarHBondContact O-N 3.26Å; E623-Q626 PolarHBondContact O-N 3.01Å; E624-Q626 VanDerWaalsContact C-N 3.33Å; E624-Q626 PolarHBondContact O-N 3.07Å; Q626-H628 VanDerWaalsContact C-N 3.35Å; Q626-H628 PolarHBondContact O-N 3.16Å; Q626-Q629 PolarHBondContact O-N 3.45Å; Q626-Q630 WeakPolarHBondContact O-CG 3.31Å; Q626-Q630 PolarHBondContact O-N 2.95Å
627	Q	92.3	Very high	86.9	Confident	101 Å²	101	58.3 Å²	58.3	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-59.8	-45.9	175.3	-70.9	174.2	26.4	0	0	110.9	E623 E624 Q629 Q630 V631	E623-Q627 WeakPolarHBondContact O-CG 3.29Å; E623-Q627 PolarHBondContact O-N 3.27Å; E624-Q627 PolarHBondContact O-N 3.45Å; Q627-Q629 VanDerWaalsContact C-N 3.33Å; Q627-Q629 PolarHBondContact O-N 3.06Å; Q627-Q630 PolarHBondContact O-N 3.46Å; Q627-Q630 VanDerWaalsContact O-N 3.16Å; Q627-V631 WeakPolarHBondContact O-CG2 3.48Å; Q627-V631 PolarHBondContact O-N 2.98Å
628	H	91.9	Very high	85.2	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-42.7	176.8	-175.4	56.9	0	0	0	112.6	E249 Y253 E624 L625 Q626 Q630 V631 K632	E249-H628 IonicContact OE1-CD2 3.88Å; E249-H628 IonicContact OE1-NE2 2.78Å; Y253-H628 HydrophobicContact CD2-CB 4.39Å; Y253-H628 AromaticContact CD2-CD2 3.99Å; Y253-H628 AromaticContact CD2-CE1 3.66Å; Y253-H628 AromaticContact CD2-CG 3.69Å; Y253-H628 AromaticContact CD2-ND1 3.48Å; Y253-H628 WeakPolarHBondContact CD2-ND1 3.46Å; Y253-H628 AromaticContact CD2-NE2 3.97Å; Y253-H628 HydrophobicContact CE2-CB 4.07Å; Y253-H628 AromaticContact CE2-CG 3.86Å; Y253-H628 AromaticContact CE2-ND1 3.84Å; E624-H628 PolarHBondContact O-N 2.77Å; L625-H628 PolarHBondContact O-N 3.06Å; Q626-H628 VanDerWaalsContact C-N 3.35Å; Q626-H628 PolarHBondContact O-N 3.16Å; H628-Q630 VanDerWaalsContact C-N 3.35Å; H628-Q630 PolarHBondContact O-N 2.95Å; H628-V631 PolarHBondContact O-N 2.92Å; H628-K632 WeakPolarHBondContact O-CB 3.27Å; H628-K632 PolarHBondContact O-N 3.36Å
629	Q	89.6	Confident	83.4	Confident	86 Å²	86	67.4 Å²	67.4	40%	0.402	33%	0.331	S	S	.	.	H	α-helix	trans	-64.3	-37	176.9	-73.6	-179.2	1.6	0	0	113	L625 Q626 Q627 K633	L625-Q629 WeakPolarHBondContact O-CG 3.38Å; L625-Q629 PolarHBondContact O-N 2.85Å; Q626-Q629 PolarHBondContact O-N 3.45Å; Q627-Q629 VanDerWaalsContact C-N 3.33Å; Q627-Q629 PolarHBondContact O-N 3.06Å; Q629-K633 WeakPolarHBondContact O-CG 3.4Å; Q629-K633 PolarHBondContact O-N 3.4Å
630	Q	87	Confident	81.4	Confident	117 Å²	117	72 Å²	72	55%	0.547	36%	0.355	S	S	.	.	H	α-helix	trans	-66.7	-45.9	176.2	-71.8	176	1.5	0	0	111.5	Q626 Q627 H628 K632 K633 S634	Q626-Q630 WeakPolarHBondContact O-CG 3.31Å; Q626-Q630 PolarHBondContact O-N 2.95Å; Q627-Q630 PolarHBondContact O-N 3.46Å; Q627-Q630 VanDerWaalsContact O-N 3.16Å; H628-Q630 VanDerWaalsContact C-N 3.35Å; H628-Q630 PolarHBondContact O-N 2.95Å; Q630-K632 VanDerWaalsContact C-N 3.34Å; Q630-K632 PolarHBondContact O-N 2.79Å; Q630-K633 PolarHBondContact O-N 3.38Å; Q630-S634 PolarHBondContact O-N 3.35Å
631	V	85.1	Confident	79.6	Confident	73 Å²	73	75.3 Å²	75.3	44%	0.442	37%	0.368	S	S	.	.	H	α-helix	trans	-57.7	-48.7	176.1	174.3	0	0	0	0	110.2	Q627 H628 K633 S634 E635	Q627-V631 WeakPolarHBondContact O-CG2 3.48Å; Q627-V631 PolarHBondContact O-N 2.98Å; H628-V631 PolarHBondContact O-N 2.92Å; V631-K633 PolarHBondContact O-N 3.34Å; V631-S634 PolarHBondContact O-N 3.49Å; V631-S634 VanDerWaalsContact O-N 3.14Å; V631-S634 PolarHBondContact O-OG 3.43Å; V631-E635 HydrophobicContact CG1-CG 4.47Å; V631-E635 WeakPolarHBondContact O-CG 3.48Å; V631-E635 PolarHBondContact O-N 3.13Å
632	K	81.3	Confident	77.7	Confident	83 Å²	83	78.5 Å²	78.5	36%	0.361	39%	0.387	S	S	.	.	H	α-helix	trans	-59.2	-44	178.8	-170.9	-178.7	-174.1	179.9	0	113	E249 H628 Q630 S634 E635 C636	E249-K632 IonicContact OE1-NZ 2.6Å; E249-K632 PolarHBondContact OE1-NZ 2.84Å; E249-K632 IonicContact OE2-NZ 2.62Å; E249-K632 PolarHBondContact OE2-NZ 3.26Å; H628-K632 WeakPolarHBondContact O-CB 3.27Å; H628-K632 PolarHBondContact O-N 3.36Å; Q630-K632 VanDerWaalsContact C-N 3.34Å; Q630-K632 PolarHBondContact O-N 2.79Å; K632-S634 VanDerWaalsContact C-N 3.33Å; K632-S634 PolarHBondContact O-N 2.93Å; K632-E635 PolarHBondContact O-N 3.38Å; K632-C636 PolarHBondContact O-N 3.41Å; K632-C636 PolarHBondContact O-SG 3.38Å; K632-C636 VanDerWaalsContact O-SG 3.34Å
633	K	77.3	Confident	75.4	Confident	139 Å²	139	82.3 Å²	82.3	60%	0.604	41%	0.408	S	S	*	.	H	α-helix	trans	-59.7	-44.3	175.9	-75.8	176.2	-179.3	-178.2	0	111.3	Q629 Q630 V631 E635 C636 E637	Q629-K633 WeakPolarHBondContact O-CG 3.4Å; Q629-K633 PolarHBondContact O-N 3.4Å; Q630-K633 PolarHBondContact O-N 3.38Å; V631-K633 PolarHBondContact O-N 3.34Å; K633-E635 PolarHBondContact O-N 2.94Å; K633-C636 PolarHBondContact O-N 3.4Å; K633-E637 WeakPolarHBondContact O-CG 3.49Å; K633-E637 PolarHBondContact O-N 3.17Å
634	S	71.9	Confident	73	Confident	40 Å²	40	82.8 Å²	82.8	28%	0.28	42%	0.419	S	S	.	.	H	α-helix	trans	-65.6	-35.5	178.3	76	0	0	0	0	113.3	Q630 V631 K632 R638	Q630-S634 PolarHBondContact O-N 3.35Å; V631-S634 PolarHBondContact O-N 3.49Å; V631-S634 VanDerWaalsContact O-N 3.14Å; V631-S634 PolarHBondContact O-OG 3.43Å; K632-S634 VanDerWaalsContact C-N 3.33Å; K632-S634 PolarHBondContact O-N 2.93Å; S634-R638 VanDerWaalsContact O-CG 3.31Å; S634-R638 WeakPolarHBondContact O-CG 3.41Å; S634-R638 PolarHBondContact O-N 3.26Å
635	E	72.6	Confident	70.8	Confident	84 Å²	84	89.9 Å²	89.9	39%	0.393	45%	0.45	S	S	.	.	H	α-helix	trans	-67.6	-41.6	174.6	-72.8	177.9	171.2	0	0	112	V631 K632 K633 R638 T639	V631-E635 HydrophobicContact CG1-CG 4.47Å; V631-E635 WeakPolarHBondContact O-CG 3.48Å; V631-E635 PolarHBondContact O-N 3.13Å; K632-E635 PolarHBondContact O-N 3.38Å; K633-E635 PolarHBondContact O-N 2.94Å; E635-R638 PolarHBondContact O-N 3.47Å; E635-T639 WeakPolarHBondContact O-CB 3.18Å; E635-T639 PolarHBondContact O-N 3.05Å; E635-T639 PolarHBondContact O-OG1 3.02Å
636	C	64.5	Low	68.4	Low	69 Å²	69	97.9 Å²	97.9	47%	0.466	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-45.5	174.7	-70.4	0	0	0	0	111.4	K632 K633 T639 I640	K632-C636 PolarHBondContact O-N 3.41Å; K632-C636 PolarHBondContact O-SG 3.38Å; K632-C636 VanDerWaalsContact O-SG 3.34Å; K633-C636 PolarHBondContact O-N 3.4Å; C636-T639 PolarHBondContact O-N 3.41Å; C636-I640 WeakPolarHBondContact O-CG1 3.25Å; C636-I640 PolarHBondContact O-N 2.92Å
637	E	58.4	Low	65.6	Low	124 Å²	124	97.3 Å²	97.3	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-61	-45.1	176.5	-74.2	173.9	-177.9	0	0	112	K633 T639 I640 I641	K633-E637 WeakPolarHBondContact O-CG 3.49Å; K633-E637 PolarHBondContact O-N 3.17Å; E637-T639 VanDerWaalsContact C-N 3.31Å; E637-T639 PolarHBondContact O-N 3.27Å; E637-I640 PolarHBondContact O-N 3.17Å; E637-I641 VanDerWaalsContact O-CG1 3.31Å; E637-I641 WeakPolarHBondContact O-CG1 3.5Å; E637-I641 PolarHBondContact O-N 2.97Å
638	R	59.8	Low	63.1	Low	155 Å²	155	98.4 Å²	98.4	59%	0.585	50%	0.5	S	S	*	.	H	α-helix	trans	-59.4	-41.2	174.8	-74.4	174.8	-176.5	163.3	1.6	112.2	S634 E635 I641 V642	S634-R638 VanDerWaalsContact O-CG 3.31Å; S634-R638 WeakPolarHBondContact O-CG 3.41Å; S634-R638 PolarHBondContact O-N 3.26Å; E635-R638 PolarHBondContact O-N 3.47Å; R638-I641 PolarHBondContact O-N 3.43Å; R638-V642 WeakPolarHBondContact O-CG2 3.42Å; R638-V642 PolarHBondContact O-N 3.08Å
639	T	57.9	Low	60.4	Low	77 Å²	77	103.2 Å²	103.2	47%	0.472	53%	0.531	S	S	.	.	H	α-helix	trans	-64.4	-41.3	179.1	-54.9	0	0	0	0	111.5	E635 C636 E637 V642 N643	E635-T639 WeakPolarHBondContact O-CB 3.18Å; E635-T639 PolarHBondContact O-N 3.05Å; E635-T639 PolarHBondContact O-OG1 3.02Å; C636-T639 PolarHBondContact O-N 3.41Å; E637-T639 VanDerWaalsContact C-N 3.31Å; E637-T639 PolarHBondContact O-N 3.27Å; T639-V642 PolarHBondContact O-N 3.37Å; T639-N643 PolarHBondContact O-N 3.41Å
640	I	56.3	Low	57.8	Low	107 Å²	107	108.6 Å²	108.6	55%	0.549	55%	0.554	S	S	.	*	H	α-helix	trans	-61.6	-45.4	174.8	-66	164.9	0	0	0	110.3	C636 E637 V642 N643 C644	C636-I640 WeakPolarHBondContact O-CG1 3.25Å; C636-I640 PolarHBondContact O-N 2.92Å; E637-I640 PolarHBondContact O-N 3.17Å; I640-V642 PolarHBondContact O-N 2.81Å; I640-N643 PolarHBondContact O-N 3.29Å; I640-C644 PolarHBondContact O-N 3.43Å
641	I	57	Low	55.1	Low	93 Å²	93	109.3 Å²	109.3	48%	0.477	57%	0.566	S	S	.	*	H	α-helix	trans	-62.8	-42.1	179.4	-64.9	164.4	0	0	0	111.4	E637 R638 K645	E637-I641 VanDerWaalsContact O-CG1 3.31Å; E637-I641 WeakPolarHBondContact O-CG1 3.5Å; E637-I641 PolarHBondContact O-N 2.97Å; R638-I641 PolarHBondContact O-N 3.43Å; I641-K645 HydrophobicContact CG2-CD 4.38Å; I641-K645 WeakPolarHBondContact O-CG 3.41Å; I641-K645 PolarHBondContact O-N 3.41Å
642	V	56.2	Low	52.8	Low	70 Å²	70	112 Å²	112	42%	0.424	58%	0.583	S	S	.	*	H	α-helix	trans	-66.2	-39.5	178.3	173.4	0	0	0	0	111.5	R638 T639 I640 K645 R646	R638-V642 WeakPolarHBondContact O-CG2 3.42Å; R638-V642 PolarHBondContact O-N 3.08Å; T639-V642 PolarHBondContact O-N 3.37Å; I640-V642 PolarHBondContact O-N 2.81Å; V642-K645 PolarHBondContact O-N 3.45Å; V642-R646 WeakPolarHBondContact O-CG 3.23Å; V642-R646 PolarHBondContact O-N 3.28Å; V642-R646 VanDerWaalsContact O-N 3.12Å
643	N	47.2	Very low	50.6	Low	97 Å²	97	112.1 Å²	112.1	52%	0.519	60%	0.599	S	S	.	*	H	α-helix	trans	-70.4	-39.4	178	-74.6	-10.5	0	0	0	112.4	T639 I640 K645 R646 S647	T639-N643 PolarHBondContact O-N 3.41Å; I640-N643 PolarHBondContact O-N 3.29Å; N643-K645 VanDerWaalsContact C-N 3.29Å; N643-K645 PolarHBondContact O-N 2.9Å; N643-R646 PolarHBondContact O-N 3.25Å; N643-R646 VanDerWaalsContact O-N 3.17Å; N643-S647 PolarHBondContact O-N 2.92Å
644	C	43.7	Very low	48.6	Very low	90 Å²	90	113 Å²	113	61%	0.608	61%	0.611	S	S	*	*	H	α-helix	trans	-62.7	-33.6	171.8	-83.2	0	0	0	0	112.8	I640 R646 S647	I640-C644 PolarHBondContact O-N 3.43Å; C644-R646 VanDerWaalsContact C-N 3.35Å; C644-S647 PolarHBondContact O-OG 3.39Å
645	K	48	Very low	46.7	Very low	175 Å²	175	115 Å²	115	76%	0.761	64%	0.638	S	S	*	*	H	α-helix	trans	-76.3	-20.1	175.5	-73.5	-176.5	179.4	-174.4	0	113.7	I641 V642 N643	I641-K645 HydrophobicContact CG2-CD 4.38Å; I641-K645 WeakPolarHBondContact O-CG 3.41Å; I641-K645 PolarHBondContact O-N 3.41Å; V642-K645 PolarHBondContact O-N 3.45Å; N643-K645 VanDerWaalsContact C-N 3.29Å; N643-K645 PolarHBondContact O-N 2.9Å
646	R	45.3	Very low	44.8	Very low	172 Å²	172	117 Å²	117	65%	0.649	66%	0.656	S	S	*	*	H	α-helix	trans	-93.1	-9.9	-179.7	-81.1	178.9	170.9	-174.9	-7.4	114.2	V642 N643 C644 P648	V642-R646 WeakPolarHBondContact O-CG 3.23Å; V642-R646 PolarHBondContact O-N 3.28Å; V642-R646 VanDerWaalsContact O-N 3.12Å; N643-R646 PolarHBondContact O-N 3.25Å; N643-R646 VanDerWaalsContact O-N 3.17Å; C644-R646 VanDerWaalsContact C-N 3.35Å; R646-P648 WeakPolarHBondContact O-CD 3.4Å
647	S	34.3	Very low	43.4	Very low	67 Å²	67	121.7 Å²	121.7	47%	0.469	67%	0.674	S	S	.	*	S	Bend	trans	-80.4	117.3	169.6	52.7	0	0	0	0	110.4	N643 C644 T649	N643-S647 PolarHBondContact O-N 2.92Å; C644-S647 PolarHBondContact O-OG 3.39Å; S647-T649 PolarHBondContact O-N 3.07Å; S647-T649 VanDerWaalsContact O-N 3.17Å
648	P	39	Very low	42.1	Very low	124 Å²	124	120.1 Å²	120.1	81%	0.805	68%	0.677	S	S	*	*			trans	-70.2	113.1	174.4	27.6	-30.2	0	0	0	109.2	R646 K650	R646-P648 WeakPolarHBondContact O-CD 3.4Å; P648-K650 PolarHBondContact O-N 3.17Å; P648-K650 VanDerWaalsContact O-N 3.07Å
649	T	35.9	Very low	40.9	Very low	125 Å²	125	119.5 Å²	119.5	77%	0.767	68%	0.684	S	S	*	*			trans	-65.6	102.6	172.2	47.8	0	0	0	0	109.5	S647 T651	S647-T649 PolarHBondContact O-N 3.07Å; S647-T649 VanDerWaalsContact O-N 3.17Å; T649-T651 PolarHBondContact O-N 3.12Å
650	K	34.9	Very low	39.9	Very low	200 Å²	200	122.7 Å²	122.7	87%	0.87	70%	0.697	S	S	*	*			trans	-80.3	105.8	156.8	-85.1	-173.6	176.9	-179.2	0	107.9	P648 T652	P648-K650 PolarHBondContact O-N 3.17Å; P648-K650 VanDerWaalsContact O-N 3.07Å; K650-T652 PolarHBondContact O-N 3.48Å
651	T	30.3	Very low	38.8	Very low	132 Å²	132	125 Å²	125	81%	0.81	71%	0.71	S	S	*	*			trans	-71.6	114.2	172	-48.3	0	0	0	0	109	T649	T649-T651 PolarHBondContact O-N 3.12Å
652	T	36.3	Very low	37.6	Very low	130 Å²	130	123.7 Å²	123.7	80%	0.798	72%	0.719	S	S	*	*			trans	-126.7	118.6	161.4	-33.8	0	0	0	0	108	K650 N654	K650-T652 PolarHBondContact O-N 3.48Å; T652-N654 PolarHBondContact O-N 3.15Å; T652-N654 VanDerWaalsContact O-N 3.16Å
653	A	34.7	Very low	36.4	Very low	85 Å²	85	127.5 Å²	127.5	70%	0.702	74%	0.737	S	S	*	*			trans	-64.6	108.6	173.6	0	0	0	0	0	109
654	N	36.1	Very low	35.5	Very low	158 Å²	158	133.8 Å²	133.8	85%	0.845	75%	0.753	S	S	*	*	S	Bend	trans	173.6	122.3	143.2	-85.3	-17.5	0	0	0	108.2	T652 T656	T652-N654 PolarHBondContact O-N 3.15Å; T652-N654 VanDerWaalsContact O-N 3.16Å; N654-T656 PolarHBondContact O-N 2.86Å
655	G	32.1	Very low	34.7	Very low	82 Å²	82	136 Å²	136	85%	0.845	77%	0.768	S	S	*	*			trans	-64.1	113.6	-170.7	0	0	0	0	0	113.1
656	T	33.7	Very low	33.9	Very low	126 Å²	126	133.8 Å²	133.8	77%	0.773	77%	0.769	S	S	*	*			trans	-158.5	113.8	148.7	-40.3	0	0	0	0	107.9	N654 S658	N654-T656 PolarHBondContact O-N 2.86Å; T656-S658 PolarHBondContact O-N 3.35Å
657	I	33.4	Very low	33.5	Very low	167 Å²	167	133.8 Å²	133.8	86%	0.856	78%	0.779	S	S	*	*			trans	-77.8	98.5	171.5	-62.4	173.4	0	0	0	106.8	I659	I657-I659 HydrophobicContact CG2-CG1 4.48Å
658	S	32.7	Very low	33.5	Very low	90 Å²	90	136.2 Å²	136.2	63%	0.629	79%	0.793	S	S	*	*			trans	-93.3	109.9	167.8	48.4	0	0	0	0	109.5	T656 I660	T656-S658 PolarHBondContact O-N 3.35Å; S658-I660 PolarHBondContact O-N 3.44Å; S658-I660 VanDerWaalsContact O-N 3.12Å
659	I	33.8	Very low	33.1	Very low	143 Å²	143	135.2 Å²	135.2	73%	0.733	79%	0.789	S	S	*	*			trans	-72.6	99.2	166.7	-59.4	173.4	0	0	0	106.3	I657 N661	I657-I659 HydrophobicContact CG2-CG1 4.48Å; I659-N661 PolarHBondContact O-N 3.16Å; I659-N661 VanDerWaalsContact O-N 3.15Å
660	I	36.2	Very low	32.9	Very low	144 Å²	144	134.4 Å²	134.4	74%	0.738	79%	0.788	S	S	*	*			trans	-78.3	96.3	171.9	-59.1	176.1	0	0	0	107.4	S658 G662	S658-I660 PolarHBondContact O-N 3.44Å; S658-I660 VanDerWaalsContact O-N 3.12Å; I660-G662 PolarHBondContact O-N 3.42Å
661	N	32.9	Very low	32.8	Very low	156 Å²	156	136.1 Å²	136.1	83%	0.834	79%	0.789	S	S	*	*			trans	-68.4	117.4	154.3	-81.9	-22.7	0	0	0	107.5	I659	I659-N661 PolarHBondContact O-N 3.16Å; I659-N661 VanDerWaalsContact O-N 3.15Å
662	G	33	Very low	32.9	Very low	64 Å²	64	136.4 Å²	136.4	66%	0.66	79%	0.79	S	S	*	*			trans	-156	91.7	-178.1	0	0	0	0	0	111.9	I660	I660-G662 PolarHBondContact O-N 3.42Å
663	D	30	Very low	32.7	Very low	151 Å²	151	136 Å²	136	81%	0.807	79%	0.788	S	S	*	*			trans	23.5	131.2	139.7	-71.8	-21.5	0	0	0	120.9
664	R	28.4	Very low	32.5	Very low	228 Å²	228	140.3 Å²	140.3	86%	0.86	79%	0.794	S	S	*	*			trans	65.4	92.2	154.3	-60.4	-179.9	-158	-150.9	4.7	117.2
665	C	28	Very low	32.3	Very low	136 Å²	136	140.7 Å²	140.7	92%	0.919	79%	0.788	S	S	*	*			trans	-98	97.4	151	-81.7	0	0	0	0	109.8
666	V	30.6	Very low	32.2	Very low	129 Å²	129	142.4 Å²	142.4	78%	0.782	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.2	120.7	156.9	174.4	0	0	0	0	106.8	P668	V666-P668 WeakPolarHBondContact O-CD 3.47Å
667	M	36.1	Very low	32.3	Very low	173 Å²	173	142.4 Å²	142.4	85%	0.852	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-65.9	125.5	172.6	-76.6	-72.6	-168.4	0	0	109.6
668	P	34.8	Very low	32.1	Very low	117 Å²	117	141.8 Å²	141.8	76%	0.76	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-77.4	129.7	164.5	30.7	-28	0	0	0	109	V666	V666-P668 WeakPolarHBondContact O-CD 3.47Å
669	S	30.9	Very low	32.3	Very low	104 Å²	104	145.5 Å²	145.5	73%	0.727	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-59.3	154.1	166.2	57.5	0	0	0	0	111.2
670	S	32.1	Very low	32.1	Very low	107 Å²	107	146.1 Å²	146.1	75%	0.748	78%	0.783	S	S	*	*			trans	66	101.8	159.6	60	0	0	0	0	118.1
671	R	33.1	Very low	32	Very low	236 Å²	236	149.3 Å²	149.3	89%	0.891	81%	0.81	S	S	*	*				-177	104.2	124.4	-98.8	171.7	-171.7	-162.8	2.1	109.1	T673	R671-T673 PolarHBondContact O-N 3.18Å
672	V	31	Very low	31.9	Very low	138 Å²	138	149 Å²	149	84%	0.836	81%	0.809	S	S	*	*			trans	-64.1	113.7	164.8	177.1	0	0	0	0	106.6	E674	V672-E674 HydrophobicContact CG1-CG 4.41Å
673	T	32.5	Very low	31.9	Very low	122 Å²	122	153.5 Å²	153.5	75%	0.748	82%	0.816	S	S	*	*			trans	-118.2	101.4	161.7	37.6	0	0	0	0	105.9	R671 K675	R671-T673 PolarHBondContact O-N 3.18Å; T673-K675 PolarHBondContact O-N 3.19Å
674	E	30.3	Very low	32	Very low	176 Å²	176	153.6 Å²	153.6	82%	0.822	82%	0.817	S	S	*	*			trans	-60.8	118.1	168.3	-79.7	-179.6	147.4	0	0	108.4	V672	V672-E674 HydrophobicContact CG1-CG 4.41Å
675	K	33.2	Very low	32.2	Very low	165 Å²	165	149.2 Å²	149.2	72%	0.717	81%	0.814	S	S	*	*			trans	-101.6	99.5	159.4	-89.5	-170.2	172.2	-167	0	107.8	T673 I677	T673-K675 PolarHBondContact O-N 3.19Å; K675-I677 PolarHBondContact O-N 3.2Å
676	V	29.4	Very low	32.4	Very low	119 Å²	119	150.1 Å²	150.1	72%	0.721	81%	0.808	S	S	*	*			trans	-58.1	120.5	160.8	177.3	0	0	0	0	107.8	L678	V676-L678 HydrophobicContact CG1-CG 4.27Å
677	I	35.7	Very low	32.5	Very low	125 Å²	125	151.5 Å²	151.5	64%	0.641	81%	0.81	S	S	*	*			trans	-110.6	99	165.9	-57.6	178	0	0	0	106.4	K675 F679	K675-I677 PolarHBondContact O-N 3.2Å; I677-F679 HydrophobicContact CG2-CD2 3.72Å; I677-F679 HydrophobicContact CG2-CE2 3.43Å; I677-F679 VanDerWaalsContact CG2-CE2 3.43Å; I677-F679 HydrophobicContact CG2-CZ 4.07Å; I677-F679 PolarHBondContact O-N 2.96Å
678	L	29.9	Very low	32.3	Very low	154 Å²	154	149.9 Å²	149.9	81%	0.806	81%	0.806	S	S	*	*			trans	-67.5	118.8	162.6	-81.4	150.5	0	0	0	108	V676	V676-L678 HydrophobicContact CG1-CG 4.27Å
679	F	36.5	Very low	32.1	Very low	168 Å²	168	152.5 Å²	152.5	74%	0.737	81%	0.81	S	S	*	*			trans	-99.5	107.7	160.8	-84.3	-79.3	0	0	0	108.3	I677	I677-F679 HydrophobicContact CG2-CD2 3.72Å; I677-F679 HydrophobicContact CG2-CE2 3.43Å; I677-F679 VanDerWaalsContact CG2-CE2 3.43Å; I677-F679 HydrophobicContact CG2-CZ 4.07Å; I677-F679 PolarHBondContact O-N 2.96Å
680	N	29.8	Very low	32.2	Very low	156 Å²	156	156.5 Å²	156.5	83%	0.834	82%	0.817	S	S	*	*			trans	-77	113.3	158	-98.7	-8.8	0	0	0	108
681	T	33.1	Very low	32.2	Very low	212 Å²	212	161 Å²	161	100%	1.301	82%	0.823	S	S	*	*			trans	-174.5	0	134	37.6	0	0	0	0	108.5

Retrieved 681 of 681 residues in 1235.3 ms (Link to these results)

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