A0A087XI75_POEFO Loading...

YTH domain-containing family protein

Specifically recognizes and binds N6-methyladenosine (m6A)-containing RNAs, and regulates mRNA stability. M6A is a modification present at internal sites of mRNAs and some non-coding RNAs and plays a role in mRNA stability and processing.

AlphaFold DB , UniProt , Accession A0A087XI75, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 617 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	40.5	Very low	246 Å²	246	146.6 Å²	146.6	100%	1.212	81%	0.805	S	S	*	*				0	145.1	0	-71.3	173.7	170.6	0	0	107.4
2	S	41.4	Very low	40.4	Very low	120 Å²	120	151.5 Å²	151.5	84%	0.839	81%	0.812	S	S	*	*			trans	-143.1	127.7	-158.4	-45.1	0	0	0	0	113
3	T	40.3	Very low	40	Very low	127 Å²	127	145.5 Å²	145.5	78%	0.779	81%	0.807	S	S	*	*			trans	-154.1	130.5	163.5	49.2	0	0	0	0	106.7
4	T	47.1	Very low	40	Very low	126 Å²	126	149.3 Å²	149.3	77%	0.773	82%	0.816	S	S	*	*				60.4	138	52.8	68.5	0	0	0	0	113.4
5	S	35.8	Very low	39.6	Very low	97 Å²	97	145.9 Å²	145.9	68%	0.678	82%	0.816	S	S	*	*			cis	-158.8	147.8	2.7	-122	0	0	0	0	114.6
6	I	41	Very low	39.5	Very low	150 Å²	150	143.6 Å²	143.6	77%	0.769	81%	0.812	S	S	*	*				40.8	108.2	128.4	-56.9	176.2	0	0	0	121.4
7	D	34	Very low	39.4	Very low	148 Å²	148	146.6 Å²	146.6	79%	0.791	81%	0.814	S	S	*	*				61.2	-175.8	109.8	-128.1	11.1	0	0	0	121.7
8	P	62.3	Low	39.2	Very low	105 Å²	105	145.2 Å²	145.2	68%	0.682	81%	0.81	S	S	*	*				-135.1	-162.5	-118.9	45.8	-25.7	0	0	0	117.2
9	Q	36.1	Very low	38.9	Very low	167 Å²	167	146.3 Å²	146.3	78%	0.78	81%	0.808	S	S	*	*			trans	122.8	133.6	141.4	-159.9	-178.9	24	0	0	119.9
10	R	32.2	Very low	38.7	Very low	230 Å²	230	146.7 Å²	146.7	87%	0.868	81%	0.809	S	S	*	*			trans	67.9	154.6	162.9	-95.2	178.1	168.7	174	-2.9	117.9
11	S	37.5	Very low	38.3	Very low	97 Å²	97	143 Å²	143	68%	0.678	81%	0.805	S	S	*	*			cis	-145.3	-150.6	0.4	45.4	0	0	0	0	109.6
12	K	39.1	Very low	38.2	Very low	205 Å²	205	136.6 Å²	136.6	89%	0.891	78%	0.784	S	S	*	*			cis	-170	158.4	12	-151.9	176.9	-178.6	-179.3	0	110.9
13	G	35.9	Very low	37.9	Very low	73 Å²	73	138.9 Å²	138.9	75%	0.753	79%	0.786	S	S	*	*			trans	113.3	144.8	154.9	0	0	0	0	0	118.7
14	Q	39.1	Very low	37.8	Very low	199 Å²	199	141.2 Å²	141.2	93%	0.93	79%	0.788	S	S	*	*			trans	-147.3	151.4	177.9	-65.6	176.6	-74.1	0	0	111.8
15	A	34.9	Very low	37.1	Very low	98 Å²	98	143.7 Å²	143.7	81%	0.81	79%	0.79	S	S	*	*			trans	157.1	158	139.7	0	0	0	0	0	111.2
16	S	38.4	Very low	37.1	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	79%	0.79	S	S	*	*			cis	165.2	115.7	-40.3	-93.6	0	0	0	0	108.5
17	K	36.6	Very low	36.6	Very low	195 Å²	195	145.6 Å²	145.6	85%	0.848	78%	0.783	S	S	*	*			trans	-179.3	128.5	149.1	-110.6	-174.6	178.9	-177.5	0	116.6
18	V	35.7	Very low	36.6	Very low	121 Å²	121	143.6 Å²	143.6	73%	0.733	78%	0.776	S	S	*	*			trans	52.6	157.3	149.4	-57.9	0	0	0	0	123.9
19	Q	34.4	Very low	35.3	Very low	166 Å²	166	144.9 Å²	144.9	78%	0.776	78%	0.782	S	S	*	*			cis	-173	126.2	-35.9	-178.9	159.3	-25	0	0	111.8
20	N	34.3	Very low	35.1	Very low	154 Å²	154	144.1 Å²	144.1	82%	0.824	78%	0.778	S	S	*	*			trans	48.5	143.5	148.3	-156.5	29.6	0	0	0	122.8
21	G	30	Very low	35.3	Very low	70 Å²	70	138.8 Å²	138.8	72%	0.722	77%	0.767	S	S	*	*			trans	179.1	120.2	165.6	0	0	0	0	0	112.5
22	S	35.2	Very low	35.2	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	77%	0.768	S	S	*	*			trans	-163.9	172.6	-179.4	-169.7	0	0	0	0	111.9
23	L	36.4	Very low	35	Very low	169 Å²	169	137.3 Å²	137.3	89%	0.885	76%	0.761	S	S	*	*			trans	90.2	148.8	167.1	-124.4	76.2	0	0	0	120.4
24	H	38.6	Very low	35	Very low	175 Å²	175	142.7 Å²	142.7	81%	0.81	76%	0.764	S	S	*	*			trans	-85.9	155.1	175.1	-77.7	-85.6	0	0	0	112.6
25	Q	32.2	Very low	35.2	Very low	178 Å²	178	140.5 Å²	140.5	83%	0.832	75%	0.754	S	S	*	*				173.8	158.4	102	-91.6	-170.8	21	0	0	114.7
26	K	35	Very low	36.3	Very low	153 Å²	153	139.9 Å²	139.9	67%	0.665	74%	0.741	S	S	*	*			trans	1.7	158.8	143.8	-90	168.5	151.2	-82.5	0	119.7
27	E	31.5	Very low	36.2	Very low	135 Å²	135	145.2 Å²	145.2	63%	0.631	75%	0.746	S	S	*	*			cis	-129.1	-140.4	19.6	-70.3	-67.7	4.2	0	0	113.4
28	T	32.1	Very low	36.4	Very low	105 Å²	105	142.9 Å²	142.9	64%	0.644	74%	0.742	S	S	*	*				-166.2	137.4	-105.2	-61.2	0	0	0	0	112.3
29	V	36.5	Very low	37.1	Very low	133 Å²	133	143.2 Å²	143.2	81%	0.806	75%	0.747	S	S	*	*			trans	-148.9	117.5	167.9	-159.8	0	0	0	0	106.5
30	H	32.3	Very low	37	Very low	151 Å²	151	138.7 Å²	138.7	70%	0.699	75%	0.745	S	S	*	*				59.5	135.1	79.6	-84.6	-90.7	0	0	0	114.9
31	D	35	Very low	36.9	Very low	117 Å²	117	140.6 Å²	140.6	63%	0.626	75%	0.749	S	S	*	*			cis	-148.7	151.8	18.5	-105.2	-56	0	0	0	114.3
32	N	35.3	Very low	37	Very low	132 Å²	132	141.5 Å²	141.5	71%	0.706	74%	0.744	S	S	*	*			trans	53.1	156.2	147.4	-54.6	-35	0	0	0	121.5
33	D	35	Very low	36.7	Very low	139 Å²	139	141.8 Å²	141.8	74%	0.743	74%	0.742	S	S	*	*			cis	-153.1	173	25.7	-140.5	-44	0	0	0	114.8
34	F	36.8	Very low	36.5	Very low	187 Å²	187	142.2 Å²	142.2	82%	0.82	74%	0.739	S	S	*	*			trans	75.7	87.5	167.1	-99.8	-94.1	0	0	0	122.5
35	E	43.5	Very low	36.3	Very low	153 Å²	153	140.9 Å²	140.9	72%	0.715	74%	0.738	S	S	*	*			trans	-91.2	-174.9	138.1	-99.7	-92.2	138.3	0	0	108.3
36	P	57.8	Low	36	Very low	84 Å²	84	140 Å²	140	55%	0.545	74%	0.739	S	S	.	*			cis	-137.1	178.3	8.6	44.3	-27.6	0	0	0	117.4
37	Y	35.9	Very low	35.9	Very low	222 Å²	222	137 Å²	137	87%	0.871	74%	0.738	S	S	*	*				-166.7	129.9	116.6	-103.7	-68.5	0	0	0	113
38	L	41.7	Very low	35.9	Very low	145 Å²	145	142.1 Å²	142.1	76%	0.759	75%	0.753	S	S	*	*			trans	-93	-172.2	-179	-61.5	164.1	0	0	0	111.8
39	P	50.3	Low	35.9	Very low	129 Å²	129	144.6 Å²	144.6	84%	0.838	76%	0.757	S	S	*	*			cis	-121.8	-169.7	-27.7	16.7	9	0	0	0	110.9
40	G	31.6	Very low	35.6	Very low	71 Å²	71	143.6 Å²	143.6	73%	0.732	76%	0.756	S	S	*	*			cis	163.6	168.8	-4.7	0	0	0	0	0	112.2
41	Q	31.8	Very low	35.5	Very low	193 Å²	193	143.1 Å²	143.1	90%	0.902	76%	0.757	S	S	*	*			trans	20.3	147.2	153.9	-75.4	179.5	-12	0	0	122.7
42	S	31.6	Very low	35.3	Very low	90 Å²	90	144.4 Å²	144.4	63%	0.629	77%	0.769	S	S	*	*			cis	-173.8	156.4	1.6	47.4	0	0	0	0	115.3
43	T	30.5	Very low	35.2	Very low	117 Å²	117	145.3 Å²	145.3	72%	0.718	77%	0.774	S	S	*	*			trans	59.8	124.9	142.4	50.9	0	0	0	0	125.2
44	Q	32.4	Very low	35.6	Very low	178 Å²	178	143.9 Å²	143.9	83%	0.832	77%	0.772	S	S	*	*			trans	83.7	129.2	132	-73.3	-168.4	9.8	0	0	123.8
45	N	32.4	Very low	35.3	Very low	146 Å²	146	144.2 Å²	144.2	78%	0.781	77%	0.77	S	S	*	*			trans	10	139.6	146.3	-70.5	-4	0	0	0	120.8
46	N	27.3	Very low	35	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	77%	0.772	S	S	*	*				-147.3	154.7	128.9	-140.2	-29.9	0	0	0	112.5
47	S	33.2	Very low	33.8	Very low	92 Å²	92	145.1 Å²	145.1	64%	0.643	78%	0.779	S	S	*	*			trans	-146.6	130.8	-179.3	-57.7	0	0	0	0	109.2
48	Y	30.4	Very low	33.7	Very low	241 Å²	241	138.9 Å²	138.9	95%	0.945	77%	0.768	S	S	*	*			trans	-167.3	-176.2	148.3	-111.9	-66.4	0	0	0	112.9
49	Q	33.1	Very low	33.4	Very low	158 Å²	158	141.8 Å²	141.8	74%	0.738	77%	0.771	S	S	*	*			trans	-120.1	148.9	-157.7	-75.5	-95.8	-14.5	0	0	113.6
50	S	29.2	Very low	32.7	Very low	112 Å²	112	146.2 Å²	146.2	78%	0.783	77%	0.772	S	S	*	*			trans	-166.1	119.5	145.3	30.5	0	0	0	0	107.6
51	I	30.5	Very low	32.7	Very low	141 Å²	141	147.4 Å²	147.4	72%	0.723	78%	0.775	S	S	*	*				67.1	90	64	-61.8	176.4	0	0	0	112.5
52	T	32	Very low	33.5	Very low	143 Å²	143	144.5 Å²	144.5	88%	0.877	77%	0.773	S	S	*	*				-179.6	139.8	116.3	26.6	0	0	0	0	112.1
53	D	32.3	Very low	33.9	Very low	152 Å²	152	145.3 Å²	145.3	81%	0.813	78%	0.779	S	S	*	*			trans	-150.4	131.3	158.1	-172.3	44.3	0	0	0	104
54	P	43.5	Very low	34.3	Very low	108 Å²	108	148.2 Å²	148.2	70%	0.701	79%	0.788	S	S	*	*				-143.7	165.4	72.9	40.4	-23.1	0	0	0	115.9
55	Y	30.6	Very low	34.2	Very low	195 Å²	195	142.3 Å²	142.3	77%	0.765	78%	0.775	S	S	*	*				159.9	121.1	100	-153.7	-107.9	0	0	0	114.7
56	M	36.7	Very low	34.7	Very low	155 Å²	155	144.5 Å²	144.5	76%	0.764	78%	0.778	S	S	*	*			trans	64.5	168.5	162.1	-72	-64.2	105.8	0	0	119.7
57	S	33	Very low	35.6	Very low	100 Å²	100	142.9 Å²	142.9	70%	0.699	78%	0.776	S	S	*	*			trans	-139.6	147.4	-161.5	175.1	0	0	0	0	113.4
58	S	33.3	Very low	35.8	Very low	92 Å²	92	147.9 Å²	147.9	64%	0.643	78%	0.782	S	S	*	*			trans	68.4	131.9	163.2	-55.3	0	0	0	0	117.7
59	Y	36.3	Very low	36.8	Very low	206 Å²	206	142.3 Å²	142.3	81%	0.808	78%	0.776	S	S	*	*				-179	124.4	105.1	-94.9	-67.8	0	0	0	111.5
60	Y	34.5	Very low	37	Very low	222 Å²	222	142.4 Å²	142.4	87%	0.871	78%	0.78	S	S	*	*			trans	58.8	129.1	166.5	-73.8	-81.7	0	0	0	121.9
61	A	31.5	Very low	37.1	Very low	95 Å²	95	142.2 Å²	142.2	79%	0.785	78%	0.779	S	S	*	*			trans	-149.8	149.4	146.6	0	0	0	0	0	109.7
62	P	49	Very low	37.2	Very low	132 Å²	132	145 Å²	145	86%	0.857	79%	0.789	S	S	*	*			trans	-108.1	-172	-167.6	41.6	-36	0	0	0	116.2
63	S	40.9	Very low	37.8	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	78%	0.783	S	S	*	*			trans	-78.7	-178.5	-166.4	-40.8	0	0	0	0	117.9
64	I	38	Very low	38.6	Very low	178 Å²	178	140.7 Å²	140.7	91%	0.913	78%	0.779	S	S	*	*			trans	91	136.5	169.2	-49.8	155.1	0	0	0	114.3
65	G	31.1	Very low	38.1	Very low	54 Å²	54	147.1 Å²	147.1	56%	0.557	79%	0.79	S	S	*	*			cis	158.5	133.6	-15	0	0	0	0	0	116.2
66	F	42.3	Very low	38.4	Very low	191 Å²	191	143.3 Å²	143.3	84%	0.838	79%	0.792	S	S	*	*			trans	69.3	155.9	161.9	-66.1	-64.9	0	0	0	118.6
67	P	46.1	Very low	38.4	Very low	125 Å²	125	143 Å²	143	81%	0.812	80%	0.799	S	S	*	*			cis	-141	-176	46.6	41.8	-20.5	0	0	0	120
68	Y	37.9	Very low	38.4	Very low	197 Å²	197	142.1 Å²	142.1	77%	0.773	81%	0.806	S	S	*	*			trans	-91.5	168.5	176.9	-93.6	-89.8	0	0	0	112.8
69	P	51.9	Low	38.2	Very low	125 Å²	125	141.7 Å²	141.7	81%	0.812	82%	0.816	S	S	*	*				-151.3	-146.1	65.4	39.7	-15.3	0	0	0	115.1
70	L	36.5	Very low	38.2	Very low	160 Å²	160	139.5 Å²	139.5	84%	0.838	82%	0.818	S	S	*	*				-167.7	118.3	-81.6	-178.1	85.9	0	0	0	112.6
71	S	32.3	Very low	38.7	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	81%	0.81	S	S	*	*			trans	-175.2	113.5	163.2	55.2	0	0	0	0	112.1
72	E	30.8	Very low	39.4	Very low	200 Å²	200	135.5 Å²	135.5	94%	0.935	81%	0.811	S	S	*	*				97.7	152.7	87.1	-79.2	-159	147.2	0	0	115.4
73	A	44.6	Very low	39.1	Very low	93 Å²	93	136.3 Å²	136.3	77%	0.769	81%	0.807	S	S	*	*			trans	-154.8	151	-174.6	0	0	0	0	0	112.3
74	P	49.9	Very low	39.2	Very low	112 Å²	112	136.9 Å²	136.9	73%	0.727	81%	0.808	S	S	*	*				-132.8	-173.5	114.2	11.9	11.8	0	0	0	111.4
75	W	32.5	Very low	39	Very low	242 Å²	242	138.5 Å²	138.5	92%	0.917	80%	0.804	S	S	*	*			cis	-146.6	176.2	24.1	2.7	-84.3	0	0	0	112.6
76	S	37	Very low	39.1	Very low	115 Å²	115	143.2 Å²	143.2	80%	0.804	82%	0.815	S	S	*	*			trans	-131.6	147.3	-167.6	-50.3	0	0	0	0	115.5
77	T	37	Very low	38.4	Very low	149 Å²	149	140 Å²	140	91%	0.914	81%	0.811	S	S	*	*			trans	-178	139.7	139.7	32.6	0	0	0	0	106.9
78	G	32.2	Very low	38.4	Very low	82 Å²	82	138.7 Å²	138.7	85%	0.845	80%	0.803	S	S	*	*			cis	120.8	125.3	9.7	0	0	0	0	0	109.8
79	G	30.6	Very low	38	Very low	83 Å²	83	140.4 Å²	140.4	86%	0.856	81%	0.81	S	S	*	*			cis	-170.7	176.4	-3.6	0	0	0	0	0	111
80	D	35.4	Very low	37.1	Very low	159 Å²	159	137.5 Å²	137.5	85%	0.85	80%	0.803	S	S	*	*			trans	-142.7	132.3	-173.7	-162.4	23.4	0	0	0	109.7
81	P	46	Very low	37.5	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.3	150.4	-171.2	31.2	-35	0	0	0	114.3
82	P	45.4	Very low	37.4	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-84.5	146.7	-170.5	33.4	-36.4	0	0	0	114.7
83	I	42.1	Very low	37.3	Very low	150 Å²	150	133.6 Å²	133.6	77%	0.769	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-97.9	125.6	166.8	-61.5	178.9	0	0	0	109.6
84	P	44.4	Very low	36.5	Very low	119 Å²	119	136.6 Å²	136.6	77%	0.773	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-83.6	156.4	175.2	33.9	-34.5	0	0	0	112.9
85	Y	33.4	Very low	35.6	Very low	213 Å²	213	134.3 Å²	134.3	84%	0.835	79%	0.794	S	S	*	*			trans	-119.1	163.2	178.2	-92.4	-93.3	0	0	0	112.1
86	L	32.3	Very low	35.4	Very low	152 Å²	152	129.8 Å²	129.8	80%	0.796	79%	0.788	S	S	*	*			trans	93.6	114.7	163.3	-52.6	179.3	0	0	0	119.6
87	T	28.1	Very low	35.4	Very low	123 Å²	123	131 Å²	131	76%	0.755	78%	0.781	S	S	*	*				23.8	165.9	121.6	21.9	0	0	0	0	122.6
88	P	45.2	Very low	35.2	Very low	98 Å²	98	131.1 Å²	131.1	64%	0.636	77%	0.771	S	S	*	*			cis	-143	-176.2	-5.7	41.6	-22.7	0	0	0	117.5
89	Y	30	Very low	35.3	Very low	233 Å²	233	134.7 Å²	134.7	91%	0.914	76%	0.763	S	S	*	*			trans	62	161.7	157.4	-77.8	-72.1	0	0	0	120.4
90	G	33.5	Very low	35.6	Very low	64 Å²	64	137.3 Å²	137.3	66%	0.66	76%	0.755	S	S	*	*			trans	-154.1	178.8	175.9	0	0	0	0	0	111.9
91	P	44	Very low	36.3	Very low	120 Å²	120	134.5 Å²	134.5	78%	0.779	75%	0.745	S	S	*	*			trans	-152.8	156.5	149.2	39.2	-21.5	0	0	0	118.5
92	L	30.2	Very low	35.5	Very low	166 Å²	166	135.8 Å²	135.8	87%	0.869	75%	0.746	S	S	*	*			trans	56	123.3	136.8	-67.9	171.5	0	0	0	125.5
93	S	28.9	Very low	35.1	Very low	100 Å²	100	135 Å²	135	70%	0.699	74%	0.739	S	S	*	*				96	146.1	120.2	-160.2	0	0	0	0	124.1
94	N	29	Very low	34.8	Very low	155 Å²	155	134 Å²	134	83%	0.829	74%	0.74	S	S	*	*			trans	100.5	131.9	168.8	-55.4	2.8	0	0	0	114
95	G	31.3	Very low	34.3	Very low	65 Å²	65	137.7 Å²	137.7	67%	0.67	74%	0.744	S	S	*	*			cis	115.5	143.6	14.1	0	0	0	0	0	109.7
96	D	28	Very low	34.1	Very low	146 Å²	146	130 Å²	130	78%	0.781	73%	0.73	S	S	*	*			cis	-170.3	167.9	-4.5	-116.7	-72.7	0	0	0	106.9
97	H	36.3	Very low	34	Very low	140 Å²	140	131.3 Å²	131.3	65%	0.648	73%	0.732	S	S	*	*			cis	-161.6	179.7	6.3	-161.9	70.7	0	0	0	108.8
98	H	32.7	Very low	34.9	Very low	152 Å²	152	130.8 Å²	130.8	70%	0.704	73%	0.73	S	S	*	*			trans	152.2	114.9	134.5	-84.2	80.8	0	0	0	117.5
99	F	33.8	Very low	34.1	Very low	158 Å²	158	130 Å²	130	69%	0.693	74%	0.74	S	S	*	*			trans	62.9	140.2	140	-78.1	-126.9	0	0	0	120.1
100	M	36.7	Very low	34.1	Very low	137 Å²	137	122.2 Å²	122.2	68%	0.675	73%	0.731	S	S	*	*			cis	-159.2	-166.1	-4.5	-114.4	-56.7	169.6	0	0	110.2
101	P	50.4	Low	34	Very low	100 Å²	100	128.2 Å²	128.2	65%	0.649	75%	0.747	S	S	*	*				-97.3	-169.2	-117.7	38.8	-14.5	0	0	0	113.5
102	D	29.7	Very low	33.2	Very low	137 Å²	137	125.9 Å²	125.9	73%	0.733	75%	0.745	S	S	*	*			cis	-161	151.3	40.3	-138.2	5.1	0	0	0	116
103	T	36.3	Very low	33.1	Very low	107 Å²	107	124.1 Å²	124.1	66%	0.656	75%	0.746	S	S	*	*			trans	-0.8	152	155.4	58.8	0	0	0	0	121.3
104	V	37.3	Very low	33.1	Very low	129 Å²	129	124.8 Å²	124.8	78%	0.782	75%	0.751	S	S	*	*			cis	-164.1	179.5	-11.6	-90.1	0	0	0	0	105.7
105	F	34.2	Very low	33.1	Very low	196 Å²	196	125.3 Å²	125.3	86%	0.86	75%	0.752	S	S	*	*			cis	-150.7	176.3	6.6	-153.9	-134.6	0	0	0	106.6
106	G	28.8	Very low	33	Very low	52 Å²	52	132.2 Å²	132.2	54%	0.536	76%	0.759	S	S	.	*			cis	177.8	-164.8	6.4	0	0	0	0	0	110.5
107	Q	30.2	Very low	33.8	Very low	179 Å²	179	129.9 Å²	129.9	84%	0.836	75%	0.752	S	S	*	*			trans	-161.6	-174.3	-178.3	-109.5	-154.5	27.3	0	0	110.6
108	P	47.5	Very low	33.5	Very low	112 Å²	112	131.3 Å²	131.3	73%	0.727	76%	0.759	S	S	*	*			cis	-134.8	176.3	0.6	34.1	-13.2	0	0	0	117.2
109	G	28.2	Very low	33.2	Very low	81 Å²	81	133.4 Å²	133.4	84%	0.835	76%	0.761	S	S	*	*			trans	92.3	153.6	151.8	0	0	0	0	0	118.5
110	G	29.9	Very low	33.2	Very low	71 Å²	71	132.5 Å²	132.5	73%	0.732	76%	0.757	S	S	*	*			cis	166.5	141.3	-11.2	0	0	0	0	0	115
111	L	31.2	Very low	32.8	Very low	190 Å²	190	133.5 Å²	133.5	100%	0.995	76%	0.764	S	S	*	*			trans	71.5	144.2	170.7	-49	176.7	0	0	0	118.8
112	G	27.1	Very low	31.9	Very low	71 Å²	71	136.2 Å²	136.2	73%	0.732	77%	0.766	S	S	*	*			trans	142.4	70.5	154	0	0	0	0	0	121.9
113	S	28.7	Very low	32.3	Very low	129 Å²	129	139 Å²	139	90%	0.902	77%	0.773	S	S	*	*			trans	70.1	158.8	145.2	-54.6	0	0	0	0	122.5
114	S	27.2	Very low	32.3	Very low	113 Å²	113	140.1 Å²	140.1	79%	0.79	78%	0.781	S	S	*	*			trans	-67.4	175	-178.4	-43	0	0	0	0	113.9
115	I	29.7	Very low	31.8	Very low	166 Å²	166	143.1 Å²	143.1	85%	0.851	79%	0.787	S	S	*	*				-157.1	158.1	53.1	-58.9	158.7	0	0	0	111.1
116	Y	29.7	Very low	31.8	Very low	210 Å²	210	140.8 Å²	140.8	82%	0.824	78%	0.783	S	S	*	*			trans	-67.5	-174.1	168.9	-82.5	-94.5	0	0	0	113.5
117	P	44.8	Very low	32.2	Very low	98 Å²	98	143.4 Å²	143.4	64%	0.636	79%	0.791	S	S	*	*			cis	-130	-170.8	-15.7	17.8	9.2	0	0	0	114.7
118	H	29.1	Very low	32.2	Very low	169 Å²	169	138.9 Å²	138.9	78%	0.782	78%	0.784	S	S	*	*			trans	-1.8	152.7	156.9	-37.5	-54.3	0	0	0	120.4
119	R	27.5	Very low	31.5	Very low	197 Å²	197	143 Å²	143	74%	0.743	79%	0.791	S	S	*	*				-178.6	140.8	52.7	-172.3	-178.3	177.3	-167.7	0.9	115.5
120	F	32.5	Very low	31.7	Very low	139 Å²	139	143.5 Å²	143.5	61%	0.61	78%	0.782	S	S	*	*			trans	55.2	128.8	152.4	-72.3	-154	0	0	0	122.9	F122	F120-F122 HydrophobicContact CD1-CD2 4.3Å; F120-F122 HydrophobicContact CD1-CE2 4.06Å
121	N	28.5	Very low	31.7	Very low	157 Å²	157	144.4 Å²	144.4	84%	0.84	78%	0.782	S	S	*	*				-122.2	144.3	119.1	-91.5	-14	0	0	0	105.6
122	F	32.9	Very low	31.9	Very low	157 Å²	157	147.7 Å²	147.7	69%	0.689	78%	0.781	S	S	*	*			cis	72.2	122.5	43.4	-81.2	-78.3	0	0	0	115.4	F120	F120-F122 HydrophobicContact CD1-CD2 4.3Å; F120-F122 HydrophobicContact CD1-CE2 4.06Å
123	F	36.6	Very low	32.1	Very low	197 Å²	197	147.7 Å²	147.7	86%	0.864	78%	0.781	S	S	*	*			trans	66.3	102.1	-171.8	-52.7	-72.6	0	0	0	117.3
124	P	36.3	Very low	32.2	Very low	129 Å²	129	148.5 Å²	148.5	84%	0.838	78%	0.781	S	S	*	*			trans	-100.4	102.5	156.1	33.7	-22.9	0	0	0	110.1
125	E	27.5	Very low	32.3	Very low	192 Å²	192	149 Å²	149	90%	0.897	78%	0.784	S	S	*	*			trans	-84.4	148.5	159.5	-157.6	168.3	-151.6	0	0	109.3	P127	E125-P127 VanDerWaalsContact O-CD 3.29Å; E125-P127 WeakPolarHBondContact O-CD 3.23Å
126	N	33.8	Very low	32.3	Very low	147 Å²	147	144.7 Å²	144.7	79%	0.786	78%	0.781	S	S	*	*			trans	-63.5	114.8	-154.2	178.8	95.1	0	0	0	115.9
127	P	37.1	Very low	32.4	Very low	108 Å²	108	140.4 Å²	140.4	70%	0.701	78%	0.782	S	S	*	*			trans	-87.1	158	165.4	36.2	-32.6	0	0	0	112.3	E125	E125-P127 VanDerWaalsContact O-CD 3.29Å; E125-P127 WeakPolarHBondContact O-CD 3.23Å
128	A	29.8	Very low	31.7	Very low	83 Å²	83	144.6 Å²	144.6	69%	0.686	79%	0.793	S	S	*	*			trans	-102.1	-175.6	173	0	0	0	0	0	111.8
129	F	33.2	Very low	31.7	Very low	200 Å²	200	140.4 Å²	140.4	88%	0.877	80%	0.795	S	S	*	*			trans	71.4	146.9	178.9	-79.1	-115.3	0	0	0	115.8
130	S	33.6	Very low	31.8	Very low	91 Å²	91	139.8 Å²	139.8	64%	0.636	80%	0.801	S	S	*	*			cis	-164.6	166	-22.5	-116.9	0	0	0	0	112.7
131	A	29.9	Very low	31.8	Very low	90 Å²	90	141.5 Å²	141.5	74%	0.744	81%	0.811	S	S	*	*			trans	26.9	114	152.4	0	0	0	0	0	119.9
132	W	34.8	Very low	31.8	Very low	259 Å²	259	140.2 Å²	140.2	98%	0.981	81%	0.809	S	S	*	*			trans	-113.8	138.4	143.9	-98.4	62.7	0	0	0	109.7	T134	W132-T134 PolarHBondContact O-N 3.41Å
133	G	31.3	Very low	31.6	Very low	70 Å²	70	140.5 Å²	140.5	72%	0.722	81%	0.812	S	S	*	*			trans	-61.4	123	-153.9	0	0	0	0	0	116.9	S135	G133-S135 VanDerWaalsContact C-N 3.34Å; G133-S135 PolarHBondContact O-N 2.8Å
134	T	30.6	Very low	31.3	Very low	146 Å²	146	135.8 Å²	135.8	90%	0.896	80%	0.804	S	S	*	*			trans	-78	83.2	151.2	50.1	0	0	0	0	109.8	W132 G136	W132-T134 PolarHBondContact O-N 3.41Å; T134-G136 PolarHBondContact O-N 3.03Å
135	S	29.2	Very low	31.1	Very low	124 Å²	124	135.2 Å²	135.2	87%	0.867	80%	0.803	S	S	*	*			trans	-89.2	92	161.9	-66.5	0	0	0	0	108.4	G133	G133-S135 VanDerWaalsContact C-N 3.34Å; G133-S135 PolarHBondContact O-N 2.8Å
136	G	29.9	Very low	31.2	Very low	76 Å²	76	129.6 Å²	129.6	78%	0.784	79%	0.789	S	S	*	*			trans	-89.8	158.9	178.4	0	0	0	0	0	112.9	T134	T134-G136 PolarHBondContact O-N 3.03Å
137	S	30.9	Very low	31	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	80%	0.796	S	S	*	*			trans	-140.8	122.9	155.1	56.2	0	0	0	0	108.8
138	Q	30.4	Very low	30.6	Very low	185 Å²	185	132.4 Å²	132.4	86%	0.864	80%	0.8	S	S	*	*			trans	-68.2	141.2	169	-69.1	170.1	-39.3	0	0	109.2	Q140	Q138-Q140 PolarHBondContact O-N 2.99Å
139	G	29.2	Very low	30.5	Very low	81 Å²	81	131.8 Å²	131.8	84%	0.835	80%	0.802	S	S	*	*			trans	-75.5	115.7	163.8	0	0	0	0	0	110.3
140	Q	29.4	Very low	30.6	Very low	185 Å²	185	127.2 Å²	127.2	86%	0.864	80%	0.795	S	S	*	*			trans	-125	165.1	155.8	-82.5	-160.8	-10.7	0	0	110.3	Q138	Q138-Q140 PolarHBondContact O-N 2.99Å
141	Q	33.8	Very low	30.6	Very low	174 Å²	174	133.1 Å²	133.1	81%	0.813	81%	0.805	S	S	*	*			trans	-96.3	155.3	-154.7	-56.8	170.1	-24.9	0	0	113.9
142	T	28.1	Very low	30.8	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	81%	0.807	S	S	*	*				-169.4	132	128.1	26	0	0	0	0	106.5
143	Q	29.3	Very low	30.7	Very low	163 Å²	163	132.4 Å²	132.4	76%	0.762	80%	0.801	S	S	*	*				59.8	145.6	67.1	-64	-161.2	36.1	0	0	113.5
144	S	28.5	Very low	31.7	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	80%	0.803	S	S	*	*			cis	-128.3	178.7	1.9	-51.6	0	0	0	0	109.3
145	S	32.3	Very low	32.8	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	80%	0.797	S	S	*	*			cis	-144.7	-171.4	8.7	-50.2	0	0	0	0	107.7
146	A	29.3	Very low	33.3	Very low	74 Å²	74	132.6 Å²	132.6	61%	0.612	79%	0.792	S	S	*	*			cis	-150.8	177.7	-0.8	0	0	0	0	0	106.7
147	Y	29.8	Very low	33.7	Very low	238 Å²	238	134.1 Å²	134.1	93%	0.933	79%	0.791	S	S	*	*			cis	-134.8	166.5	6	-86.1	-85	0	0	0	108.7
148	G	28.3	Very low	33.8	Very low	76 Å²	76	137 Å²	137	78%	0.784	80%	0.795	S	S	*	*			cis	169.5	-21.3	-4	0	0	0	0	0	115.9
149	G	28.9	Very low	33.6	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	79%	0.789	S	S	*	*			trans	-163.4	158.4	179.2	0	0	0	0	0	115.5
150	S	35.4	Very low	33.6	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	79%	0.787	S	S	*	*			cis	-168.5	144.8	-8	54.8	0	0	0	0	114.3
151	Y	34.2	Very low	33.7	Very low	215 Å²	215	128.6 Å²	128.6	84%	0.843	78%	0.783	S	S	*	*			trans	69.6	109.4	158.3	-66	-64.7	0	0	0	123.1
152	S	32.4	Very low	33.7	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	79%	0.787	S	S	*	*				56.2	131.1	124.4	-56.9	0	0	0	0	125.6
153	Y	34.2	Very low	34	Very low	222 Å²	222	128.7 Å²	128.7	87%	0.871	79%	0.788	S	S	*	*			trans	-49	167.5	154.7	-81.4	-74.4	0	0	0	115.4
154	P	52.5	Low	35	Very low	115 Å²	115	126.8 Å²	126.8	75%	0.747	79%	0.79	S	S	*	*			cis	-137.6	-131.2	40.2	32.8	-5	0	0	0	117.1
155	P	52.9	Low	35.1	Very low	119 Å²	119	129.9 Å²	129.9	77%	0.773	80%	0.799	S	S	*	*				-127.2	-163.2	-105.9	43.8	-25.9	0	0	0	115.8
156	S	40.2	Very low	35.1	Very low	110 Å²	110	127 Å²	127	77%	0.769	79%	0.787	S	S	*	*			trans	-65.7	165.8	-170.5	-45.4	0	0	0	0	118.4
157	S	36.8	Very low	35.2	Very low	108 Å²	108	132 Å²	132	76%	0.755	80%	0.798	S	S	*	*			trans	97.8	154.2	157.1	80.3	0	0	0	0	118.3
158	L	34	Very low	35.4	Very low	179 Å²	179	127.6 Å²	127.6	94%	0.937	80%	0.796	S	S	*	*			trans	65.6	151.5	-171.7	-63.9	153.2	0	0	0	115.1
159	G	26.7	Very low	35.5	Very low	70 Å²	70	127.4 Å²	127.4	72%	0.722	79%	0.794	S	S	*	*			cis	157.7	93.7	-11.7	0	0	0	0	0	115.2
160	G	28.2	Very low	35.7	Very low	78 Å²	78	133.2 Å²	133.2	80%	0.804	80%	0.8	S	S	*	*			trans	74.8	126.8	154.4	0	0	0	0	0	119.2
161	T	31.5	Very low	35.5	Very low	128 Å²	128	136.9 Å²	136.9	79%	0.785	81%	0.805	S	S	*	*			trans	-143.3	109.3	154.2	49.6	0	0	0	0	111.9
162	L	34.2	Very low	35.4	Very low	171 Å²	171	131 Å²	131	90%	0.895	80%	0.795	S	S	*	*			trans	68.3	139.1	143.3	-55.6	171.8	0	0	0	120.6
163	V	35.2	Very low	35.4	Very low	136 Å²	136	132 Å²	132	82%	0.824	79%	0.792	S	S	*	*			trans	-129.8	131.9	177.2	167.8	0	0	0	0	107.7
164	P	49.7	Very low	35.3	Very low	122 Å²	122	127.6 Å²	127.6	79%	0.792	79%	0.788	S	S	*	*				-142.6	164.7	116.3	36.1	-22.2	0	0	0	112.1
165	D	30.9	Very low	34.4	Very low	162 Å²	162	128.9 Å²	128.9	87%	0.866	79%	0.788	S	S	*	*			cis	-164.7	164.2	-17.4	173.6	33.3	0	0	0	106.3
166	G	30.9	Very low	33.6	Very low	56 Å²	56	130.4 Å²	130.4	58%	0.577	79%	0.79	S	S	*	*			trans	124.6	89.9	162.9	0	0	0	0	0	119.8
167	Q	31.3	Very low	33.2	Very low	180 Å²	180	134.6 Å²	134.6	84%	0.841	79%	0.794	S	S	*	*			trans	54.3	133.8	131.9	-70	-171.2	-10.1	0	0	124.8
168	T	34.4	Very low	33.2	Very low	146 Å²	146	133.4 Å²	133.4	90%	0.896	79%	0.791	S	S	*	*			trans	69.1	149.8	158.6	64.3	0	0	0	0	118.5
169	G	30.8	Very low	33.6	Very low	71 Å²	71	131 Å²	131	73%	0.732	79%	0.786	S	S	*	*			cis	-171	178.2	-1.4	0	0	0	0	0	113
170	F	32.5	Very low	33.7	Very low	194 Å²	194	131.2 Å²	131.2	85%	0.851	79%	0.787	S	S	*	*			trans	-66.7	162.4	178.4	-62.2	-94.9	0	0	0	112.2
171	H	32.7	Very low	33.8	Very low	179 Å²	179	136.5 Å²	136.5	83%	0.829	79%	0.794	S	S	*	*			cis	-156.7	179.8	46.9	-88.3	-83.3	0	0	0	114.5
172	S	31.9	Very low	33.9	Very low	91 Å²	91	138.5 Å²	138.5	64%	0.636	80%	0.799	S	S	*	*			trans	-106.5	-178.4	-177.5	53	0	0	0	0	114.6
173	D	32	Very low	33.9	Very low	135 Å²	135	134.9 Å²	134.9	72%	0.722	79%	0.788	S	S	*	*			trans	76.3	128.3	164.1	-52.7	-70.8	0	0	0	117.2
174	T	31.1	Very low	33.9	Very low	130 Å²	130	135.2 Å²	135.2	80%	0.798	79%	0.785	S	S	*	*				-164.3	164.7	64.6	30	0	0	0	0	114.8
175	L	35.2	Very low	33.2	Very low	141 Å²	141	135.9 Å²	135.9	74%	0.738	78%	0.777	S	S	*	*			trans	-15.8	142.3	170.7	-79	70.5	0	0	0	118.9
176	N	34.5	Very low	33.6	Very low	152 Å²	152	136.7 Å²	136.7	81%	0.813	78%	0.776	S	S	*	*				-158.5	158.1	70.5	-104.8	-67.1	0	0	0	118.7
177	K	32.3	Very low	33.7	Very low	198 Å²	198	137.7 Å²	137.7	86%	0.861	79%	0.787	S	S	*	*			trans	-71.7	167.3	165.8	-82.5	177.3	173.4	174.9	0	111.6
178	A	37.6	Very low	33.7	Very low	83 Å²	83	137.1 Å²	137.1	69%	0.686	79%	0.786	S	S	*	*			cis	-171.4	-143.9	-22.2	0	0	0	0	0	107.8
179	P	42.3	Very low	34	Very low	129 Å²	129	136.2 Å²	136.2	84%	0.838	78%	0.78	S	S	*	*				-127.8	168.6	-97.2	39.4	-23.9	0	0	0	116.4
180	G	29.3	Very low	34	Very low	73 Å²	73	136.1 Å²	136.1	75%	0.753	78%	0.779	S	S	*	*				106.7	118.9	130	0	0	0	0	0	119.1
181	M	30.1	Very low	34	Very low	190 Å²	190	134.2 Å²	134.2	94%	0.936	78%	0.777	S	S	*	*			trans	-148.3	130.9	150.4	-98.3	169.9	66.2	0	0	107.6
182	N	33.9	Very low	33.9	Very low	169 Å²	169	133.9 Å²	133.9	90%	0.904	77%	0.773	S	S	*	*			trans	-111.4	162.7	-174.1	-82.6	-14.2	0	0	0	112.5
183	S	32.8	Very low	33.7	Very low	95 Å²	95	137 Å²	137	66%	0.664	78%	0.781	S	S	*	*			trans	-82.5	157	-179.5	-171.1	0	0	0	0	114
184	L	35.2	Very low	33.5	Very low	143 Å²	143	133.9 Å²	133.9	75%	0.749	78%	0.781	S	S	*	*			trans	171.8	130	140.1	-106	57.4	0	0	0	105.5
185	E	35.1	Very low	33.3	Very low	136 Å²	136	131.1 Å²	131.1	64%	0.636	78%	0.778	S	S	*	*				61.5	145.4	64.3	-57.9	163.9	-115	0	0	112.6
186	Q	38.7	Very low	32.9	Very low	179 Å²	179	131.5 Å²	131.5	84%	0.836	78%	0.781	S	S	*	*			cis	-164.8	171.4	-10.1	-107.7	-178.2	53.5	0	0	105.8
187	G	33	Very low	32.9	Very low	78 Å²	78	129.9 Å²	129.9	80%	0.804	78%	0.776	S	S	*	*			trans	169	131.4	167.8	0	0	0	0	0	115.8
188	M	33.3	Very low	32.8	Very low	167 Å²	167	127 Å²	127	82%	0.823	78%	0.775	S	S	*	*			trans	-157.3	156	-169.7	-157.1	-179.2	69.2	0	0	113.2
189	V	39.3	Very low	32.5	Very low	127 Å²	127	126 Å²	126	77%	0.77	77%	0.774	S	S	*	*			trans	58.1	147.3	163.5	-78.8	0	0	0	0	122.4
190	G	31.2	Very low	31.9	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	78%	0.78	S	S	*	*			trans	142.8	105.8	165.1	0	0	0	0	0	111.4
191	L	33.5	Very low	31.8	Very low	154 Å²	154	129.6 Å²	129.6	81%	0.806	78%	0.778	S	S	*	*			cis	106.6	120	29.7	-79.6	170.3	0	0	0	113.8
192	K	29.7	Very low	31.8	Very low	171 Å²	171	127.1 Å²	127.1	74%	0.743	78%	0.779	S	S	*	*			trans	73.2	128.3	143.9	-76.9	-178.7	164.4	-172	0	122.8
193	I	28.6	Very low	31.6	Very low	158 Å²	158	122.8 Å²	122.8	81%	0.81	78%	0.775	S	S	*	*				67.1	141.4	128.8	-60.4	171.2	0	0	0	117.6
194	G	27.6	Very low	31.4	Very low	69 Å²	69	124.6 Å²	124.6	71%	0.711	78%	0.781	S	S	*	*			cis	160.5	178.4	-3	0	0	0	0	0	112.1
195	G	27.2	Very low	31.2	Very low	71 Å²	71	126.8 Å²	126.8	73%	0.732	79%	0.785	S	S	*	*			trans	82.7	151	-176.1	0	0	0	0	0	113.8
196	D	27	Very low	30.8	Very low	150 Å²	150	124.7 Å²	124.7	80%	0.802	79%	0.791	S	S	*	*			cis	-154.5	150.9	-2.1	-114.4	-43.7	0	0	0	112.6
197	V	33.6	Very low	30.3	Very low	117 Å²	117	123.1 Å²	123.1	71%	0.709	79%	0.793	S	S	*	*				27.1	135.7	129.6	163	0	0	0	0	119
198	T	29.6	Very low	30	Very low	137 Å²	137	122.5 Å²	122.5	84%	0.84	79%	0.786	S	S	*	*			cis	-167.1	170.1	-2	26.3	0	0	0	0	107.9
199	G	30.9	Very low	29.7	Very low	64 Å²	64	120 Å²	120	66%	0.66	79%	0.786	S	S	*	*			cis	159.3	163.2	-2.4	0	0	0	0	0	112.4
200	Q	29.9	Very low	29.3	Very low	209 Å²	209	120.5 Å²	120.5	98%	0.977	79%	0.789	S	S	*	*			trans	64	153.4	173	-59.2	-178	-20.9	0	0	117.9
201	G	28.6	Very low	29.3	Very low	68 Å²	68	125.3 Å²	125.3	70%	0.701	80%	0.796	S	S	*	*			cis	-159	140.8	-7.5	0	0	0	0	0	110.2
202	S	29.6	Very low	29.1	Very low	137 Å²	137	121.6 Å²	121.6	96%	0.958	80%	0.795	S	S	*	*				73.9	115.3	91.3	-162.1	0	0	0	0	115.6
203	G	28.8	Very low	29	Very low	79 Å²	79	117.1 Å²	117.1	81%	0.814	80%	0.797	S	S	*	*			trans	-178.5	109.2	179.4	0	0	0	0	0	115.7
204	V	28.9	Very low	30.2	Very low	133 Å²	133	116.1 Å²	116.1	81%	0.806	80%	0.801	S	S	*	*			trans	-75.9	178.1	176	-67.6	0	0	0	0	112.6
205	K	30.6	Very low	30.4	Very low	189 Å²	189	117.8 Å²	117.8	82%	0.822	81%	0.808	S	S	*	*			cis	-173.6	140.8	24	-148.3	170.5	-171.6	179	0	112.8
206	A	26.9	Very low	30.5	Very low	92 Å²	92	121.1 Å²	121.1	76%	0.76	81%	0.814	S	S	*	*			trans	46.3	-177.5	148.4	0	0	0	0	0	120.7
207	V	27.9	Very low	30.6	Very low	145 Å²	145	118.5 Å²	118.5	88%	0.879	81%	0.813	S	S	*	*			cis	-152.8	157.3	6.6	-158.8	0	0	0	0	110.6
208	G	27.4	Very low	30.4	Very low	65 Å²	65	117 Å²	117	67%	0.67	81%	0.813	S	S	*	*			trans	85.7	137.9	157	0	0	0	0	0	116.9
209	S	28.1	Very low	30.4	Very low	115 Å²	115	117.4 Å²	117.4	80%	0.804	82%	0.815	S	S	*	*			cis	70.8	135.9	28.4	-146	0	0	0	0	113.5
210	V	31	Very low	30.3	Very low	138 Å²	138	118.1 Å²	118.1	84%	0.836	82%	0.823	S	S	*	*			cis	-144.3	-176.3	33.4	-144	0	0	0	0	113.5
211	I	30.2	Very low	30.4	Very low	171 Å²	171	116.7 Å²	116.7	88%	0.877	82%	0.822	S	S	*	*			trans	-96.6	151.6	-174.6	-63.5	159	0	0	0	112
212	G	28.9	Very low	30.6	Very low	76 Å²	76	117 Å²	117	78%	0.784	83%	0.825	S	S	*	*			trans	-157.5	138.4	169	0	0	0	0	0	113.8
213	G	27.8	Very low	30.8	Very low	77 Å²	77	115.4 Å²	115.4	79%	0.794	82%	0.82	S	S	*	*			trans	-102	-170.9	-172.5	0	0	0	0	0	116.4
214	P	54.3	Low	31.3	Very low	136 Å²	136	118 Å²	118	88%	0.883	82%	0.82	S	S	*	*			trans	-106.5	157.4	-156.6	39.3	-35.4	0	0	0	116.4
215	A	30.6	Very low	32	Very low	105 Å²	105	117 Å²	117	87%	0.868	82%	0.816	S	S	*	*			trans	-154.7	170.5	161.4	0	0	0	0	0	112.1
216	V	29.8	Very low	32.2	Very low	140 Å²	140	115.9 Å²	115.9	85%	0.848	82%	0.818	S	S	*	*			trans	-108.5	160.4	-160.4	-71.3	0	0	0	0	116
217	A	29	Very low	32.5	Very low	95 Å²	95	114.9 Å²	114.9	79%	0.785	82%	0.816	S	S	*	*			trans	86.7	148.5	141.7	0	0	0	0	0	123.2
218	A	30.1	Very low	32.9	Very low	85 Å²	85	116.9 Å²	116.9	70%	0.702	82%	0.818	S	S	*	*			trans	78.8	102.1	147.9	0	0	0	0	0	122.3
219	T	28.9	Very low	33.8	Very low	146 Å²	146	119.1 Å²	119.1	90%	0.896	82%	0.821	S	S	*	*			trans	35.5	123.2	130.3	54.9	0	0	0	0	122.1
220	G	29.7	Very low	34.9	Very low	79 Å²	79	119.2 Å²	119.2	81%	0.814	82%	0.819	S	S	*	*			trans	175.2	127.1	155.9	0	0	0	0	0	113.7
221	N	32.5	Very low	35.6	Very low	180 Å²	180	118.6 Å²	118.6	96%	0.963	82%	0.818	S	S	*	*			trans	-90.1	140.2	173.4	-78.8	-21.6	0	0	0	110.9
222	G	32.6	Very low	36.5	Very low	73 Å²	73	119.6 Å²	119.6	75%	0.753	82%	0.816	S	S	*	*			trans	171.3	104.1	166	0	0	0	0	0	117.4
223	A	32.6	Very low	37.6	Very low	105 Å²	105	120.7 Å²	120.7	87%	0.868	81%	0.809	S	S	*	*			trans	62.5	158.6	158.8	0	0	0	0	0	120.1
224	T	39.3	Very low	39	Very low	132 Å²	132	124 Å²	124	81%	0.81	81%	0.814	S	S	*	*			trans	-121.2	161.2	167.6	60.1	0	0	0	0	108.7
225	P	43.5	Very low	39	Very low	112 Å²	112	120.9 Å²	120.9	73%	0.727	80%	0.795	S	S	*	*				-147.5	152.8	97.3	34.4	-16.4	0	0	0	116.7
226	I	34.7	Very low	40	Very low	167 Å²	167	126.8 Å²	126.8	86%	0.856	80%	0.795	S	S	*	*			trans	53.8	99.6	143.6	-55	166.7	0	0	0	118.7
227	G	33.6	Very low	41.5	Very low	70 Å²	70	123.8 Å²	123.8	72%	0.722	79%	0.785	S	S	*	*				94.2	83	100.4	0	0	0	0	0	120.7
228	M	37.1	Very low	42.7	Very low	188 Å²	188	121.7 Å²	121.7	93%	0.926	77%	0.768	S	S	*	*			trans	-147.5	155.6	143.5	-92.6	-130	170.5	0	0	110.7
229	P	46.4	Very low	44	Very low	112 Å²	112	123.2 Å²	123.2	73%	0.727	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-77.5	147.6	-170.5	30.7	-35.7	0	0	0	113.5
230	P	51.1	Low	44.9	Very low	116 Å²	116	120.7 Å²	120.7	75%	0.753	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-72.2	149	178.1	30.2	-35.3	0	0	0	112.5
231	P	45.3	Very low	46	Very low	126 Å²	126	121.2 Å²	121.2	82%	0.818	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-67.5	151	176.9	28.7	-35	0	0	0	112.3
232	K	49.7	Very low	47.2	Very low	192 Å²	192	121.2 Å²	121.2	84%	0.835	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-70.6	139.8	177	-62.7	176.4	-177.7	175.1	0	110.5	T234	K232-T234 PolarHBondContact O-N 3.41Å
233	P	52.2	Low	47.7	Very low	98 Å²	98	123.5 Å²	123.5	64%	0.636	74%	0.741	S	S	*	*			trans	-76.6	107.6	178.6	29.9	-33.8	0	0	0	111.8	S235 A238	P233-S235 VanDerWaalsContact C-N 3.3Å; P233-S235 PolarHBondContact O-N 2.6Å; P233-S235 VanDerWaalsContact O-N 3.17Å; P233-A238 HydrophobicContact CB-CB 4.26Å
234	T	55.7	Low	47.9	Very low	146 Å²	146	123.4 Å²	123.4	90%	0.896	74%	0.741	S	S	*	*			trans	-87.4	63.9	172.8	-47.1	0	0	0	0	110.9	K232	K232-T234 PolarHBondContact O-N 3.41Å
235	S	54.7	Low	48.1	Very low	71 Å²	71	126.3 Å²	126.3	50%	0.497	74%	0.742	S	S	.	*			trans	-158.7	132.2	169.7	-178.3	0	0	0	0	112	P233 A237 A238	P233-S235 VanDerWaalsContact C-N 3.3Å; P233-S235 PolarHBondContact O-N 2.6Å; P233-S235 VanDerWaalsContact O-N 3.17Å; S235-A237 PolarHBondContact O-N 3.1Å; S235-A238 PolarHBondContact O-N 2.88Å
236	W	52.8	Low	47.9	Very low	229 Å²	229	127.1 Å²	127.1	87%	0.867	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-62.2	-31.5	-177.9	-150.2	-126.5	0	0	0	112.8	A238 I239	W236-A238 PolarHBondContact O-N 3.34Å; W236-I239 HydrophobicContact CE3-CD1 4.16Å; W236-I239 HydrophobicContact CZ3-CD1 4.23Å; W236-I239 PolarHBondContact O-N 2.84Å
237	A	60.7	Low	47.8	Very low	77 Å²	77	128.2 Å²	128.2	64%	0.636	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-63	-23.9	179.4	0	0	0	0	0	113.9	S235 I239	S235-A237 PolarHBondContact O-N 3.1Å; A237-I239 VanDerWaalsContact C-N 3.3Å; A237-I239 PolarHBondContact O-N 2.94Å
238	A	53.2	Low	47.9	Very low	52 Å²	52	132.7 Å²	132.7	43%	0.43	75%	0.751	S	S	.	*	G	3₁₀ helix	trans	-79.9	-7.8	-177.3	0	0	0	0	0	114.3	P233 S235 W236	P233-A238 HydrophobicContact CB-CB 4.26Å; S235-A238 PolarHBondContact O-N 2.88Å; W236-A238 PolarHBondContact O-N 3.34Å
239	I	57.7	Low	47.8	Very low	116 Å²	116	131.9 Å²	131.9	60%	0.595	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-33.3	-174	-59.9	177.9	0	0	0	111.7	W236 A237 S241	W236-I239 HydrophobicContact CE3-CD1 4.16Å; W236-I239 HydrophobicContact CZ3-CD1 4.23Å; W236-I239 PolarHBondContact O-N 2.84Å; A237-I239 VanDerWaalsContact C-N 3.3Å; A237-I239 PolarHBondContact O-N 2.94Å; I239-S241 PolarHBondContact O-N 2.98Å
240	A	48.2	Very low	47.1	Very low	93 Å²	93	135.7 Å²	135.7	77%	0.769	76%	0.755	S	S	*	*	S	Bend	trans	-80.3	-13.6	-171.6	0	0	0	0	0	115.5
241	S	52.3	Low	46.3	Very low	91 Å²	91	135.8 Å²	135.8	64%	0.636	76%	0.758	S	S	*	*			trans	-104.4	38	-162	74.6	0	0	0	0	115.5	I239	I239-S241 PolarHBondContact O-N 2.98Å
242	K	57.6	Low	45.5	Very low	179 Å²	179	139.8 Å²	139.8	78%	0.778	76%	0.763	S	S	*	*			trans	-129.7	123.9	178.6	-72	-176	179.5	175.7	0	112.4
243	P	44.3	Very low	44.7	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	76%	0.76	S	S	*	*			trans	-75.4	137.1	179.2	30.8	-34.4	0	0	0	111.5
244	A	36.9	Very low	43.6	Very low	104 Å²	104	141.4 Å²	141.4	86%	0.86	77%	0.77	S	S	*	*			trans	-71.4	139.8	175.6	0	0	0	0	0	111.7
245	K	43	Very low	42.7	Very low	192 Å²	192	140.1 Å²	140.1	84%	0.835	77%	0.765	S	S	*	*			trans	-124.9	142.7	165.2	-78.8	-173.4	174.5	-178.8	0	109.4	Q247	K245-Q247 PolarHBondContact O-N 2.96Å
246	P	38.1	Very low	41.6	Very low	129 Å²	129	140.5 Å²	140.5	84%	0.838	78%	0.78	S	S	*	*			trans	-71.8	127.5	-172.7	28.4	-34.8	0	0	0	111.6
247	Q	33.6	Very low	40.7	Very low	190 Å²	190	138.6 Å²	138.6	89%	0.888	78%	0.783	S	S	*	*			trans	-93.3	114.7	175.8	-174.3	165.9	-14.5	0	0	110.4	K245	K245-Q247 PolarHBondContact O-N 2.96Å
248	Q	36.3	Very low	39.8	Very low	164 Å²	164	140.6 Å²	140.6	77%	0.766	79%	0.789	S	S	*	*			trans	-70.3	144.5	175.7	-67.1	-177.7	-15.3	0	0	111.6
249	L	34.8	Very low	39	Very low	171 Å²	171	145.1 Å²	145.1	90%	0.895	81%	0.806	S	S	*	*			trans	-64	138	168.7	-75	81.7	0	0	0	110.1
250	K	31.3	Very low	38.2	Very low	193 Å²	193	145.3 Å²	145.3	84%	0.839	82%	0.815	S	S	*	*			trans	-127.6	103.1	161.6	-72.6	-171.4	176	-177.9	0	109.1
251	S	32.8	Very low	37.3	Very low	118 Å²	118	144.4 Å²	144.4	83%	0.825	82%	0.815	S	S	*	*			trans	-68.3	154.5	169.7	47.7	0	0	0	0	110.7
252	K	29.6	Very low	36.4	Very low	209 Å²	209	144 Å²	144	91%	0.909	83%	0.825	S	S	*	*			trans	-142.1	116.1	175.6	-167.5	175	-176.2	179.7	0	109.4
253	V	33.3	Very low	35.2	Very low	130 Å²	130	140 Å²	140	79%	0.788	83%	0.825	S	S	*	*			trans	-126.7	146.8	-178.1	178.5	0	0	0	0	109
254	K	28.2	Very low	35.1	Very low	195 Å²	195	142.2 Å²	142.2	85%	0.848	83%	0.829	S	S	*	*			trans	-152.4	160.3	168.4	-116.7	-163	174.5	-170.9	0	109
255	P	38.2	Very low	35.8	Very low	119 Å²	119	143 Å²	143	77%	0.773	83%	0.825	S	S	*	*				-129.2	164.6	-98.9	39.4	-25.8	0	0	0	115.4
256	G	30	Very low	35.7	Very low	79 Å²	79	139.5 Å²	139.5	81%	0.814	82%	0.822	S	S	*	*			trans	-160	148.4	168	0	0	0	0	0	110.7
257	M	34.5	Very low	35.8	Very low	188 Å²	188	139.1 Å²	139.1	93%	0.926	82%	0.82	S	S	*	*			trans	-105.5	172.5	-178.4	-118.6	117.6	78	0	0	110.9
258	P	42.1	Very low	36.6	Very low	120 Å²	120	135.4 Å²	135.4	78%	0.779	81%	0.812	S	S	*	*			cis	-127.2	179.6	-3.3	39.9	-23.9	0	0	0	114.6
259	N	35.8	Very low	36.6	Very low	147 Å²	147	134 Å²	134	79%	0.786	81%	0.809	S	S	*	*			trans	-92.2	151.3	170.8	-154.8	46.8	0	0	0	110
260	P	41.3	Very low	36.4	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	80%	0.8	S	S	*	*				-153.3	170.2	94.3	40.9	-24	0	0	0	116.5
261	G	29.9	Very low	36.8	Very low	74 Å²	74	131.6 Å²	131.6	76%	0.763	79%	0.793	S	S	*	*			trans	91.1	143.5	162.2	0	0	0	0	0	115.1
262	G	31.9	Very low	36.9	Very low	82 Å²	82	133.6 Å²	133.6	85%	0.845	79%	0.794	S	S	*	*			trans	-152.2	152.1	178.2	0	0	0	0	0	112.7
263	A	32.4	Very low	37.6	Very low	94 Å²	94	132.3 Å²	132.3	78%	0.777	79%	0.794	S	S	*	*			trans	-156.9	125.1	172.4	0	0	0	0	0	111.7
264	L	42.3	Very low	37.8	Very low	168 Å²	168	133.9 Å²	133.9	88%	0.88	80%	0.798	S	S	*	*			trans	51.5	142.2	146.5	-54.8	176.5	0	0	0	122.1
265	P	52.7	Low	38	Very low	120 Å²	120	132.4 Å²	132.4	78%	0.779	80%	0.797	S	S	*	*			trans	-98.5	159	171.4	38.9	-34.1	0	0	0	113.8
266	P	39.5	Very low	38	Very low	119 Å²	119	129.6 Å²	129.6	77%	0.773	79%	0.791	S	S	*	*			trans	-110.9	157.9	159.3	36.9	-28.9	0	0	0	113.3
267	P	42	Very low	38.2	Very low	122 Å²	122	132 Å²	132	79%	0.792	79%	0.789	S	S	*	*			trans	-109.4	-143.2	-173.4	46.5	-36.5	0	0	0	112.4
268	P	49.3	Very low	38.2	Very low	111 Å²	111	134.2 Å²	134.2	72%	0.721	79%	0.788	S	S	*	*			trans	-122	-153.6	-133.2	27.2	0.2	0	0	0	114.2
269	I	36.3	Very low	37.7	Very low	135 Å²	135	133.7 Å²	133.7	69%	0.692	78%	0.778	S	S	*	*			trans	107.4	103.5	150.8	-68.8	171.9	0	0	0	119.9
270	K	31.9	Very low	37.5	Very low	162 Å²	162	135.1 Å²	135.1	70%	0.704	78%	0.777	S	S	*	*			trans	77.3	130.2	131.9	-66.1	-176.2	-171.9	179.6	0	125.2
271	H	39.6	Very low	36.9	Very low	152 Å²	152	132.9 Å²	132.9	70%	0.704	78%	0.777	S	S	*	*			trans	37.3	140.6	136.9	-36.2	-48.9	0	0	0	123.5
272	N	33.4	Very low	38	Very low	159 Å²	159	135.3 Å²	135.3	85%	0.85	78%	0.779	S	S	*	*				-172.2	155.4	107.6	-101.6	2.4	0	0	0	114.5
273	M	45.3	Very low	38	Very low	183 Å²	183	138.3 Å²	138.3	90%	0.901	78%	0.781	S	S	*	*			trans	-113.6	155.7	154.9	-69.4	-167.2	-64.1	0	0	108.4
274	N	37.8	Very low	37.9	Very low	163 Å²	163	139.8 Å²	139.8	87%	0.872	78%	0.78	S	S	*	*			trans	-154.6	171.4	156.7	-149.7	-0.2	0	0	0	112.9
275	I	32.6	Very low	37.5	Very low	163 Å²	163	140.2 Å²	140.2	84%	0.836	78%	0.775	S	S	*	*			trans	-135.8	154	-166.3	-171.3	168.9	0	0	0	112
276	G	37.1	Very low	36.5	Very low	61 Å²	61	140.2 Å²	140.2	63%	0.629	77%	0.772	S	S	*	*			trans	105.4	161.1	170.9	0	0	0	0	0	115.5
277	T	33.8	Very low	36.2	Very low	128 Å²	128	138.7 Å²	138.7	79%	0.785	77%	0.769	S	S	*	*			cis	-165.2	144.2	-9.9	21.1	0	0	0	0	110.9
278	W	34.3	Very low	35.6	Very low	235 Å²	235	140 Å²	140	89%	0.89	78%	0.776	S	S	*	*			trans	28.4	126.4	152.7	-61.9	91.7	0	0	0	123
279	D	31.8	Very low	34.7	Very low	109 Å²	109	139 Å²	139	58%	0.583	78%	0.777	S	S	*	*				141.9	151.3	106.2	-149.1	-137.3	0	0	0	117.6
280	K	31.5	Very low	35.7	Very low	177 Å²	177	137.8 Å²	137.8	77%	0.77	78%	0.777	S	S	*	*			trans	-9	146.1	172.3	-61.8	165.8	-159.8	72.3	0	122.3
281	G	28.8	Very low	35.6	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	78%	0.779	S	S	*	*			trans	177.7	124.6	150.9	0	0	0	0	0	114.4
282	P	53.4	Low	35.3	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	78%	0.777	S	S	*	*			trans	-122.2	156.4	-162.9	40.8	-30.1	0	0	0	117
283	V	32.9	Very low	35.3	Very low	145 Å²	145	135.3 Å²	135.3	88%	0.879	77%	0.767	S	S	*	*			trans	-145.4	129.9	150.4	-119.4	0	0	0	0	115
284	T	30.7	Very low	34.7	Very low	124 Å²	124	134.5 Å²	134.5	76%	0.761	76%	0.762	S	S	*	*			trans	-58.9	169.7	161.8	37.6	0	0	0	0	115
285	K	33.2	Very low	34.3	Very low	178 Å²	178	135.3 Å²	135.3	77%	0.774	76%	0.76	S	S	*	*			cis	169.6	167.4	-10.4	-178	-165.7	-177.8	-177.1	0	108
286	V	30.6	Very low	35.2	Very low	119 Å²	119	132.8 Å²	132.8	72%	0.721	75%	0.754	S	S	*	*			trans	72.6	129.7	166.6	-164.8	0	0	0	0	114.8
287	A	34.6	Very low	34.9	Very low	87 Å²	87	137.5 Å²	137.5	72%	0.719	76%	0.764	S	S	*	*			cis	100.3	125.2	8.1	0	0	0	0	0	118
288	T	29.3	Very low	34.8	Very low	150 Å²	150	134.5 Å²	134.5	92%	0.92	76%	0.759	S	S	*	*			trans	-152.6	156.3	171.1	15.1	0	0	0	0	111.8
289	A	29.4	Very low	34.8	Very low	91 Å²	91	131 Å²	131	75%	0.752	76%	0.757	S	S	*	*			trans	-149.9	-160.9	178.3	0	0	0	0	0	107.1
290	P	57.3	Low	35.8	Very low	108 Å²	108	129.8 Å²	129.8	70%	0.701	76%	0.755	S	S	*	*			cis	-134.9	-142	-10.7	35.4	-11.8	0	0	0	112.5
291	L	31	Very low	36	Very low	142 Å²	142	130.1 Å²	130.1	74%	0.743	76%	0.759	S	S	*	*			trans	88.3	143.2	164.2	-53	167.8	0	0	0	116.9
292	Q	32.6	Very low	36.1	Very low	141 Å²	141	130.1 Å²	130.1	66%	0.659	76%	0.758	S	S	*	*			cis	-162.8	166.7	-10.1	-130.5	-179.9	1.4	0	0	113.6
293	Q	33	Very low	35.1	Very low	138 Å²	138	132.8 Å²	132.8	65%	0.645	76%	0.762	S	S	*	*			trans	66.9	154.2	152.6	-70.1	167.1	6.1	0	0	118.3
294	Q	32.6	Very low	35.9	Very low	167 Å²	167	131.3 Å²	131.3	78%	0.78	76%	0.755	S	S	*	*			cis	-149.6	171.2	-2.8	-130.3	159.3	29	0	0	111.8
295	Q	29.8	Very low	37.1	Very low	179 Å²	179	130.5 Å²	130.5	84%	0.836	75%	0.753	S	S	*	*			trans	-111.7	-172.8	173.5	-61	-170.4	-13.2	0	0	110.2
296	P	51.4	Low	37.2	Very low	110 Å²	110	132 Å²	132	71%	0.714	76%	0.762	S	S	*	*			cis	-125	-141.4	-4.6	30.7	-4.3	0	0	0	111.2
297	L	31.3	Very low	37.4	Very low	160 Å²	160	129.7 Å²	129.7	84%	0.838	76%	0.763	S	S	*	*			cis	-162.8	150.6	3.5	-145.8	177.9	0	0	0	109.5
298	G	30.3	Very low	38.4	Very low	65 Å²	65	131.7 Å²	131.7	67%	0.67	77%	0.769	S	S	*	*			trans	151.3	124	162.6	0	0	0	0	0	115.9
299	L	34.9	Very low	38.7	Very low	162 Å²	162	134.2 Å²	134.2	85%	0.848	77%	0.772	S	S	*	*			trans	-152.1	172.9	-173.1	-84.7	148.5	0	0	0	109
300	P	52.7	Low	39.1	Very low	84 Å²	84	137.6 Å²	137.6	55%	0.545	77%	0.772	S	S	.	*				-142.4	-148.2	-66.3	42.3	-21.2	0	0	0	112.9
301	H	35.3	Very low	38.1	Very low	184 Å²	184	140.8 Å²	140.8	85%	0.852	78%	0.778	S	S	*	*			trans	79.5	154.8	174.2	-43.1	114.5	0	0	0	116.2
302	G	31.8	Very low	38.3	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	78%	0.778	S	S	*	*			cis	-165.8	-178.1	1.1	0	0	0	0	0	113.2
303	M	31.6	Very low	38.9	Very low	181 Å²	181	137 Å²	137	89%	0.892	79%	0.787	S	S	*	*			trans	-124.5	-167.1	-172.3	-37.6	167.3	69.6	0	0	111
304	P	51.3	Low	39	Very low	114 Å²	114	139.6 Å²	139.6	74%	0.74	80%	0.802	S	S	*	*			cis	-124.2	-106.2	-24.9	21.1	4.8	0	0	0	115.6
305	P	56.1	Low	39.6	Very low	108 Å²	108	140.4 Å²	140.4	70%	0.701	81%	0.805	S	S	*	*				-135.5	179.3	-125	44.3	-25.2	0	0	0	118
306	Q	34.9	Very low	40.3	Very low	208 Å²	208	137.5 Å²	137.5	97%	0.972	80%	0.802	S	S	*	*			trans	-161.5	178.9	151.8	-115.7	169.8	33.3	0	0	114.6
307	G	34.8	Very low	40.2	Very low	71 Å²	71	138.1 Å²	138.1	73%	0.732	81%	0.806	S	S	*	*			trans	-127	-151.6	-153.9	0	0	0	0	0	119.2
308	P	54.2	Low	41.1	Very low	130 Å²	130	136.2 Å²	136.2	84%	0.844	80%	0.804	S	S	*	*			trans	-115.5	177.1	-145.4	43.3	-37.8	0	0	0	118
309	M	36.4	Very low	42	Very low	202 Å²	202	139 Å²	139	100%	0.995	81%	0.81	S	S	*	*			trans	-145.4	-178.2	168.3	-109.1	-172.5	179.1	0	0	114.5
310	Q	38.2	Very low	42.2	Very low	162 Å²	162	140.9 Å²	140.9	76%	0.757	81%	0.814	S	S	*	*			trans	-154.5	171.6	-146.1	-164.7	-166.2	83.4	0	0	114.5
311	Q	35.6	Very low	41.3	Very low	176 Å²	176	141.8 Å²	141.8	82%	0.822	82%	0.822	S	S	*	*			trans	82.7	155.3	165.5	-50.2	174.6	13.6	0	0	116.5
312	G	34.6	Very low	41.2	Very low	72 Å²	72	140.6 Å²	140.6	74%	0.742	82%	0.822	S	S	*	*			cis	-168.9	176.1	-1.7	0	0	0	0	0	112.8
313	P	47.1	Very low	41.3	Very low	132 Å²	132	143.2 Å²	143.2	86%	0.857	82%	0.822	S	S	*	*			trans	-107.6	176	-164.6	40.6	-36	0	0	0	117.7
314	M	33.7	Very low	41.4	Very low	191 Å²	191	143 Å²	143	94%	0.941	82%	0.82	S	S	*	*			trans	-138.4	167	-177	-87.9	-82.8	-82.5	0	0	114.4
315	Q	44.9	Very low	41	Very low	184 Å²	184	143.9 Å²	143.9	86%	0.86	83%	0.825	S	S	*	*			trans	-117.8	166.8	-165.8	-71.6	180	-24.2	0	0	115.9
316	P	45.1	Very low	39.8	Very low	118 Å²	118	146.4 Å²	146.4	77%	0.766	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-101.5	167.3	178.6	39.5	-35.5	0	0	0	116
317	P	49.1	Very low	39.6	Very low	123 Å²	123	143.2 Å²	143.2	80%	0.799	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-97	171.6	-175.7	38.3	-36.8	0	0	0	116.6
318	P	51.1	Low	39.8	Very low	121 Å²	121	148 Å²	148	79%	0.786	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-102.2	173.9	-168.5	40.4	-37	0	0	0	116.7
319	P	48.2	Very low	40.1	Very low	123 Å²	123	147.4 Å²	147.4	80%	0.799	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-98.1	173.4	-174.8	39	-37	0	0	0	116.3
320	Q	40.5	Very low	39.9	Very low	201 Å²	201	147 Å²	147	94%	0.939	81%	0.812	S	S	*	*			trans	-134.7	176.1	172.2	-71.9	-171.2	-20.9	0	0	112.3
321	S	34	Very low	39.7	Very low	103 Å²	103	143.7 Å²	143.7	72%	0.72	81%	0.812	S	S	*	*			trans	-145.6	-170.8	-159.5	53.1	0	0	0	0	114.6
322	L	32.3	Very low	39.7	Very low	160 Å²	160	143.4 Å²	143.4	84%	0.838	82%	0.815	S	S	*	*			trans	77.1	149.9	-176.9	-63.9	97.2	0	0	0	114.9
323	V	33.6	Very low	40	Very low	127 Å²	127	148.7 Å²	148.7	77%	0.77	82%	0.821	S	S	*	*			cis	-158.7	166.2	-8.3	115.9	0	0	0	0	111.6
324	Q	33.9	Very low	40	Very low	178 Å²	178	147 Å²	147	83%	0.832	81%	0.81	S	S	*	*			trans	-99.6	156.2	170.5	-78.4	-175.5	-23.8	0	0	113.7
325	P	41.8	Very low	39.7	Very low	132 Å²	132	146.5 Å²	146.5	86%	0.857	81%	0.805	S	S	*	*			trans	-130.2	-171.7	137.7	34.2	-20.7	0	0	0	114.1
326	Q	32.3	Very low	39.7	Very low	161 Å²	161	143.1 Å²	143.1	75%	0.752	80%	0.799	S	S	*	*			trans	-148.9	169.3	-145.3	-164.3	-168.8	-6.1	0	0	112.9
327	M	31.2	Very low	40.1	Very low	140 Å²	140	142 Å²	142	69%	0.69	79%	0.792	S	S	*	*			trans	78	158.8	161.9	-56.2	-168.6	-175.7	0	0	118.4
328	Q	38.4	Very low	39.5	Very low	172 Å²	172	143.4 Å²	143.4	80%	0.804	79%	0.787	S	S	*	*			cis	-162.2	170.6	-37.1	-110.6	175.2	-10.1	0	0	109.5
329	P	60.5	Low	38.8	Very low	118 Å²	118	144.8 Å²	144.8	77%	0.766	78%	0.783	S	S	*	*			trans	-113.5	162.5	-162.2	41.5	-35.8	0	0	0	118.5
330	M	32.3	Very low	38.2	Very low	193 Å²	193	146 Å²	146	95%	0.951	78%	0.778	S	S	*	*			trans	-164.8	160.8	163.3	-97.6	-163.3	178.6	0	0	109.1
331	A	33.4	Very low	37.9	Very low	93 Å²	93	144.7 Å²	144.7	77%	0.769	77%	0.772	S	S	*	*			cis	-157.6	-172.2	-12.3	0	0	0	0	0	109.8
332	L	35.9	Very low	38	Very low	169 Å²	169	147.6 Å²	147.6	89%	0.885	77%	0.774	S	S	*	*			trans	-116.2	178	-166.4	-75.6	164.7	0	0	0	115.7
333	Q	40.2	Very low	38.1	Very low	184 Å²	184	149 Å²	149	86%	0.86	78%	0.776	S	S	*	*			trans	100	164.1	157.5	-57.2	-161.9	-12.4	0	0	118.8
334	P	47.6	Very low	38.6	Very low	97 Å²	97	148.5 Å²	148.5	63%	0.63	78%	0.775	S	S	*	*				-145.5	167.8	-66.7	43.8	-26.9	0	0	0	117.9
335	Q	28.1	Very low	39.4	Very low	179 Å²	179	145.6 Å²	145.6	84%	0.836	77%	0.772	S	S	*	*			trans	65.3	170.4	144.7	-85.5	-173.7	16.7	0	0	121.4
336	P	45.2	Very low	39.3	Very low	113 Å²	113	145.2 Å²	145.2	73%	0.734	77%	0.77	S	S	*	*			cis	-127	-129.8	-29.7	34.8	-12.2	0	0	0	113.9
337	P	52.4	Low	39.7	Very low	94 Å²	94	145.8 Å²	145.8	61%	0.61	77%	0.772	S	S	*	*				-131.9	178.1	-128.7	38.9	-15.8	0	0	0	118.6
338	H	35.7	Very low	40.1	Very low	153 Å²	153	144.6 Å²	144.6	71%	0.708	78%	0.775	S	S	*	*				165.8	138.3	121.1	-87.1	-70.3	0	0	0	116.9
339	H	37.9	Very low	39.8	Very low	151 Å²	151	147.7 Å²	147.7	70%	0.699	78%	0.781	S	S	*	*			trans	38	121.8	150.4	-55.7	-44.9	0	0	0	127.3
340	Q	34.6	Very low	38.7	Very low	149 Å²	149	149.7 Å²	149.7	70%	0.696	78%	0.78	S	S	*	*				33.2	130.6	129.1	-57.3	-171.1	15.5	0	0	122.9
341	H	34.8	Very low	38.5	Very low	172 Å²	172	147.3 Å²	147.3	80%	0.796	77%	0.771	S	S	*	*				-164.1	178.9	99.2	-117.9	26.9	0	0	0	112.6
342	H	36.1	Very low	38.8	Very low	165 Å²	165	150.1 Å²	150.1	76%	0.764	77%	0.768	S	S	*	*			trans	-102.3	143.9	-161.7	-60.6	85.3	0	0	0	115.6
343	Q	34.6	Very low	38.7	Very low	188 Å²	188	148 Å²	148	88%	0.879	76%	0.763	S	S	*	*			trans	-146.8	148.4	148	-76.6	-160.9	-17.2	0	0	111.1
344	P	44.8	Very low	38.5	Very low	118 Å²	118	148.1 Å²	148.1	77%	0.766	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-86.8	155.3	178.5	35	-35	0	0	0	113.4
345	P	50.2	Low	38.2	Very low	117 Å²	117	148.9 Å²	148.9	76%	0.76	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-80.4	151.7	-179.4	32.9	-35.8	0	0	0	113.6
346	P	40.1	Very low	38.5	Very low	124 Å²	124	146.5 Å²	146.5	81%	0.805	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-77.9	150.5	176.7	32.2	-35.2	0	0	0	113.3
347	Q	39.9	Very low	38.1	Very low	173 Å²	173	149.4 Å²	149.4	81%	0.808	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-76.7	138.8	176.1	-69.8	-73.6	-12.2	0	0	112
348	P	39	Very low	37.3	Very low	115 Å²	115	151 Å²	151	75%	0.747	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-78.3	132.4	172.8	31.3	-32.9	0	0	0	111.7
349	Y	32.3	Very low	37.4	Very low	237 Å²	237	152.5 Å²	152.5	93%	0.929	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-73.1	136.7	176.5	-100.3	-102.2	0	0	0	112.6	N351	Y349-N351 PolarHBondContact O-N 3.02Å
350	Q	36.8	Very low	37.6	Very low	159 Å²	159	152.6 Å²	152.6	74%	0.743	80%	0.801	S	S	*	*			trans	-83.4	102.8	-178.1	-176.1	179.6	0	0	0	111.7	H352	Q350-H352 PolarHBondContact NE2-CE1 3.08Å; Q350-H352 VanDerWaalsContact NE2-CE1 3.3Å
351	N	28.6	Very low	37.6	Very low	144 Å²	144	155.2 Å²	155.2	77%	0.77	80%	0.804	S	S	*	*			trans	-96.3	127.7	178.2	-161.6	-3.3	0	0	0	112	Y349	Y349-N351 PolarHBondContact O-N 3.02Å
352	H	39.4	Very low	37.6	Very low	151 Å²	151	158.1 Å²	158.1	70%	0.699	81%	0.808	S	S	*	*			trans	-104.8	106.1	-178.3	-77.9	85.2	0	0	0	111.5	Q350	Q350-H352 PolarHBondContact NE2-CE1 3.08Å; Q350-H352 VanDerWaalsContact NE2-CE1 3.3Å
353	T	33.6	Very low	38	Very low	126 Å²	126	156.3 Å²	156.3	77%	0.773	80%	0.803	S	S	*	*			trans	-143.3	114.6	164.4	35.4	0	0	0	0	110.9
354	Q	37.3	Very low	38	Very low	186 Å²	186	149.9 Å²	149.9	87%	0.869	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-82.3	144.7	170.3	-69.8	-178	-6	0	0	110.5
355	P	40	Very low	37.7	Very low	112 Å²	112	149.9 Å²	149.9	73%	0.727	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.2	148.1	167.2	31.4	-34	0	0	0	110.9
356	P	35.6	Very low	37.6	Very low	129 Å²	129	155 Å²	155	84%	0.838	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-70.5	143.3	178.6	29.8	-35	0	0	0	111.9
357	Q	35.8	Very low	37.3	Very low	174 Å²	174	156.3 Å²	156.3	81%	0.813	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-85.2	145.7	176.9	-66.9	-166.9	-2.2	0	0	112.6	Q359	Q357-Q359 PolarHBondContact O-N 3.05Å
358	P	37	Very low	37	Very low	128 Å²	128	158.5 Å²	158.5	83%	0.831	79%	0.787	S	S	*	*			trans	-73.1	114.6	171.6	29.8	-33.1	0	0	0	111
359	Q	36.3	Very low	36.5	Very low	185 Å²	185	160 Å²	160	86%	0.864	79%	0.789	S	S	*	*			trans	-90.9	103.2	175.3	-73.3	-168.8	-16.4	0	0	111.8	Q357	Q357-Q359 PolarHBondContact O-N 3.05Å
360	T	42.4	Very low	36.5	Very low	153 Å²	153	156.7 Å²	156.7	94%	0.939	78%	0.782	S	S	*	*			trans	-163.3	51.1	150.9	3.6	0	0	0	0	111.7
361	R	35.9	Very low	36.1	Very low	204 Å²	204	152.7 Å²	152.7	77%	0.77	78%	0.784	S	S	*	*			trans	-113.9	109.5	162	177.5	177.6	-89.6	-99.3	2	108.1	I363	R361-I363 HydrophobicContact CG-CG1 4Å
362	W	34.9	Very low	36.5	Very low	233 Å²	233	156.9 Å²	156.9	88%	0.883	79%	0.791	S	S	*	*			trans	-63.3	135.4	163.1	-109.6	96.4	0	0	0	108.6
363	I	43.9	Very low	36	Very low	126 Å²	126	153.3 Å²	153.3	65%	0.646	79%	0.794	S	S	*	*			trans	-126.9	118.8	175.8	-60.4	176.5	0	0	0	105.4	R361	R361-I363 HydrophobicContact CG-CG1 4Å
364	A	35.3	Very low	35.9	Very low	54 Å²	54	156.9 Å²	156.9	45%	0.446	80%	0.802	S	S	.	*			trans	-58.1	136	177.2	0	0	0	0	0	110	R366	A364-R366 PolarHBondContact O-N 3.04Å
365	P	36.8	Very low	35.5	Very low	118 Å²	118	151.7 Å²	151.7	77%	0.766	80%	0.799	S	S	*	*			trans	-68	99.2	-176.7	27	-34	0	0	0	110.4	N367	P365-N367 PolarHBondContact O-N 3.07Å
366	R	48.5	Very low	35	Very low	225 Å²	225	149.8 Å²	149.8	85%	0.849	80%	0.799	S	S	*	*			trans	-58.7	109.1	174.3	-82.1	-176.9	167.3	167.4	-3.1	110.1	A364 R368	A364-R366 PolarHBondContact O-N 3.04Å; R366-R368 VanDerWaalsContact C-N 3.31Å; R366-R368 PolarHBondContact O-N 3.29Å
367	N	33.6	Very low	34.9	Very low	150 Å²	150	152.6 Å²	152.6	80%	0.802	81%	0.806	S	S	*	*			trans	-66.6	87.5	172.6	-173.9	-2.3	0	0	0	110.2	P365 N369	P365-N367 PolarHBondContact O-N 3.07Å; N367-N369 PolarHBondContact O-N 2.88Å; N367-N369 VanDerWaalsContact O-N 3.11Å
368	R	33.5	Very low	34.6	Very low	219 Å²	219	148 Å²	148	83%	0.826	81%	0.805	S	S	*	*			trans	-82.8	83.8	178	-170.5	-179.9	-172.1	173	2.9	109.7	R366 Q370	R366-R368 VanDerWaalsContact C-N 3.31Å; R366-R368 PolarHBondContact O-N 3.29Å; R368-Q370 PolarHBondContact O-N 3.42Å; R368-Q370 VanDerWaalsContact O-N 3.11Å
369	N	28.7	Very low	34.5	Very low	146 Å²	146	149.6 Å²	149.6	78%	0.781	80%	0.802	S	S	*	*			trans	-53.2	114.2	175.3	-162.9	33.5	0	0	0	111	N367 G371	N367-N369 PolarHBondContact O-N 2.88Å; N367-N369 VanDerWaalsContact O-N 3.11Å; N369-G371 PolarHBondContact O-N 3.13Å
370	Q	32.4	Very low	34.3	Very low	168 Å²	168	147.9 Å²	147.9	79%	0.785	80%	0.798	S	S	*	*			trans	-92.4	98.9	-178.8	-82.4	-174.6	-31.3	0	0	111	R368	R368-Q370 PolarHBondContact O-N 3.42Å; R368-Q370 VanDerWaalsContact O-N 3.11Å
371	G	28.8	Very low	33.7	Very low	76 Å²	76	144.4 Å²	144.4	78%	0.784	79%	0.793	S	S	*	*			trans	-98.2	87.9	175.3	0	0	0	0	0	113.4	N369	N369-G371 PolarHBondContact O-N 3.13Å
372	Y	37.4	Very low	33.7	Very low	232 Å²	232	141.2 Å²	141.2	91%	0.91	80%	0.802	S	S	*	*			trans	13.2	128.8	160.4	-77.8	-88.7	0	0	0	123.4
373	G	28.2	Very low	33.5	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	80%	0.799	S	S	*	*				-144.8	152.2	126.6	0	0	0	0	0	107.6
374	Q	32.7	Very low	33.1	Very low	201 Å²	201	136 Å²	136	94%	0.939	81%	0.808	S	S	*	*			cis	-157.2	151.4	13.3	178.1	-174.9	29.5	0	0	110.6
375	G	28.6	Very low	33.1	Very low	78 Å²	78	140.6 Å²	140.6	80%	0.804	82%	0.822	S	S	*	*			trans	112.1	138.3	164.4	0	0	0	0	0	115.5
376	G	28.3	Very low	32.8	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	82%	0.824	S	S	*	*			cis	174.1	144.3	-10.6	0	0	0	0	0	114.9
377	L	33.4	Very low	32.2	Very low	188 Å²	188	133.7 Å²	133.7	98%	0.984	82%	0.819	S	S	*	*			trans	69.3	146.4	166	-60.9	173.8	0	0	0	120.3
378	G	29.1	Very low	32.2	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	82%	0.822	S	S	*	*			trans	90.1	141	171.6	0	0	0	0	0	115.7
379	Q	35.3	Very low	32	Very low	163 Å²	163	126.8 Å²	126.8	76%	0.762	82%	0.822	S	S	*	*			cis	169.9	144.6	-44.5	165.8	167.5	-11.4	0	0	106.7
380	D	31.9	Very low	32.1	Very low	148 Å²	148	124 Å²	124	79%	0.791	83%	0.828	S	S	*	*			trans	66.2	150.1	169.4	-60.6	-22.6	0	0	0	119.9
381	G	30.8	Very low	32	Very low	81 Å²	81	119.5 Å²	119.5	84%	0.835	83%	0.826	S	S	*	*			trans	138.3	81.2	166.5	0	0	0	0	0	117.4
382	S	36	Very low	32.2	Very low	136 Å²	136	123.5 Å²	123.5	95%	0.951	83%	0.829	S	S	*	*			trans	-78.7	145.5	175	-54	0	0	0	0	113.5
383	G	29.3	Very low	32	Very low	79 Å²	79	121 Å²	121	81%	0.814	83%	0.831	S	S	*	*			trans	-167	82.1	-179.1	0	0	0	0	0	118.4
384	M	36	Very low	32.4	Very low	172 Å²	172	119.8 Å²	119.8	85%	0.847	82%	0.82	S	S	*	*			trans	18	138.5	158.7	-162.6	54.8	174.9	0	0	124.3
385	M	34.9	Very low	32.8	Very low	149 Å²	149	116.3 Å²	116.3	73%	0.734	81%	0.814	S	S	*	*			trans	-43.8	149.1	167.5	-177.7	-167.3	-59.2	0	0	118.1	V387	M385-V387 HydrophobicContact CG-CG2 4.14Å; M385-V387 HydrophobicContact SD-CG2 4.49Å
386	G	31.6	Very low	33.1	Very low	79 Å²	79	120.6 Å²	120.6	81%	0.814	82%	0.818	S	S	*	*			trans	-152.2	115.4	161.6	0	0	0	0	0	113.7
387	V	35.6	Very low	33.5	Very low	120 Å²	120	124 Å²	124	73%	0.727	82%	0.824	S	S	*	*			trans	-120.2	147.2	171.7	-151.5	0	0	0	0	105	M385	M385-V387 HydrophobicContact CG-CG2 4.14Å; M385-V387 HydrophobicContact SD-CG2 4.49Å
388	V	34.6	Very low	33.7	Very low	145 Å²	145	119.7 Å²	119.7	88%	0.879	81%	0.81	S	S	*	*			cis	-156	162.5	34.7	-154.7	0	0	0	0	109
389	G	29.1	Very low	33.9	Very low	79 Å²	79	122.1 Å²	122.1	81%	0.814	81%	0.81	S	S	*	*			trans	159.4	104.5	162.3	0	0	0	0	0	114.3
390	G	30.1	Very low	33.7	Very low	88 Å²	88	120 Å²	120	91%	0.907	81%	0.813	S	S	*	*			trans	-94.7	165.6	-174.4	0	0	0	0	0	115.5
391	G	30	Very low	34.1	Very low	72 Å²	72	122.5 Å²	122.5	74%	0.742	82%	0.82	S	S	*	*			trans	155.3	130.2	168.2	0	0	0	0	0	114.2
392	N	33.1	Very low	34.1	Very low	161 Å²	161	121.1 Å²	121.1	86%	0.861	81%	0.806	S	S	*	*			trans	50.9	92.4	163.8	-65.5	0.1	0	0	0	119.3	G394	N392-G394 PolarHBondContact O-N 2.89Å
393	N	34	Very low	34.5	Very low	178 Å²	178	121.5 Å²	121.5	95%	0.952	81%	0.805	S	S	*	*			trans	-72.1	85.6	157.2	-82.1	-7.5	0	0	0	111.3
394	G	36.3	Very low	35.3	Very low	51 Å²	51	121.8 Å²	121.8	53%	0.526	81%	0.808	S	S	.	*			trans	-97.6	133.2	155.3	0	0	0	0	0	109.7	N392 L396	N392-G394 PolarHBondContact O-N 2.89Å; G394-L396 PolarHBondContact O-N 3.15Å
395	P	41	Very low	36	Very low	127 Å²	127	117.2 Å²	117.2	83%	0.825	81%	0.805	S	S	*	*			trans	-69.6	86.8	178.3	-20	33.6	0	0	0	112.5	T397	P395-T397 PolarHBondContact O-N 3.32Å; P395-T397 VanDerWaalsContact O-N 3.16Å
396	L	34	Very low	37	Very low	169 Å²	169	118.9 Å²	118.9	89%	0.885	81%	0.811	S	S	*	*			trans	-70.5	103.2	170.5	-86.9	163.4	0	0	0	110	G394 S398	G394-L396 PolarHBondContact O-N 3.15Å; L396-S398 PolarHBondContact O-N 3.43Å
397	T	37	Very low	38.9	Very low	141 Å²	141	117.3 Å²	117.3	87%	0.865	79%	0.788	S	S	*	*			trans	-86.3	90.9	176.9	52	0	0	0	0	111.6	P395	P395-T397 PolarHBondContact O-N 3.32Å; P395-T397 VanDerWaalsContact O-N 3.16Å
398	S	37.3	Very low	41.4	Very low	99 Å²	99	113.6 Å²	113.6	69%	0.692	76%	0.762	S	S	*	*			trans	-129.3	150.9	160.6	69.5	0	0	0	0	108.2	L396	L396-S398 PolarHBondContact O-N 3.43Å
399	T	33.4	Very low	44.1	Very low	128 Å²	128	110.2 Å²	110.2	79%	0.785	74%	0.743	S	S	*	*			cis	-152.8	139.3	7	-29.5	0	0	0	0	110
400	S	32.4	Very low	47.1	Very low	117 Å²	117	108.4 Å²	108.4	82%	0.818	72%	0.716	S	S	*	*			trans	-174.3	77.1	150	58.2	0	0	0	0	111.8	G402	S400-G402 PolarHBondContact O-N 2.69Å
401	Q	38.8	Very low	50	Low	201 Å²	201	104.4 Å²	104.4	94%	0.939	67%	0.674	S	S	*	*			trans	-75.3	92.1	168.3	-79.2	-177.9	-23.8	0	0	110.1
402	G	32.1	Very low	53	Low	53 Å²	53	105.6 Å²	105.6	55%	0.546	66%	0.66	S	S	.	*			trans	-77.9	148.1	154.5	0	0	0	0	0	109.9	S400 G404	S400-G402 PolarHBondContact O-N 2.69Å; G402-G404 PolarHBondContact O-N 3.13Å
403	P	44.8	Very low	55.9	Low	144 Å²	144	104.9 Å²	104.9	94%	0.935	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	130.3	178.4	28.6	-33.7	0	0	0	111.2
404	G	45.3	Very low	58.7	Low	84 Å²	84	97 Å²	97	87%	0.866	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.8	21.2	171.3	0	0	0	0	0	117.2	G402	G402-G404 PolarHBondContact O-N 3.13Å
405	G	50.3	Low	61.4	Low	76 Å²	76	100.3 Å²	100.3	78%	0.784	60%	0.604	S	S	*	*			trans	-99	31.8	-176.4	0	0	0	0	0	116.7
406	E	56.2	Low	63.7	Low	184 Å²	184	98.6 Å²	98.6	86%	0.86	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-88.4	117.9	-179.6	-68.1	178.8	-157.1	0	0	111.2
407	S	71.6	Confident	66.3	Low	47 Å²	47	94.3 Å²	94.3	33%	0.329	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-71.5	135.5	177	21.3	0	0	0	0	111.7	E412	S407-E412 WeakPolarHBondContact CB-OE1 3.3Å; S407-E412 PolarHBondContact OG-OE1 3.02Å
408	H	87.3	Confident	68.8	Low	41 Å²	41	89.6 Å²	89.6	19%	0.19	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-60.2	134.2	178.1	-157.1	-115.7	0	0	0	110.7	V410 L411 E412 F579 E583	H408-V410 PolarHBondContact O-N 2.88Å; H408-L411 HydrophobicContact CB-CB 4.25Å; H408-L411 WeakPolarHBondContact O-CA 3.16Å; H408-L411 WeakPolarHBondContact O-CB 2.74Å; H408-L411 PolarHBondContact O-N 3.14Å; H408-E412 PolarHBondContact O-N 3.24Å; H408-E412 VanDerWaalsContact O-N 3.07Å; H408-F579 HydrophobicContact CB-CD1 4Å; H408-F579 HydrophobicContact CB-CE1 4.42Å; H408-E583 IonicContact CE1-OE2 2.57Å; H408-E583 PolarHBondContact CE1-OE2 2.89Å; H408-E583 WeakPolarHBondContact ND1-CG 3.43Å; H408-E583 IonicContact ND1-OE2 2.72Å; H408-E583 PolarHBondContact ND1-OE2 2.8Å
409	P	91.7	Very high	71.4	Confident	74 Å²	74	89.8 Å²	89.8	48%	0.481	55%	0.554	S	S	.	*	H	α-helix	trans	-63.2	-16.7	-176	23.4	-35.1	0	0	0	114	K413	P409-K413 WeakPolarHBondContact O-CD 3.42Å; P409-K413 VanDerWaalsContact O-CG 3.24Å; P409-K413 WeakPolarHBondContact O-CG 3.45Å; P409-K413 PolarHBondContact O-N 3.11Å
410	V	92.1	Very high	74.4	Confident	41 Å²	41	85.3 Å²	85.3	25%	0.248	52%	0.523	C	S	.	.	H	α-helix	trans	-76.9	-41.6	169.6	177.4	0	0	0	0	111.2	H408 E412 K413 L414 K450 F579 E583	H408-V410 PolarHBondContact O-N 2.88Å; V410-E412 VanDerWaalsContact C-N 3.3Å; V410-E412 PolarHBondContact O-N 2.9Å; V410-K413 PolarHBondContact O-N 3.32Å; V410-L414 HydrophobicContact CG1-CD1 4.06Å; V410-L414 HydrophobicContact CG1-CG 4.49Å; V410-L414 WeakPolarHBondContact O-CG 3.38Å; V410-L414 PolarHBondContact O-N 3.27Å; V410-K450 HydrophobicContact CG1-CG 4.3Å; V410-F579 HydrophobicContact CB-CE1 4.22Å; V410-F579 HydrophobicContact CG1-CE1 4.2Å; V410-F579 HydrophobicContact CG1-CZ 4.18Å; V410-E583 WeakPolarHBondContact CB-OE2 3.49Å; V410-E583 WeakPolarHBondContact CG1-OE2 3.2Å; V410-E583 VanDerWaalsContact CG2-OE2 3.24Å; V410-E583 WeakPolarHBondContact CG2-OE2 3.34Å
411	L	92	Very high	77.4	Confident	5 Å²	5	81.5 Å²	81.5	3%	0.026	49%	0.493	C	S	.	.	H	α-helix	trans	-62.5	-37.4	175.3	178.8	57.3	0	0	0	111.8	H408 L414 R415 F576 F579	H408-L411 HydrophobicContact CB-CB 4.25Å; H408-L411 WeakPolarHBondContact O-CA 3.16Å; H408-L411 WeakPolarHBondContact O-CB 2.74Å; H408-L411 PolarHBondContact O-N 3.14Å; L411-L414 PolarHBondContact O-N 3.27Å; L411-R415 HydrophobicContact CD1-CG 4.22Å; L411-R415 WeakPolarHBondContact O-CB 3.44Å; L411-R415 VanDerWaalsContact O-CG 3.28Å; L411-R415 WeakPolarHBondContact O-CG 3.37Å; L411-R415 PolarHBondContact O-N 2.93Å; L411-F576 HydrophobicContact CD1-CB 4.38Å; L411-F576 HydrophobicContact CD1-CD1 3.29Å; L411-F576 HydrophobicContact CD1-CE1 3.52Å; L411-F576 HydrophobicContact CD1-CG 3.87Å; L411-F576 HydrophobicContact CD1-CZ 4.28Å; L411-F579 HydrophobicContact CB-CD1 3.71Å; L411-F579 HydrophobicContact CB-CD2 4.5Å; L411-F579 HydrophobicContact CB-CE1 3.84Å; L411-F579 HydrophobicContact CB-CG 4.06Å; L411-F579 HydrophobicContact CB-CZ 4.31Å; L411-F579 HydrophobicContact CD1-CD2 3.97Å; L411-F579 HydrophobicContact CD1-CE2 4.21Å; L411-F579 HydrophobicContact CD1-CG 4.21Å; L411-F579 HydrophobicContact CD2-CB 3.88Å; L411-F579 HydrophobicContact CD2-CD1 4.4Å; L411-F579 HydrophobicContact CD2-CG 4.05Å; L411-F579 HydrophobicContact CG-CD1 4.48Å; L411-F579 HydrophobicContact CG-CG 4.34Å
412	E	92.6	Very high	80.1	Confident	96 Å²	96	73.2 Å²	73.2	45%	0.449	46%	0.457	S	S	.	.	H	α-helix	trans	-64.3	-45.2	174.3	-63.6	-174.6	165.7	0	0	111.7	S407 H408 V410 L414 R415 A416	S407-E412 WeakPolarHBondContact CB-OE1 3.3Å; S407-E412 PolarHBondContact OG-OE1 3.02Å; H408-E412 PolarHBondContact O-N 3.24Å; H408-E412 VanDerWaalsContact O-N 3.07Å; V410-E412 VanDerWaalsContact C-N 3.3Å; V410-E412 PolarHBondContact O-N 2.9Å; E412-L414 VanDerWaalsContact C-N 3.34Å; E412-L414 PolarHBondContact O-N 3.1Å; E412-R415 PolarHBondContact O-N 3.46Å; E412-A416 VanDerWaalsContact O-CB 3.3Å; E412-A416 WeakPolarHBondContact O-CB 3.29Å; E412-A416 PolarHBondContact O-N 3.02Å
413	K	93.2	Very high	82.9	Confident	147 Å²	147	80.9 Å²	80.9	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-61.9	-39.3	174.4	-71.6	166.9	-172.9	174.2	0	112.5	P409 V410 A416 S417	P409-K413 WeakPolarHBondContact O-CD 3.42Å; P409-K413 VanDerWaalsContact O-CG 3.24Å; P409-K413 WeakPolarHBondContact O-CG 3.45Å; P409-K413 PolarHBondContact O-N 3.11Å; V410-K413 PolarHBondContact O-N 3.32Å; K413-A416 PolarHBondContact O-N 2.7Å; K413-S417 WeakPolarHBondContact O-CB 3.46Å; K413-S417 PolarHBondContact O-N 3.21Å; K413-S417 VanDerWaalsContact O-N 3.08Å; K413-S417 PolarHBondContact O-OG 3.03Å
414	L	93.6	Very high	85.2	Confident	13 Å²	13	81 Å²	81	7%	0.068	47%	0.468	C	S	.	.	H	α-helix	trans	-64.2	-49.8	175.5	-72.2	167.3	0	0	0	111	V410 L411 E412 A416 S417 H418 Y420 F579	V410-L414 HydrophobicContact CG1-CD1 4.06Å; V410-L414 HydrophobicContact CG1-CG 4.49Å; V410-L414 WeakPolarHBondContact O-CG 3.38Å; V410-L414 PolarHBondContact O-N 3.27Å; L411-L414 PolarHBondContact O-N 3.27Å; E412-L414 VanDerWaalsContact C-N 3.34Å; E412-L414 PolarHBondContact O-N 3.1Å; L414-A416 VanDerWaalsContact C-N 3.26Å; L414-A416 PolarHBondContact O-N 2.89Å; L414-S417 WeakPolarHBondContact CA-OG 3.44Å; L414-S417 PolarHBondContact O-N 3.46Å; L414-S417 VanDerWaalsContact O-N 3.13Å; L414-S417 PolarHBondContact O-OG 3.47Å; L414-S417 VanDerWaalsContact O-OG 3.07Å; L414-H418 PolarHBondContact O-N 2.7Å; L414-Y420 HydrophobicContact CB-CE2 4.15Å; L414-F579 HydrophobicContact CD1-CE2 3.9Å; L414-F579 HydrophobicContact CD1-CZ 3.56Å
415	R	92.1	Very high	87.5	Confident	120 Å²	120	78.2 Å²	78.2	45%	0.453	43%	0.432	S	S	.	.	H	α-helix	trans	-62.6	-28.2	176.2	-71.6	170.6	176.4	174.8	-1.5	113.7	L411 E412 Y420	L411-R415 HydrophobicContact CD1-CG 4.22Å; L411-R415 WeakPolarHBondContact O-CB 3.44Å; L411-R415 VanDerWaalsContact O-CG 3.28Å; L411-R415 WeakPolarHBondContact O-CG 3.37Å; L411-R415 PolarHBondContact O-N 2.93Å; E412-R415 PolarHBondContact O-N 3.46Å; R415-Y420 HydrophobicContact CG-CD2 4.29Å; R415-Y420 HydrophobicContact CG-CE2 4.48Å
416	A	90.3	Very high	89.6	Confident	90 Å²	90	79 Å²	79	74%	0.744	42%	0.418	S	S	*	.	H	α-helix	trans	-82.4	-19.7	176.1	0	0	0	0	0	113.7	E412 K413 L414	E412-A416 VanDerWaalsContact O-CB 3.3Å; E412-A416 WeakPolarHBondContact O-CB 3.29Å; E412-A416 PolarHBondContact O-N 3.02Å; K413-A416 PolarHBondContact O-N 2.7Å; L414-A416 VanDerWaalsContact C-N 3.26Å; L414-A416 PolarHBondContact O-N 2.89Å
417	S	89.4	Confident	91.4	Very high	79 Å²	79	74.2 Å²	74.2	55%	0.552	39%	0.393	S	S	*	.	H	α-helix	trans	-101.7	-24.5	-179.1	49.2	0	0	0	0	114	K413 L414	K413-S417 WeakPolarHBondContact O-CB 3.46Å; K413-S417 PolarHBondContact O-N 3.21Å; K413-S417 VanDerWaalsContact O-N 3.08Å; K413-S417 PolarHBondContact O-OG 3.03Å; L414-S417 WeakPolarHBondContact CA-OG 3.44Å; L414-S417 PolarHBondContact O-N 3.46Å; L414-S417 VanDerWaalsContact O-N 3.13Å; L414-S417 PolarHBondContact O-OG 3.47Å; L414-S417 VanDerWaalsContact O-OG 3.07Å
418	H	89.4	Confident	92.5	Very high	42 Å²	42	75.6 Å²	75.6	19%	0.194	40%	0.396	C	S	.	.	S	Bend	trans	-124.9	132.6	-176.8	-60.5	76.5	0	0	0	111.4	L414 Y420 S452 D520	L414-H418 PolarHBondContact O-N 2.7Å; H418-Y420 VanDerWaalsContact C-N 3.29Å; H418-Y420 HydrophobicContact CB-CD1 4.14Å; H418-Y420 HydrophobicContact CB-CD2 4.32Å; H418-Y420 HydrophobicContact CB-CE1 3.62Å; H418-Y420 HydrophobicContact CB-CE2 3.86Å; H418-Y420 HydrophobicContact CB-CG 4.45Å; H418-Y420 VanDerWaalsContact CB-CZ 3.48Å; H418-Y420 AromaticContact CG-CZ 3.96Å; H418-Y420 PolarHBondContact O-N 2.86Å; H418-S452 PolarHBondContact NE2-OG 2.85Å; H418-D520 IonicContact CD2-OD1 3.33Å
419	S	91.6	Very high	92.7	Very high	104 Å²	104	74.3 Å²	74.3	73%	0.727	39%	0.391	S	S	*	.			trans	-81.9	71.3	178.9	-165.3	0	0	0	0	111.3	P422	S419-P422 WeakPolarHBondContact O-CD 3.45Å
420	Y	95	Very high	92.8	Very high	33 Å²	33	80 Å²	80	13%	0.129	41%	0.408	C	S	.	.			trans	-66.2	141.9	-177.5	-62	-56.9	0	0	0	113.3	L414 R415 H418 W521 V524 F576	L414-Y420 HydrophobicContact CB-CE2 4.15Å; R415-Y420 HydrophobicContact CG-CD2 4.29Å; R415-Y420 HydrophobicContact CG-CE2 4.48Å; H418-Y420 VanDerWaalsContact C-N 3.29Å; H418-Y420 HydrophobicContact CB-CD1 4.14Å; H418-Y420 HydrophobicContact CB-CD2 4.32Å; H418-Y420 HydrophobicContact CB-CE1 3.62Å; H418-Y420 HydrophobicContact CB-CE2 3.86Å; H418-Y420 HydrophobicContact CB-CG 4.45Å; H418-Y420 VanDerWaalsContact CB-CZ 3.48Å; H418-Y420 AromaticContact CG-CZ 3.96Å; H418-Y420 PolarHBondContact O-N 2.86Å; Y420-W521 HydrophobicContact CD1-CB 4.46Å; Y420-W521 WeakPolarHBondContact CD1-O 3.31Å; Y420-W521 HydrophobicContact CE1-CB 3.87Å; Y420-W521 VanDerWaalsContact CE1-O 3.29Å; Y420-W521 WeakPolarHBondContact CE1-O 3.22Å; Y420-V524 HydrophobicContact CD1-CG2 3.78Å; Y420-V524 HydrophobicContact CE1-CG2 4.04Å; Y420-V524 HydrophobicContact CG-CG2 4.44Å; Y420-F576 HydrophobicContact CD1-CZ 4.35Å; Y420-F576 AromaticContact CD2-CE2 3.87Å; Y420-F576 HydrophobicContact CD2-CE2 3.87Å; Y420-F576 AromaticContact CD2-CZ 3.6Å; Y420-F576 HydrophobicContact CD2-CZ 3.6Å; Y420-F576 HydrophobicContact CE1-CZ 4.36Å; Y420-F576 HydrophobicContact CE2-CE1 4.44Å; Y420-F576 HydrophobicContact CE2-CE2 4.31Å; Y420-F576 AromaticContact CE2-CZ 3.58Å; Y420-F576 HydrophobicContact CE2-CZ 3.58Å; Y420-F576 HydrophobicContact CG-CE2 4.1Å; Y420-F576 AromaticContact CG-CZ 4Å; Y420-F576 HydrophobicContact CG-CZ 4Å; Y420-F576 AromaticContact CZ-CZ 3.99Å
421	N	95.8	Very high	92.9	Very high	38 Å²	38	81.7 Å²	81.7	20%	0.203	42%	0.416	C	S	.	.	S	Bend	trans	56.7	53	177.5	-59.7	-53.6	0	0	0	114.1	L522 F523 V524 K525	N421-L522 PolarHBondContact N-O 3Å; N421-F523 HydrophobicContact CB-CD1 4.21Å; N421-F523 WeakPolarHBondContact OD1-CA 3.23Å; N421-F523 WeakPolarHBondContact OD1-CD1 3.31Å; N421-V524 PolarHBondContact ND2-O 3.43Å; N421-V524 VanDerWaalsContact ND2-O 3.1Å; N421-V524 PolarHBondContact OD1-N 3.3Å; N421-K525 WeakPolarHBondContact OD1-CD 3.37Å; N421-K525 WeakPolarHBondContact OD1-CG 3.35Å
422	P	95.6	Very high	93.1	Very high	27 Å²	27	81.9 Å²	81.9	18%	0.175	42%	0.419	C	S	.	.			trans	-61	140.5	-177.9	24.7	-31.2	0	0	0	112.1	S419 F425 L522 F523	S419-P422 WeakPolarHBondContact O-CD 3.45Å; P422-F425 HydrophobicContact CG-CB 4.21Å; P422-F425 HydrophobicContact CG-CD2 4.39Å; P422-L522 WeakPolarHBondContact CD-O 3.21Å; P422-F523 HydrophobicContact CG-CZ 4.28Å
423	K	91.7	Very high	93.4	Very high	214 Å²	214	80.5 Å²	80.5	93%	0.93	41%	0.409	S	S	*	.	S	Bend	trans	-84.7	-24.5	-173.2	-65.7	176.7	-178.6	171.7	0	113
424	D	92.4	Very high	93.6	Very high	147 Å²	147	73.5 Å²	73.5	79%	0.786	38%	0.379	S	S	*	.	S	Bend	trans	-103.4	13.9	-173.1	53.8	-45.1	0	0	0	112.7	D426	D424-D426 PolarHBondContact O-N 2.83Å
425	F	94.9	Very high	93.9	Very high	25 Å²	25	72.9 Å²	72.9	11%	0.11	38%	0.376	C	S	.	.			trans	-58.9	122.3	-179.3	-179.1	-101.4	0	0	0	113.6	P422 W427 Y478 L522 F523 L563 A567	P422-F425 HydrophobicContact CG-CB 4.21Å; P422-F425 HydrophobicContact CG-CD2 4.39Å; F425-W427 HydrophobicContact CD1-CB 4.11Å; F425-W427 HydrophobicContact CE1-CB 4.09Å; F425-W427 PolarHBondContact O-N 2.94Å; F425-Y478 HydrophobicContact CE2-CE2 4.21Å; F425-Y478 HydrophobicContact CZ-CD2 4.44Å; F425-Y478 AromaticContact CZ-CE2 3.68Å; F425-Y478 HydrophobicContact CZ-CE2 3.68Å; F425-Y478 AromaticContact CZ-CZ 3.97Å; F425-L522 HydrophobicContact CE2-CD1 4.02Å; F425-F523 HydrophobicContact CB-CE2 4.18Å; F425-F523 HydrophobicContact CB-CZ 3.74Å; F425-F523 AromaticContact CD1-CE2 3.67Å; F425-F523 HydrophobicContact CD1-CE2 3.67Å; F425-F523 AromaticContact CD1-CZ 3.89Å; F425-F523 HydrophobicContact CD1-CZ 3.89Å; F425-F523 AromaticContact CD2-CE2 3.81Å; F425-F523 HydrophobicContact CD2-CE2 3.81Å; F425-F523 HydrophobicContact CD2-CZ 4.23Å; F425-F523 AromaticContact CE1-CE2 3.93Å; F425-F523 HydrophobicContact CE1-CE2 3.93Å; F425-F523 HydrophobicContact CE2-CE2 4.08Å; F425-F523 AromaticContact CG-CE2 3.6Å; F425-F523 HydrophobicContact CG-CE2 3.6Å; F425-F523 AromaticContact CG-CZ 3.68Å; F425-F523 HydrophobicContact CG-CZ 3.68Å; F425-F523 HydrophobicContact CZ-CE2 4.13Å; F425-L563 HydrophobicContact CE1-CB 4.3Å; F425-L563 HydrophobicContact CE1-CD2 4.19Å; F425-L563 HydrophobicContact CZ-CD2 4.29Å; F425-A567 HydrophobicContact CD1-CB 4.13Å
426	D	93.6	Very high	94.2	Very high	92 Å²	92	67.2 Å²	67.2	49%	0.492	36%	0.355	S	S	.	.			trans	-75.5	91.5	173.4	-172.7	10.6	0	0	0	111.6	D424 N428	D424-D426 PolarHBondContact O-N 2.83Å; D426-N428 PolarHBondContact O-N 2.83Å; D426-N428 WeakPolarHBondContact OD1-CA 3.4Å; D426-N428 WeakPolarHBondContact OD1-CB 3.46Å; D426-N428 PolarHBondContact OD1-N 3.15Å
427	W	93.7	Very high	94.6	Very high	84 Å²	84	63 Å²	63	32%	0.318	32%	0.319	S	S	.	.			trans	-73.5	-8.6	171.4	52.2	-93.1	0	0	0	113.5	F425 L429 K560 L563 K564	F425-W427 HydrophobicContact CD1-CB 4.11Å; F425-W427 HydrophobicContact CE1-CB 4.09Å; F425-W427 PolarHBondContact O-N 2.94Å; W427-L429 VanDerWaalsContact C-N 3.32Å; W427-L429 PolarHBondContact O-N 2.83Å; W427-K560 WeakPolarHBondContact O-CA 3.29Å; W427-L563 HydrophobicContact CB-CB 3.89Å; W427-K564 HydrophobicContact CB-CB 4.27Å; W427-K564 HydrophobicContact CD2-CB 3.66Å; W427-K564 HydrophobicContact CD2-CD 4.07Å; W427-K564 HydrophobicContact CD2-CG 3.74Å; W427-K564 HydrophobicContact CE3-CB 3.75Å; W427-K564 HydrophobicContact CE3-CD 3.93Å; W427-K564 HydrophobicContact CE3-CG 4.02Å; W427-K564 HydrophobicContact CG-CB 3.87Å; W427-K564 HydrophobicContact CG-CG 4.19Å; W427-K564 HydrophobicContact CH2-CD 3.8Å; W427-K564 HydrophobicContact CH2-CG 4.49Å; W427-K564 HydrophobicContact CZ2-CD 3.9Å; W427-K564 HydrophobicContact CZ2-CG 4.22Å; W427-K564 HydrophobicContact CZ3-CB 4.46Å; W427-K564 HydrophobicContact CZ3-CD 3.8Å; W427-K564 HydrophobicContact CZ3-CG 4.39Å
428	N	94.3	Very high	95	Very high	76 Å²	76	60.4 Å²	60.4	41%	0.406	30%	0.298	S	S	.	.	S	Bend	trans	-93.9	54.2	-175.6	-171.2	30.4	0	0	0	112.4	D426 K430	D426-N428 PolarHBondContact O-N 2.83Å; D426-N428 WeakPolarHBondContact OD1-CA 3.4Å; D426-N428 WeakPolarHBondContact OD1-CB 3.46Å; D426-N428 PolarHBondContact OD1-N 3.15Å; N428-K430 PolarHBondContact O-N 2.91Å; N428-K430 VanDerWaalsContact O-N 3.13Å
429	L	92.5	Very high	95.4	Very high	13 Å²	13	58.6 Å²	58.6	7%	0.068	29%	0.29	C	S	.	.			trans	-49.9	115.8	-176.1	-69.8	176.8	0	0	0	113.6	W427 V434 P476 Y478 L556 K560 L563	W427-L429 VanDerWaalsContact C-N 3.32Å; W427-L429 PolarHBondContact O-N 2.83Å; L429-V434 HydrophobicContact CD1-CG2 4.12Å; L429-P476 HydrophobicContact CD2-CG 3.75Å; L429-Y478 HydrophobicContact CD1-CD2 3.81Å; L429-Y478 HydrophobicContact CD1-CE2 3.81Å; L429-Y478 HydrophobicContact CD2-CE2 3.9Å; L429-Y478 HydrophobicContact CG-CE2 4.28Å; L429-L556 HydrophobicContact CB-CD1 3.85Å; L429-L556 HydrophobicContact CD1-CD1 4.35Å; L429-K560 WeakPolarHBondContact O-CE 3.38Å; L429-L563 HydrophobicContact CD1-CD1 3.64Å; L429-L563 HydrophobicContact CG-CD1 4.27Å
430	K	93.4	Very high	95.5	Very high	194 Å²	194	61.3 Å²	61.3	84%	0.843	29%	0.286	S	S	*	.	S	Bend	trans	-72.6	-32.7	173.6	-61.2	175.7	-174.2	171.9	0	112.3	N428	N428-K430 PolarHBondContact O-N 2.91Å; N428-K430 VanDerWaalsContact O-N 3.13Å
431	N	94.1	Very high	95.5	Very high	77 Å²	77	61 Å²	61	41%	0.412	29%	0.288	S	S	.	.	S	Bend	trans	-149.9	152.3	174.1	-173.2	29.5	0	0	0	108.6	M471 K474	N431-M471 WeakPolarHBondContact ND2-CE 3.21Å; N431-K474 PolarHBondContact ND2-O 2.87Å
432	G	95.9	Very high	95.5	Very high	9 Å²	9	62.6 Å²	62.6	9%	0.093	29%	0.294	C	S	.	.			trans	149.7	164.6	-176	0	0	0	0	0	112	P476	G432-P476 VanDerWaalsContact CA-O 3.23Å; G432-P476 WeakPolarHBondContact CA-O 3.37Å
433	R	98.2	Very high	95.5	Very high	66 Å²	66	62.1 Å²	62.1	25%	0.249	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.7	169.7	-66.4	177.6	75.6	174.9	1.3	109.6	F435 M471 P476 V477 Y478 E553	R433-F435 HydrophobicContact CB-CE2 3.77Å; R433-F435 HydrophobicContact CB-CZ 4.27Å; R433-M471 HydrophobicContact CG-CG 4.29Å; R433-M471 HydrophobicContact CG-SD 3.86Å; R433-P476 PolarHBondContact N-O 3.03Å; R433-V477 CarbonylContact O-C 3.54Å; R433-V477 VanDerWaalsContact O-CA 3.3Å; R433-V477 WeakPolarHBondContact O-CA 3.5Å; R433-Y478 PolarHBondContact O-N 2.71Å; R433-E553 IonicContact CZ-OE1 2.88Å; R433-E553 IonicContact NE-OE1 3.42Å; R433-E553 PolarHBondContact NE-OE1 2.98Å; R433-E553 VanDerWaalsContact NH2-CD 3.25Å; R433-E553 IonicContact NH2-OE1 3.54Å; R433-E553 PolarHBondContact NH2-OE1 2.6Å; R433-E553 IonicContact NH2-OE2 3.65Å; R433-E553 PolarHBondContact NH2-OE2 2.86Å
434	V	98.7	Very high	95.8	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.5	-174.6	-175.2	0	0	0	0	110	L429 Y478 L480 V554 A559 L563	L429-V434 HydrophobicContact CD1-CG2 4.12Å; V434-Y478 CarbonylContact C-O 3.22Å; V434-Y478 VanDerWaalsContact CA-O 3.32Å; V434-Y478 WeakPolarHBondContact CA-O 3.43Å; V434-L480 HydrophobicContact CG1-CD1 3.56Å; V434-L480 HydrophobicContact CG1-CD2 4.17Å; V434-L480 HydrophobicContact CG1-CG 3.66Å; V434-V554 HydrophobicContact CB-CB 4.38Å; V434-V554 HydrophobicContact CG1-CB 4.45Å; V434-V554 PolarHBondContact O-N 3.06Å; V434-A559 HydrophobicContact CB-CB 3.72Å; V434-A559 HydrophobicContact CG1-CB 4.11Å; V434-A559 HydrophobicContact CG2-CB 3.66Å; V434-L563 HydrophobicContact CG2-CD1 4.46Å
435	F	98.8	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	147.7	-176.3	-61.2	-89.6	0	0	0	111.3	R433 R463 L464 A467 V477 Y478 L479 L480 Q552 E553	R433-F435 HydrophobicContact CB-CE2 3.77Å; R433-F435 HydrophobicContact CB-CZ 4.27Å; F435-R463 HydrophobicContact CE1-CG 4.3Å; F435-L464 HydrophobicContact CB-CD2 3.95Å; F435-L464 HydrophobicContact CD1-CD2 4.13Å; F435-L464 HydrophobicContact CD2-CD2 3.72Å; F435-L464 HydrophobicContact CE2-CD2 4.27Å; F435-L464 HydrophobicContact CG-CD2 3.65Å; F435-A467 HydrophobicContact CE2-CB 3.57Å; F435-A467 HydrophobicContact CZ-CB 3.46Å; F435-A467 VanDerWaalsContact CZ-CB 3.46Å; F435-V477 HydrophobicContact CD2-CG1 3.94Å; F435-V477 HydrophobicContact CE2-CG1 3.95Å; F435-Y478 PolarHBondContact N-O 2.77Å; F435-L479 HydrophobicContact CB-CD2 4.1Å; F435-L479 HydrophobicContact CD2-CD2 4.41Å; F435-L479 WeakPolarHBondContact O-CA 3.43Å; F435-L480 PolarHBondContact O-N 3.23Å; F435-Q552 CarbonylContact C-O 3.6Å; F435-Q552 VanDerWaalsContact CA-O 3.31Å; F435-Q552 WeakPolarHBondContact CA-O 3.04Å; F435-E553 HydrophobicContact CD1-CB 3.83Å; F435-E553 HydrophobicContact CD1-CG 4.14Å; F435-E553 HydrophobicContact CE1-CB 3.61Å; F435-E553 HydrophobicContact CE1-CG 3.63Å; F435-E553 HydrophobicContact CZ-CG 4.06Å
436	I	98.8	Very high	96.2	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	132.3	168.9	-50.6	-56.4	0	0	0	109	K438 L480 F489 V545 T551 Q552 V554	I436-K438 HydrophobicContact CG2-CD 3.69Å; I436-K438 HydrophobicContact CG2-CG 4.03Å; I436-L480 HydrophobicContact CD1-CB 4Å; I436-L480 HydrophobicContact CD1-CD1 3.77Å; I436-L480 HydrophobicContact CD1-CG 4.42Å; I436-F489 HydrophobicContact CD1-CE1 3.94Å; I436-F489 HydrophobicContact CD1-CZ 4.07Å; I436-F489 HydrophobicContact CG2-CE1 4.1Å; I436-F489 HydrophobicContact CG2-CZ 4.29Å; I436-V545 HydrophobicContact CD1-CG2 3.76Å; I436-V545 HydrophobicContact CG1-CG2 4.44Å; I436-T551 WeakPolarHBondContact O-CA 3.32Å; I436-T551 PolarHBondContact O-N 3.28Å; I436-Q552 HydrophobicContact CB-CB 4.32Å; I436-Q552 HydrophobicContact CG1-CB 4.26Å; I436-Q552 PolarHBondContact N-O 3.48Å; I436-V554 HydrophobicContact CD1-CG2 3.52Å; I436-V554 HydrophobicContact CG1-CG2 3.81Å
437	I	98.8	Very high	96.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130	171.1	-60.7	-59.2	0	0	0	109.8	W454 L464 L479 L480 F481 S482 D550 T551	I437-W454 HydrophobicContact CG2-CZ2 3.56Å; I437-L464 HydrophobicContact CD1-CD1 3.96Å; I437-L479 HydrophobicContact CD1-CD2 4.24Å; I437-L479 HydrophobicContact CG1-CB 3.85Å; I437-L479 HydrophobicContact CG1-CD1 4.49Å; I437-L479 HydrophobicContact CG1-CD2 4.23Å; I437-L479 HydrophobicContact CG1-CG 4.41Å; I437-L480 PolarHBondContact N-O 3.01Å; I437-F481 HydrophobicContact CB-CD1 3.87Å; I437-F481 HydrophobicContact CB-CE1 3.97Å; I437-F481 HydrophobicContact CB-CG 4.25Å; I437-F481 HydrophobicContact CB-CZ 4.39Å; I437-F481 HydrophobicContact CG1-CE1 4.34Å; I437-F481 HydrophobicContact CG1-CZ 4.31Å; I437-F481 HydrophobicContact CG2-CD1 3.6Å; I437-F481 HydrophobicContact CG2-CE1 3.5Å; I437-F481 HydrophobicContact CG2-CG 4.46Å; I437-F481 HydrophobicContact CG2-CZ 4.27Å; I437-S482 PolarHBondContact O-N 3.08Å; I437-D550 WeakPolarHBondContact CA-OD1 3.28Å; I437-T551 HydrophobicContact CD1-CG2 4.17Å
438	K	98.1	Very high	96.5	Very high	26 Å²	26	36.3 Å²	36.3	11%	0.113	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	87.9	-174.2	-62.6	-58.6	-62.7	131.7	0	111.7	I436 S482 V483 N484 D550	I436-K438 HydrophobicContact CG2-CD 3.69Å; I436-K438 HydrophobicContact CG2-CG 4.03Å; K438-S482 WeakPolarHBondContact CA-O 3.47Å; K438-S482 PolarHBondContact NZ-O 2.79Å; K438-S482 PolarHBondContact NZ-OG 2.81Å; K438-V483 VanDerWaalsContact NZ-C 3.34Å; K438-V483 PolarHBondContact NZ-O 2.86Å; K438-N484 WeakPolarHBondContact CE-OD1 3.41Å; K438-N484 PolarHBondContact NZ-OD1 3.4Å; K438-D550 HydrophobicContact CB-CB 4Å; K438-D550 PolarHBondContact N-OD1 2.83Å
439	S	97.1	Very high	96.7	Very high	4 Å²	4	32.8 Å²	32.8	3%	0.028	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	149.7	175.5	-171.3	0	0	0	0	112.7	S441 S482 N484	S439-S441 WeakPolarHBondContact CB-O 3.43Å; S439-S441 PolarHBondContact OG-N 2.87Å; S439-S441 VanDerWaalsContact OG-N 3.17Å; S439-S441 PolarHBondContact OG-O 3.03Å; S439-S482 PolarHBondContact N-O 3.04Å; S439-N484 WeakPolarHBondContact O-CB 3.36Å; S439-N484 VanDerWaalsContact O-CG 3.28Å; S439-N484 PolarHBondContact O-N 3.43Å; S439-N484 PolarHBondContact O-ND2 2.82Å
440	Y	93.9	Very high	96.9	Very high	161 Å²	161	34 Å²	34	63%	0.631	16%	0.155	S	C	*	.	S	Bend	trans	-92.2	-17.7	169.6	-68.1	-88.1	0	0	0	113.5	N484 W513	Y440-N484 WeakPolarHBondContact CD1-ND2 3.47Å; Y440-N484 WeakPolarHBondContact CE1-ND2 3.41Å; Y440-W513 HydrophobicContact CD2-CH2 4.45Å; Y440-W513 HydrophobicContact CD2-CZ2 4.18Å; Y440-W513 HydrophobicContact CE2-CH2 4.4Å
441	S	94.5	Very high	97	Very high	25 Å²	25	29.1 Å²	29.1	18%	0.175	13%	0.132	C	C	.	.			trans	-129	150.3	173.3	-168.1	0	0	0	0	112.8	S439 D443	S439-S441 WeakPolarHBondContact CB-O 3.43Å; S439-S441 PolarHBondContact OG-N 2.87Å; S439-S441 VanDerWaalsContact OG-N 3.17Å; S439-S441 PolarHBondContact OG-O 3.03Å; S441-D443 VanDerWaalsContact C-N 3.32Å; S441-D443 WeakPolarHBondContact OG-CB 3.41Å; S441-D443 PolarHBondContact OG-N 3.21Å; S441-D443 PolarHBondContact OG-OD2 2.81Å
442	E	96.3	Very high	97.2	Very high	72 Å²	72	27 Å²	27	34%	0.336	12%	0.123	S	C	.	.	H	α-helix	trans	-73.2	-26.6	165.5	-73.4	159.8	-162.3	0	0	110.9	D444 I445 H446 V483 Y582	E442-D444 VanDerWaalsContact C-N 3.34Å; E442-D444 PolarHBondContact O-N 3.38Å; E442-I445 WeakPolarHBondContact O-CB 2.91Å; E442-I445 PolarHBondContact O-N 3.3Å; E442-I445 VanDerWaalsContact O-N 3.11Å; E442-H446 PolarHBondContact O-N 3.42Å; E442-V483 HydrophobicContact CG-CB 4.35Å; E442-V483 HydrophobicContact CG-CG1 4.14Å; E442-V483 HydrophobicContact CG-CG2 3.81Å; E442-Y582 HydrophobicContact CB-CE1 4.07Å; E442-Y582 WeakPolarHBondContact CB-OH 3.39Å; E442-Y582 PolarHBondContact OE2-OH 2.82Å
443	D	96.3	Very high	97.3	Very high	18 Å²	18	27.2 Å²	27.2	10%	0.096	12%	0.122	C	C	.	.	H	α-helix	trans	-60.3	-41.5	173.5	-57.9	-72.1	0	0	0	112.2	S441 I445 H446 R447 A509 Y582 R585	S441-D443 VanDerWaalsContact C-N 3.32Å; S441-D443 WeakPolarHBondContact OG-CB 3.41Å; S441-D443 PolarHBondContact OG-N 3.21Å; S441-D443 PolarHBondContact OG-OD2 2.81Å; D443-I445 VanDerWaalsContact C-N 3.28Å; D443-I445 PolarHBondContact O-N 3.28Å; D443-H446 PolarHBondContact O-N 3.16Å; D443-R447 WeakPolarHBondContact O-CB 3.45Å; D443-R447 WeakPolarHBondContact O-CG 3.36Å; D443-R447 PolarHBondContact O-N 3.46Å; D443-A509 HydrophobicContact CB-CB 4.27Å; D443-Y582 VanDerWaalsContact OD1-CD1 3.29Å; D443-Y582 WeakPolarHBondContact OD1-CD1 3.36Å; D443-Y582 WeakPolarHBondContact OD1-CE1 3.43Å; D443-R585 VanDerWaalsContact OD1-CD 3.22Å; D443-R585 WeakPolarHBondContact OD1-CD 3.39Å; D443-R585 IonicContact OD1-CZ 3.14Å; D443-R585 IonicContact OD1-NE 3.7Å; D443-R585 IonicContact OD1-NH1 2.77Å; D443-R585 PolarHBondContact OD1-NH1 2.9Å; D443-R585 IonicContact OD2-NH1 2.71Å; D443-R585 PolarHBondContact OD2-NH1 3.1Å
444	D	96.6	Very high	97.3	Very high	7 Å²	7	24.6 Å²	24.6	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-64.3	-35.4	176.7	-67.8	-43.6	0	0	0	111	E442 S448 W454 W508 A509	E442-D444 VanDerWaalsContact C-N 3.34Å; E442-D444 PolarHBondContact O-N 3.38Å; D444-S448 VanDerWaalsContact O-CB 3.26Å; D444-S448 WeakPolarHBondContact O-CB 3.27Å; D444-S448 PolarHBondContact O-N 2.89Å; D444-W454 HydrophobicContact CB-CH2 4.06Å; D444-W454 HydrophobicContact CB-CZ3 4.12Å; D444-W508 HydrophobicContact CB-CE3 4.26Å; D444-W508 WeakPolarHBondContact OD1-CA 3.46Å; D444-A509 WeakPolarHBondContact OD1-CB 3.5Å; D444-A509 PolarHBondContact OD1-N 2.94Å
445	I	98.1	Very high	97.1	Very high	2 Å²	2	25 Å²	25	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-67.4	-48.2	175.3	-57.2	-63.3	0	0	0	110.5	E442 D443 R447 S448 I449 W454 F481 V483 W521 I575	E442-I445 WeakPolarHBondContact O-CB 2.91Å; E442-I445 PolarHBondContact O-N 3.3Å; E442-I445 VanDerWaalsContact O-N 3.11Å; D443-I445 VanDerWaalsContact C-N 3.28Å; D443-I445 PolarHBondContact O-N 3.28Å; I445-R447 VanDerWaalsContact C-N 3.35Å; I445-R447 PolarHBondContact O-N 3.09Å; I445-S448 WeakPolarHBondContact O-CB 3.35Å; I445-S448 PolarHBondContact O-N 2.91Å; I445-I449 HydrophobicContact CG2-CD1 3.96Å; I445-I449 WeakPolarHBondContact O-CG1 3.39Å; I445-I449 PolarHBondContact O-N 3.22Å; I445-W454 HydrophobicContact CD1-CH2 4.08Å; I445-W454 HydrophobicContact CD1-CZ3 4.24Å; I445-F481 HydrophobicContact CD1-CB 4.36Å; I445-F481 HydrophobicContact CD1-CD1 3.62Å; I445-F481 HydrophobicContact CD1-CE1 4.38Å; I445-F481 HydrophobicContact CD1-CG 4.39Å; I445-V483 HydrophobicContact CD1-CG2 4.39Å; I445-V483 HydrophobicContact CG1-CG2 3.74Å; I445-W521 HydrophobicContact CD1-CH2 4.47Å; I445-W521 HydrophobicContact CG2-CH2 3.83Å; I445-W521 HydrophobicContact CG2-CZ2 4.35Å; I445-I575 HydrophobicContact CB-CD1 3.9Å; I445-I575 HydrophobicContact CG2-CD1 3.78Å
446	H	97.7	Very high	97	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-54.9	-50.7	175.3	166.4	-104.6	0	0	0	111.4	E442 D443 S448 I449 K450 I575 F579 Y582 E583	E442-H446 PolarHBondContact O-N 3.42Å; D443-H446 PolarHBondContact O-N 3.16Å; H446-S448 VanDerWaalsContact C-N 3.3Å; H446-S448 PolarHBondContact O-N 3.4Å; H446-I449 PolarHBondContact O-N 3.44Å; H446-K450 WeakPolarHBondContact O-CB 3.47Å; H446-K450 PolarHBondContact O-N 3.33Å; H446-I575 HydrophobicContact CB-CD1 4.01Å; H446-F579 AromaticContact CD2-CD2 3.64Å; H446-F579 AromaticContact CD2-CE2 3.48Å; H446-F579 VanDerWaalsContact CD2-CE2 3.48Å; H446-F579 WeakPolarHBondContact CD2-CE2 3.25Å; H446-F579 AromaticContact CD2-CZ 3.9Å; H446-F579 AromaticContact NE2-CD2 3.91Å; H446-F579 AromaticContact NE2-CE1 3.72Å; H446-F579 AromaticContact NE2-CE2 3.54Å; H446-F579 AromaticContact NE2-CZ 3.42Å; H446-F579 WeakPolarHBondContact NE2-CZ 3.49Å; H446-Y582 HydrophobicContact CB-CD1 4.17Å; H446-Y582 HydrophobicContact CB-CD2 4.49Å; H446-Y582 HydrophobicContact CB-CG 3.96Å; H446-Y582 VanDerWaalsContact CG-CB 3.44Å; H446-Y582 AromaticContact CG-CG 3.98Å; H446-E583 IonicContact CE1-OE1 2.98Å; H446-E583 PolarHBondContact CE1-OE1 2.91Å; H446-E583 VanDerWaalsContact CE1-OE1 3.25Å; H446-E583 IonicContact NE2-OE1 2.8Å
447	R	96.8	Very high	96.7	Very high	10 Å²	10	27.6 Å²	27.6	4%	0.038	13%	0.131	C	C	.	.	H	α-helix	trans	-66.6	-32.6	-178.9	-64	172.6	-153.2	-167.7	-0.4	111.4	D443 I445 K450 Y451 V507 E589	D443-R447 WeakPolarHBondContact O-CB 3.45Å; D443-R447 WeakPolarHBondContact O-CG 3.36Å; D443-R447 PolarHBondContact O-N 3.46Å; I445-R447 VanDerWaalsContact C-N 3.35Å; I445-R447 PolarHBondContact O-N 3.09Å; R447-K450 PolarHBondContact O-N 2.83Å; R447-Y451 HydrophobicContact CB-CD2 4.22Å; R447-Y451 HydrophobicContact CB-CE2 4.44Å; R447-Y451 WeakPolarHBondContact O-CB 3.42Å; R447-Y451 WeakPolarHBondContact O-CD2 3.27Å; R447-Y451 PolarHBondContact O-N 2.73Å; R447-V507 WeakPolarHBondContact CD-O 3.15Å; R447-V507 PolarHBondContact NH1-O 2.81Å; R447-E589 IonicContact CZ-OE2 3.96Å; R447-E589 IonicContact NH1-OE2 3.77Å; R447-E589 PolarHBondContact NH1-OE2 2.72Å; R447-E589 VanDerWaalsContact NH2-CD 3.34Å; R447-E589 IonicContact NH2-OE1 3.76Å; R447-E589 PolarHBondContact NH2-OE1 3.43Å; R447-E589 IonicContact NH2-OE2 3.72Å; R447-E589 PolarHBondContact NH2-OE2 3.48Å
448	S	98.1	Very high	96.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-42.3	171.6	-174.6	0	0	0	0	113.4	D444 I445 H446 S452 I453 W521	D444-S448 VanDerWaalsContact O-CB 3.26Å; D444-S448 WeakPolarHBondContact O-CB 3.27Å; D444-S448 PolarHBondContact O-N 2.89Å; I445-S448 WeakPolarHBondContact O-CB 3.35Å; I445-S448 PolarHBondContact O-N 2.91Å; H446-S448 VanDerWaalsContact C-N 3.3Å; H446-S448 PolarHBondContact O-N 3.4Å; S448-S452 VanDerWaalsContact O-CA 3.31Å; S448-S452 WeakPolarHBondContact O-CA 3.36Å; S448-S452 PolarHBondContact O-N 2.87Å; S448-I453 WeakPolarHBondContact CA-O 3.33Å; S448-I453 VanDerWaalsContact CB-O 3.28Å; S448-I453 WeakPolarHBondContact CB-O 3.43Å; S448-I453 PolarHBondContact O-N 3.49Å; S448-I453 PolarHBondContact OG-O 2.91Å; S448-W521 PolarHBondContact O-NE1 2.93Å; S448-W521 PolarHBondContact OG-NE1 3.33Å
449	I	97.7	Very high	96.4	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-70.1	-40.6	177	-62.2	158.7	0	0	0	110.5	I445 H446 W521 V524 I575 F576	I445-I449 HydrophobicContact CG2-CD1 3.96Å; I445-I449 WeakPolarHBondContact O-CG1 3.39Å; I445-I449 PolarHBondContact O-N 3.22Å; H446-I449 PolarHBondContact O-N 3.44Å; I449-W521 HydrophobicContact CD1-CD2 4.46Å; I449-W521 HydrophobicContact CD1-CE3 4.4Å; I449-W521 HydrophobicContact CD1-CH2 4.5Å; I449-W521 HydrophobicContact CD1-CZ3 4.41Å; I449-W521 HydrophobicContact CG1-CD2 3.54Å; I449-W521 HydrophobicContact CG1-CE3 3.95Å; I449-W521 HydrophobicContact CG1-CG 3.9Å; I449-W521 HydrophobicContact CG1-CH2 4.26Å; I449-W521 HydrophobicContact CG1-CZ2 3.9Å; I449-W521 HydrophobicContact CG1-CZ3 4.28Å; I449-V524 HydrophobicContact CD1-CG1 3.77Å; I449-V524 HydrophobicContact CD1-CG2 4.38Å; I449-I575 HydrophobicContact CD1-CG2 3.59Å; I449-F576 HydrophobicContact CG2-CE1 3.96Å; I449-F576 HydrophobicContact CG2-CZ 4.39Å
450	K	96.3	Very high	96.4	Very high	40 Å²	40	39 Å²	39	17%	0.174	18%	0.184	C	C	.	.	H	α-helix	trans	-66.8	-34.7	-179.4	-179.6	177.5	176.2	-178.5	0	113.8	V410 H446 R447 E583	V410-K450 HydrophobicContact CG1-CG 4.3Å; H446-K450 WeakPolarHBondContact O-CB 3.47Å; H446-K450 PolarHBondContact O-N 3.33Å; R447-K450 PolarHBondContact O-N 2.83Å; K450-E583 WeakPolarHBondContact CD-OE1 3.4Å; K450-E583 WeakPolarHBondContact CE-OE1 3.44Å; K450-E583 IonicContact NZ-OE1 2.91Å; K450-E583 PolarHBondContact NZ-OE1 2.98Å
451	Y	96.7	Very high	96.6	Very high	90 Å²	90	31.3 Å²	31.3	35%	0.353	15%	0.154	S	C	.	.	H	α-helix	trans	-114	1.9	-174	-62.2	-62.6	0	0	0	114.4	R447 I453 V507 Q586	R447-Y451 HydrophobicContact CB-CD2 4.22Å; R447-Y451 HydrophobicContact CB-CE2 4.44Å; R447-Y451 WeakPolarHBondContact O-CB 3.42Å; R447-Y451 WeakPolarHBondContact O-CD2 3.27Å; R447-Y451 PolarHBondContact O-N 2.73Å; Y451-I453 VanDerWaalsContact C-N 3.28Å; Y451-I453 PolarHBondContact O-N 2.82Å; Y451-V507 HydrophobicContact CD2-CB 4.37Å; Y451-V507 HydrophobicContact CD2-CG1 4.19Å; Y451-V507 HydrophobicContact CD2-CG2 4.3Å; Y451-V507 HydrophobicContact CE2-CB 4.26Å; Y451-V507 HydrophobicContact CE2-CG1 3.91Å; Y451-Q586 PolarHBondContact OH-NE2 3.46Å
452	S	97.8	Very high	96.7	Very high	32 Å²	32	35.1 Å²	35.1	22%	0.224	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	42.1	-179.6	-58.3	0	0	0	0	113.8	H418 S448 D518 V519	H418-S452 PolarHBondContact NE2-OG 2.85Å; S448-S452 VanDerWaalsContact O-CA 3.31Å; S448-S452 WeakPolarHBondContact O-CA 3.36Å; S448-S452 PolarHBondContact O-N 2.87Å; S452-D518 CarbonylContact O-C 3.54Å; S452-D518 WeakPolarHBondContact O-CA 3.13Å; S452-V519 CarbonylContact C-O 3.56Å; S452-V519 WeakPolarHBondContact CA-O 3.36Å; S452-V519 VanDerWaalsContact CB-O 3.28Å; S452-V519 WeakPolarHBondContact CB-O 3.46Å; S452-V519 PolarHBondContact O-N 3.29Å
453	I	97.6	Very high	96.8	Very high	15 Å²	15	35.8 Å²	35.8	8%	0.077	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	159.5	-178.7	55.3	167.8	0	0	0	112.9	S448 Y451 A505 V507 W508 K516 F517 D518	S448-I453 WeakPolarHBondContact CA-O 3.33Å; S448-I453 VanDerWaalsContact CB-O 3.28Å; S448-I453 WeakPolarHBondContact CB-O 3.43Å; S448-I453 PolarHBondContact O-N 3.49Å; S448-I453 PolarHBondContact OG-O 2.91Å; Y451-I453 VanDerWaalsContact C-N 3.28Å; Y451-I453 PolarHBondContact O-N 2.82Å; I453-A505 HydrophobicContact CD1-CB 3.93Å; I453-V507 HydrophobicContact CD1-CG2 4.16Å; I453-W508 HydrophobicContact CD1-CH2 4.24Å; I453-W508 HydrophobicContact CD1-CZ2 4.06Å; I453-W508 HydrophobicContact CG1-CH2 4.02Å; I453-W508 HydrophobicContact CG1-CZ2 4.24Å; I453-K516 HydrophobicContact CB-CG 4.11Å; I453-K516 HydrophobicContact CD1-CD 4.19Å; I453-K516 HydrophobicContact CD1-CG 4.26Å; I453-K516 HydrophobicContact CG2-CD 3.97Å; I453-K516 HydrophobicContact CG2-CG 3.97Å; I453-F517 CarbonylContact C-O 3.3Å; I453-F517 VanDerWaalsContact CA-O 3.26Å; I453-F517 WeakPolarHBondContact CA-O 3.49Å; I453-D518 WeakPolarHBondContact CG2-OD1 3.23Å
454	W	98.1	Very high	96.9	Very high	11 Å²	11	35 Å²	35	4%	0.042	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	164.5	168.6	-167	-109.6	0	0	0	112.9	I437 D444 I445 F481 W508 F517 V519	I437-W454 HydrophobicContact CG2-CZ2 3.56Å; D444-W454 HydrophobicContact CB-CH2 4.06Å; D444-W454 HydrophobicContact CB-CZ3 4.12Å; I445-W454 HydrophobicContact CD1-CH2 4.08Å; I445-W454 HydrophobicContact CD1-CZ3 4.24Å; W454-F481 AromaticContact CD2-CE1 3.66Å; W454-F481 HydrophobicContact CD2-CE1 3.66Å; W454-F481 HydrophobicContact CD2-CZ 4.17Å; W454-F481 AromaticContact CE2-CE1 3.84Å; W454-F481 AromaticContact CE3-CE1 3.75Å; W454-F481 HydrophobicContact CE3-CE1 3.75Å; W454-F481 HydrophobicContact CE3-CZ 4.4Å; W454-F481 HydrophobicContact CG-CE1 4.22Å; W454-F481 HydrophobicContact CG-CZ 4.28Å; W454-F481 HydrophobicContact CH2-CE1 4.18Å; W454-F481 HydrophobicContact CZ2-CE1 4.1Å; W454-F481 AromaticContact CZ3-CE1 4Å; W454-F481 HydrophobicContact CZ3-CE1 4Å; W454-W508 HydrophobicContact CE3-CH2 4.18Å; W454-W508 HydrophobicContact CE3-CZ3 4.15Å; W454-W508 HydrophobicContact CZ3-CZ3 4.24Å; W454-F517 HydrophobicContact CB-CD2 4.44Å; W454-F517 HydrophobicContact CB-CE1 4.22Å; W454-F517 HydrophobicContact CB-CE2 3.86Å; W454-F517 HydrophobicContact CB-CZ 3.76Å; W454-F517 AromaticContact CD1-CE1 3.97Å; W454-F517 AromaticContact CD1-CZ 3.59Å; W454-F517 HydrophobicContact CG-CZ 4.07Å; W454-F517 PolarHBondContact N-O 2.86Å; W454-F517 PolarHBondContact O-N 2.82Å; W454-V519 HydrophobicContact CB-CG1 3.91Å; W454-V519 HydrophobicContact CB-CG2 4.44Å
455	C	96.1	Very high	96.9	Very high	8 Å²	8	35.2 Å²	35.2	5%	0.054	16%	0.164	C	C	.	.			trans	-148.5	131	167.5	-174.2	0	0	0	0	109.5	N461 W508 K514 G515	C455-N461 PolarHBondContact SG-ND2 3.03Å; C455-W508 HydrophobicContact CB-CZ2 3.85Å; C455-K514 PolarHBondContact SG-O 2.95Å; C455-K514 VanDerWaalsContact SG-O 3.36Å; C455-G515 WeakPolarHBondContact CB-O 3.48Å; C455-G515 PolarHBondContact SG-O 3.34Å
456	S	95	Very high	97	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.028	19%	0.188	C	C	.	.			trans	-101.1	-173.9	171.3	174.6	0	0	0	0	110.2	G460 N461 D550	S456-G460 WeakPolarHBondContact OG-CA 3.39Å; S456-N461 WeakPolarHBondContact CA-OD1 3.42Å; S456-N461 WeakPolarHBondContact CB-OD1 3.23Å; S456-N461 PolarHBondContact N-OD1 3.4Å; S456-N461 PolarHBondContact O-ND2 3.01Å; S456-D550 PolarHBondContact OG-OD2 2.85Å
457	T	94.1	Very high	97	Very high	53 Å²	53	38.7 Å²	38.7	33%	0.325	19%	0.188	S	C	.	.			trans	-51.6	157.2	160.1	64.5	0	0	0	0	111.6	H459 G460 N461 W513	T457-H459 VanDerWaalsContact C-N 3.26Å; T457-H459 PolarHBondContact O-N 3.14Å; T457-G460 PolarHBondContact O-N 2.94Å; T457-G460 VanDerWaalsContact O-N 3.08Å; T457-G460 PolarHBondContact OG1-N 3.07Å; T457-N461 WeakPolarHBondContact O-CB 3.22Å; T457-N461 PolarHBondContact O-N 3.41Å; T457-W513 HydrophobicContact CG2-CH2 4.39Å; T457-W513 HydrophobicContact CG2-CZ3 3.96Å
458	E	93.8	Very high	97	Very high	130 Å²	130	40.8 Å²	40.8	61%	0.607	20%	0.197	S	C	*	.	H	α-helix	trans	-54.8	-40.8	176.4	-167.1	-158.1	154.5	0	0	112.7	K462	E458-K462 WeakPolarHBondContact O-CG 3.4Å; E458-K462 PolarHBondContact O-N 2.87Å; E458-K462 VanDerWaalsContact O-N 3.09Å; E458-K462 VanDerWaalsContact OE1-CE 3.25Å; E458-K462 WeakPolarHBondContact OE1-CE 3.24Å; E458-K462 IonicContact OE1-NZ 3.7Å; E458-K462 PolarHBondContact OE1-NZ 3.2Å
459	H	95.6	Very high	97	Very high	138 Å²	138	47.3 Å²	47.3	64%	0.639	22%	0.222	S	C	*	.	H	α-helix	trans	-66.3	-44.4	176	-179.2	83.8	0	0	0	112.1	T457 K462 R463	T457-H459 VanDerWaalsContact C-N 3.26Å; T457-H459 PolarHBondContact O-N 3.14Å; H459-K462 PolarHBondContact O-N 3.29Å; H459-R463 PolarHBondContact O-N 3.34Å
460	G	97.4	Very high	96.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-42.9	177	0	0	0	0	0	112.5	S456 T457 K462 R463 L464 T551	S456-G460 WeakPolarHBondContact OG-CA 3.39Å; T457-G460 PolarHBondContact O-N 2.94Å; T457-G460 VanDerWaalsContact O-N 3.08Å; T457-G460 PolarHBondContact OG1-N 3.07Å; G460-K462 PolarHBondContact O-N 3.24Å; G460-R463 WeakPolarHBondContact O-CB 3.26Å; G460-R463 PolarHBondContact O-N 3.37Å; G460-R463 VanDerWaalsContact O-N 3.1Å; G460-L464 WeakPolarHBondContact O-CG 3.39Å; G460-L464 PolarHBondContact O-N 3.18Å; G460-T551 VanDerWaalsContact CA-CG2 3.47Å
461	N	97.3	Very high	96.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-55.3	-47.8	172.5	-76.5	-14.7	0	0	0	111.3	C455 S456 T457 R463 L464 D465 V499 Y501 K514	C455-N461 PolarHBondContact SG-ND2 3.03Å; S456-N461 WeakPolarHBondContact CA-OD1 3.42Å; S456-N461 WeakPolarHBondContact CB-OD1 3.23Å; S456-N461 PolarHBondContact N-OD1 3.4Å; S456-N461 PolarHBondContact O-ND2 3.01Å; T457-N461 WeakPolarHBondContact O-CB 3.22Å; T457-N461 PolarHBondContact O-N 3.41Å; N461-R463 VanDerWaalsContact C-N 3.33Å; N461-R463 PolarHBondContact O-N 3.41Å; N461-L464 PolarHBondContact O-N 3.43Å; N461-D465 VanDerWaalsContact O-CB 3.28Å; N461-D465 WeakPolarHBondContact O-CB 3.48Å; N461-D465 PolarHBondContact O-N 3.13Å; N461-V499 HydrophobicContact CB-CG1 4.19Å; N461-Y501 HydrophobicContact CB-CE1 4Å; N461-K514 PolarHBondContact ND2-O 3.27Å; N461-K514 VanDerWaalsContact ND2-O 3.13Å
462	K	97.5	Very high	96.6	Very high	105 Å²	105	50.8 Å²	50.8	46%	0.457	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-39.4	174.9	-71.2	173.2	-172.5	174.9	0	112.8	E458 H459 G460 S466 Y501	E458-K462 WeakPolarHBondContact O-CG 3.4Å; E458-K462 PolarHBondContact O-N 2.87Å; E458-K462 VanDerWaalsContact O-N 3.09Å; E458-K462 VanDerWaalsContact OE1-CE 3.25Å; E458-K462 WeakPolarHBondContact OE1-CE 3.24Å; E458-K462 IonicContact OE1-NZ 3.7Å; E458-K462 PolarHBondContact OE1-NZ 3.2Å; H459-K462 PolarHBondContact O-N 3.29Å; G460-K462 PolarHBondContact O-N 3.24Å; K462-S466 WeakPolarHBondContact O-CB 3.26Å; K462-S466 PolarHBondContact O-N 3.37Å; K462-S466 VanDerWaalsContact O-N 3.09Å; K462-Y501 WeakPolarHBondContact CA-OH 3.18Å; K462-Y501 HydrophobicContact CG-CE1 3.89Å
463	R	98.1	Very high	96.2	Very high	87 Å²	87	53.1 Å²	53.1	33%	0.328	29%	0.287	S	S	.	.	H	α-helix	trans	-67.1	-43.8	177.2	-172.7	173.5	-173.3	149.9	6.3	112.4	F435 H459 G460 N461 A467 T551 E553	F435-R463 HydrophobicContact CE1-CG 4.3Å; H459-R463 PolarHBondContact O-N 3.34Å; G460-R463 WeakPolarHBondContact O-CB 3.26Å; G460-R463 PolarHBondContact O-N 3.37Å; G460-R463 VanDerWaalsContact O-N 3.1Å; N461-R463 VanDerWaalsContact C-N 3.33Å; N461-R463 PolarHBondContact O-N 3.41Å; R463-A467 WeakPolarHBondContact O-CB 3.39Å; R463-A467 PolarHBondContact O-N 3.4Å; R463-T551 WeakPolarHBondContact CD-O 3.31Å; R463-E553 IonicContact CZ-OE2 2.6Å; R463-E553 IonicContact NE-OE2 3.29Å; R463-E553 VanDerWaalsContact NH2-CB 3.33Å; R463-E553 IonicContact NH2-OE2 2.99Å; R463-E553 PolarHBondContact NH2-OE2 3.35Å
464	L	98.4	Very high	95.9	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-70.9	-43.2	-179.4	-66.2	176.5	0	0	0	112	F435 I437 G460 N461 S466 A467 F468 L479 M495 F517 T551	F435-L464 HydrophobicContact CB-CD2 3.95Å; F435-L464 HydrophobicContact CD1-CD2 4.13Å; F435-L464 HydrophobicContact CD2-CD2 3.72Å; F435-L464 HydrophobicContact CE2-CD2 4.27Å; F435-L464 HydrophobicContact CG-CD2 3.65Å; I437-L464 HydrophobicContact CD1-CD1 3.96Å; G460-L464 WeakPolarHBondContact O-CG 3.39Å; G460-L464 PolarHBondContact O-N 3.18Å; N461-L464 PolarHBondContact O-N 3.43Å; L464-S466 PolarHBondContact O-N 3.41Å; L464-A467 PolarHBondContact O-N 2.86Å; L464-A467 VanDerWaalsContact O-N 3.14Å; L464-F468 WeakPolarHBondContact O-CB 2.92Å; L464-F468 PolarHBondContact O-N 2.9Å; L464-L479 HydrophobicContact CD2-CD2 3.8Å; L464-M495 HydrophobicContact CB-CE 4.21Å; L464-M495 HydrophobicContact CB-SD 4.02Å; L464-F517 HydrophobicContact CD1-CE1 4.01Å; L464-F517 HydrophobicContact CD1-CZ 3.64Å; L464-T551 HydrophobicContact CD1-CG2 3.88Å; L464-T551 HydrophobicContact CD2-CG2 4.29Å; L464-T551 HydrophobicContact CG-CG2 3.92Å
465	D	98	Very high	95.8	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.07	33%	0.327	C	S	.	.	H	α-helix	trans	-60.8	-45.2	174.9	-168.6	45.7	0	0	0	111.6	N461 A467 F468 R469 P498 V499 Y501	N461-D465 VanDerWaalsContact O-CB 3.28Å; N461-D465 WeakPolarHBondContact O-CB 3.48Å; N461-D465 PolarHBondContact O-N 3.13Å; D465-A467 VanDerWaalsContact C-N 3.3Å; D465-A467 PolarHBondContact O-N 2.7Å; D465-F468 PolarHBondContact O-N 2.8Å; D465-R469 WeakPolarHBondContact O-CB 3.45Å; D465-R469 VanDerWaalsContact O-CG 3.24Å; D465-R469 WeakPolarHBondContact O-CG 3.32Å; D465-R469 PolarHBondContact O-N 3.28Å; D465-R469 IonicContact OD1-CZ 3.38Å; D465-R469 IonicContact OD1-NE 2.82Å; D465-R469 PolarHBondContact OD1-NE 3.36Å; D465-R469 IonicContact OD1-NH2 3.5Å; D465-R469 PolarHBondContact OD1-NH2 3.47Å; D465-R469 VanDerWaalsContact OD1-NH2 3.15Å; D465-R469 IonicContact OD2-CZ 3.25Å; D465-R469 IonicContact OD2-NE 3.53Å; D465-R469 PolarHBondContact OD2-NE 3.44Å; D465-R469 IonicContact OD2-NH2 2.72Å; D465-R469 PolarHBondContact OD2-NH2 2.91Å; D465-P498 WeakPolarHBondContact OD1-CB 3.49Å; D465-V499 HydrophobicContact CB-CB 3.93Å; D465-V499 HydrophobicContact CB-CG2 3.65Å; D465-V499 PolarHBondContact OD1-N 2.83Å; D465-Y501 WeakPolarHBondContact CB-OH 3.31Å; D465-Y501 PolarHBondContact OD2-OH 2.84Å
466	S	98.2	Very high	95.8	Very high	75 Å²	75	61.2 Å²	61.2	52%	0.524	33%	0.33	S	S	.	.	H	α-helix	trans	-58.2	-42	172.8	178.9	0	0	0	0	111.7	K462 L464 A470	K462-S466 WeakPolarHBondContact O-CB 3.26Å; K462-S466 PolarHBondContact O-N 3.37Å; K462-S466 VanDerWaalsContact O-N 3.09Å; L464-S466 PolarHBondContact O-N 3.41Å; S466-A470 WeakPolarHBondContact O-CB 3.5Å; S466-A470 PolarHBondContact O-N 2.97Å
467	A	97.8	Very high	96	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-67.9	-45.1	178.5	0	0	0	0	0	113.2	F435 R463 L464 D465 A470 M471	F435-A467 HydrophobicContact CE2-CB 3.57Å; F435-A467 HydrophobicContact CZ-CB 3.46Å; F435-A467 VanDerWaalsContact CZ-CB 3.46Å; R463-A467 WeakPolarHBondContact O-CB 3.39Å; R463-A467 PolarHBondContact O-N 3.4Å; L464-A467 PolarHBondContact O-N 2.86Å; L464-A467 VanDerWaalsContact O-N 3.14Å; D465-A467 VanDerWaalsContact C-N 3.3Å; D465-A467 PolarHBondContact O-N 2.7Å; A467-A470 PolarHBondContact O-N 2.75Å; A467-M471 WeakPolarHBondContact O-CG 3.42Å; A467-M471 PolarHBondContact O-N 3.36Å
468	F	98	Very high	96.2	Very high	54 Å²	54	59.6 Å²	59.6	24%	0.237	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-47.5	177.1	-176.5	-93.2	0	0	0	111.7	L464 D465 M471 N472 M495 R496 P498	L464-F468 WeakPolarHBondContact O-CB 2.92Å; L464-F468 PolarHBondContact O-N 2.9Å; D465-F468 PolarHBondContact O-N 2.8Å; F468-M471 PolarHBondContact O-N 2.59Å; F468-N472 PolarHBondContact O-N 3.02Å; F468-M495 HydrophobicContact CB-CE 3.81Å; F468-M495 HydrophobicContact CB-SD 3.92Å; F468-M495 HydrophobicContact CD2-CB 4.2Å; F468-M495 HydrophobicContact CD2-CG 3.77Å; F468-M495 HydrophobicContact CD2-SD 4.25Å; F468-M495 HydrophobicContact CE2-CG 4.37Å; F468-M495 VanDerWaalsContact CE2-O 3.31Å; F468-M495 WeakPolarHBondContact CE2-O 3.32Å; F468-M495 HydrophobicContact CG-CE 4.17Å; F468-M495 HydrophobicContact CG-CG 4.35Å; F468-M495 HydrophobicContact CG-SD 4.35Å; F468-R496 WeakPolarHBondContact CZ-O 3.49Å; F468-P498 HydrophobicContact CD1-CB 4.13Å; F468-P498 HydrophobicContact CE1-CB 4.33Å
469	R	97.3	Very high	96.4	Very high	137 Å²	137	53.4 Å²	53.4	52%	0.517	29%	0.289	S	S	.	.	H	α-helix	trans	-63.6	-41.8	176.3	-67.6	174.9	-167.3	-85.6	-0.9	112.3	D465 M471 N472	D465-R469 WeakPolarHBondContact O-CB 3.45Å; D465-R469 VanDerWaalsContact O-CG 3.24Å; D465-R469 WeakPolarHBondContact O-CG 3.32Å; D465-R469 PolarHBondContact O-N 3.28Å; D465-R469 IonicContact OD1-CZ 3.38Å; D465-R469 IonicContact OD1-NE 2.82Å; D465-R469 PolarHBondContact OD1-NE 3.36Å; D465-R469 IonicContact OD1-NH2 3.5Å; D465-R469 PolarHBondContact OD1-NH2 3.47Å; D465-R469 VanDerWaalsContact OD1-NH2 3.15Å; D465-R469 IonicContact OD2-CZ 3.25Å; D465-R469 IonicContact OD2-NE 3.53Å; D465-R469 PolarHBondContact OD2-NE 3.44Å; D465-R469 IonicContact OD2-NH2 2.72Å; D465-R469 PolarHBondContact OD2-NH2 2.91Å; R469-M471 VanDerWaalsContact C-N 3.31Å; R469-M471 PolarHBondContact O-N 3.06Å; R469-N472 PolarHBondContact O-N 3.46Å
470	A	96.4	Very high	96.6	Very high	69 Å²	69	46.9 Å²	46.9	57%	0.57	26%	0.259	S	S	*	.	H	α-helix	trans	-65.7	-31.5	177.3	0	0	0	0	0	113.2	S466 A467 N472	S466-A470 WeakPolarHBondContact O-CB 3.5Å; S466-A470 PolarHBondContact O-N 2.97Å; A467-A470 PolarHBondContact O-N 2.75Å; A470-N472 VanDerWaalsContact C-N 3.34Å
471	M	94.9	Very high	96.6	Very high	15 Å²	15	46.9 Å²	46.9	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-68	-32.8	173.2	-74.9	-58.3	-61.3	0	0	112.5	N431 R433 A467 F468 R469 G473 K474 G475 V477	N431-M471 WeakPolarHBondContact ND2-CE 3.21Å; R433-M471 HydrophobicContact CG-CG 4.29Å; R433-M471 HydrophobicContact CG-SD 3.86Å; A467-M471 WeakPolarHBondContact O-CG 3.42Å; A467-M471 PolarHBondContact O-N 3.36Å; F468-M471 PolarHBondContact O-N 2.59Å; R469-M471 VanDerWaalsContact C-N 3.31Å; R469-M471 PolarHBondContact O-N 3.06Å; M471-G473 PolarHBondContact O-N 2.88Å; M471-G473 VanDerWaalsContact O-N 3.13Å; M471-K474 VanDerWaalsContact O-CB 3.24Å; M471-K474 WeakPolarHBondContact O-CB 3.3Å; M471-K474 WeakPolarHBondContact O-CG 3.44Å; M471-K474 PolarHBondContact O-N 2.82Å; M471-G475 WeakPolarHBondContact CE-O 3.36Å; M471-V477 HydrophobicContact CB-CG2 4.29Å; M471-V477 HydrophobicContact CG-CG2 3.7Å
472	N	91.9	Very high	96.7	Very high	121 Å²	121	47 Å²	47	65%	0.647	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	45	173.4	-162.3	97.8	0	0	0	113	F468 R469 A470 K474	F468-N472 PolarHBondContact O-N 3.02Å; R469-N472 PolarHBondContact O-N 3.46Å; A470-N472 VanDerWaalsContact C-N 3.34Å; N472-K474 PolarHBondContact O-N 2.92Å
473	G	89.1	Confident	96.7	Very high	81 Å²	81	42.5 Å²	42.5	84%	0.835	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.6	1.4	-178.6	0	0	0	0	0	116.4	M471 G475	M471-G473 PolarHBondContact O-N 2.88Å; M471-G473 VanDerWaalsContact O-N 3.13Å; G473-G475 PolarHBondContact O-N 3Å
474	K	91.9	Very high	96.7	Very high	159 Å²	159	41.3 Å²	41.3	69%	0.691	24%	0.241	S	C	*	.	S	Bend	trans	-78.9	4.2	-176.8	-58.3	175.1	-178.8	175.5	0	114.4	N431 M471 N472	N431-K474 PolarHBondContact ND2-O 2.87Å; M471-K474 VanDerWaalsContact O-CB 3.24Å; M471-K474 WeakPolarHBondContact O-CB 3.3Å; M471-K474 WeakPolarHBondContact O-CG 3.44Å; M471-K474 PolarHBondContact O-N 2.82Å; N472-K474 PolarHBondContact O-N 2.92Å
475	G	94.3	Very high	96.6	Very high	25 Å²	25	45.4 Å²	45.4	26%	0.258	28%	0.283	S	S	.	.	S	Bend	trans	161.8	166.7	-178.2	0	0	0	0	0	111.5	M471 G473	M471-G475 WeakPolarHBondContact CE-O 3.36Å; G473-G475 PolarHBondContact O-N 3Å
476	P	96.9	Very high	96.6	Very high	19 Å²	19	46.2 Å²	46.2	12%	0.123	29%	0.29	C	S	.	.			trans	-73.7	157.7	-174.8	30.3	-36.3	0	0	0	113.2	L429 G432 R433 Y478 E494	L429-P476 HydrophobicContact CD2-CG 3.75Å; G432-P476 VanDerWaalsContact CA-O 3.23Å; G432-P476 WeakPolarHBondContact CA-O 3.37Å; R433-P476 PolarHBondContact N-O 3.03Å; P476-Y478 HydrophobicContact CB-CD1 4.05Å; P476-Y478 HydrophobicContact CB-CE1 3.59Å; P476-Y478 HydrophobicContact CB-CE2 4.23Å; P476-Y478 HydrophobicContact CB-CG 4.5Å; P476-Y478 HydrophobicContact CG-CD2 4.46Å; P476-Y478 HydrophobicContact CG-CE1 4.18Å; P476-Y478 HydrophobicContact CG-CE2 3.92Å; P476-E494 HydrophobicContact CB-CG 3.99Å; P476-E494 WeakPolarHBondContact CB-OE1 3.15Å
477	V	98.4	Very high	96.6	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	105.1	161.1	176.3	0	0	0	0	108.1	R433 F435 M471 L479 E494 M495	R433-V477 CarbonylContact O-C 3.54Å; R433-V477 VanDerWaalsContact O-CA 3.3Å; R433-V477 WeakPolarHBondContact O-CA 3.5Å; F435-V477 HydrophobicContact CD2-CG1 3.94Å; F435-V477 HydrophobicContact CE2-CG1 3.95Å; M471-V477 HydrophobicContact CB-CG2 4.29Å; M471-V477 HydrophobicContact CG-CG2 3.7Å; V477-L479 HydrophobicContact CG1-CD2 4.37Å; V477-E494 WeakPolarHBondContact O-CA 3.39Å; V477-M495 HydrophobicContact CB-CB 4.14Å; V477-M495 HydrophobicContact CG1-CB 4.18Å; V477-M495 HydrophobicContact CG1-SD 4.36Å; V477-M495 PolarHBondContact O-N 2.84Å
478	Y	98.6	Very high	96.6	Very high	22 Å²	22	46.5 Å²	46.5	9%	0.086	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	144.3	179.8	-65.6	-36.7	0	0	0	112.9	F425 L429 R433 V434 F435 P476 V492 A493 E494 L522 L563	F425-Y478 HydrophobicContact CE2-CE2 4.21Å; F425-Y478 HydrophobicContact CZ-CD2 4.44Å; F425-Y478 AromaticContact CZ-CE2 3.68Å; F425-Y478 HydrophobicContact CZ-CE2 3.68Å; F425-Y478 AromaticContact CZ-CZ 3.97Å; L429-Y478 HydrophobicContact CD1-CD2 3.81Å; L429-Y478 HydrophobicContact CD1-CE2 3.81Å; L429-Y478 HydrophobicContact CD2-CE2 3.9Å; L429-Y478 HydrophobicContact CG-CE2 4.28Å; R433-Y478 PolarHBondContact O-N 2.71Å; V434-Y478 CarbonylContact C-O 3.22Å; V434-Y478 VanDerWaalsContact CA-O 3.32Å; V434-Y478 WeakPolarHBondContact CA-O 3.43Å; F435-Y478 PolarHBondContact N-O 2.77Å; P476-Y478 HydrophobicContact CB-CD1 4.05Å; P476-Y478 HydrophobicContact CB-CE1 3.59Å; P476-Y478 HydrophobicContact CB-CE2 4.23Å; P476-Y478 HydrophobicContact CB-CG 4.5Å; P476-Y478 HydrophobicContact CG-CD2 4.46Å; P476-Y478 HydrophobicContact CG-CE1 4.18Å; P476-Y478 HydrophobicContact CG-CE2 3.92Å; Y478-V492 HydrophobicContact CG-CG1 4.47Å; Y478-A493 WeakPolarHBondContact CA-O 3.37Å; Y478-E494 HydrophobicContact CD1-CB 3.76Å; Y478-E494 HydrophobicContact CD1-CG 3.71Å; Y478-E494 HydrophobicContact CE1-CB 3.76Å; Y478-E494 HydrophobicContact CE1-CG 3.61Å; Y478-L522 HydrophobicContact CD1-CD1 4.11Å; Y478-L522 HydrophobicContact CE1-CD1 3.46Å; Y478-L522 VanDerWaalsContact CE1-CD1 3.46Å; Y478-L563 HydrophobicContact CD2-CD1 3.95Å; Y478-L563 HydrophobicContact CD2-CD2 4.21Å; Y478-L563 HydrophobicContact CE2-CD1 4.37Å
479	L	98.8	Very high	96.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	114.5	-175.5	-57.2	-176.9	0	0	0	108.1	F435 I437 L464 V477 F481 V492 A493 M495 F517 V519	F435-L479 HydrophobicContact CB-CD2 4.1Å; F435-L479 HydrophobicContact CD2-CD2 4.41Å; F435-L479 WeakPolarHBondContact O-CA 3.43Å; I437-L479 HydrophobicContact CD1-CD2 4.24Å; I437-L479 HydrophobicContact CG1-CB 3.85Å; I437-L479 HydrophobicContact CG1-CD1 4.49Å; I437-L479 HydrophobicContact CG1-CD2 4.23Å; I437-L479 HydrophobicContact CG1-CG 4.41Å; L464-L479 HydrophobicContact CD2-CD2 3.8Å; V477-L479 HydrophobicContact CG1-CD2 4.37Å; L479-F481 HydrophobicContact CB-CD2 4.28Å; L479-F481 HydrophobicContact CB-CE2 3.59Å; L479-F481 HydrophobicContact CB-CZ 4.19Å; L479-F481 HydrophobicContact CD1-CZ 4.47Å; L479-F481 VanDerWaalsContact O-CD2 3.28Å; L479-F481 WeakPolarHBondContact O-CD2 3.38Å; L479-V492 VanDerWaalsContact O-CA 3.3Å; L479-V492 WeakPolarHBondContact O-CA 3.03Å; L479-A493 PolarHBondContact N-O 3.23Å; L479-A493 PolarHBondContact O-N 2.98Å; L479-M495 HydrophobicContact CD1-CB 4.25Å; L479-F517 HydrophobicContact CD1-CE2 3.69Å; L479-F517 HydrophobicContact CD1-CZ 4.08Å; L479-V519 HydrophobicContact CD1-CG1 4.02Å
480	L	98.8	Very high	96.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	104.9	-176.4	-55.8	179	0	0	0	109.1	V434 F435 I436 I437 F489 V492 V554 V562 L563 I566	V434-L480 HydrophobicContact CG1-CD1 3.56Å; V434-L480 HydrophobicContact CG1-CD2 4.17Å; V434-L480 HydrophobicContact CG1-CG 3.66Å; F435-L480 PolarHBondContact O-N 3.23Å; I436-L480 HydrophobicContact CD1-CB 4Å; I436-L480 HydrophobicContact CD1-CD1 3.77Å; I436-L480 HydrophobicContact CD1-CG 4.42Å; I437-L480 PolarHBondContact N-O 3.01Å; L480-F489 HydrophobicContact CB-CD1 4.05Å; L480-F489 HydrophobicContact CB-CE1 3.87Å; L480-V492 HydrophobicContact CD2-CB 4.31Å; L480-V492 HydrophobicContact CD2-CG1 3.89Å; L480-V492 HydrophobicContact CD2-CG2 3.56Å; L480-V554 HydrophobicContact CD1-CG2 4.46Å; L480-V562 HydrophobicContact CD1-CB 4.41Å; L480-V562 HydrophobicContact CD1-CG1 3.67Å; L480-L563 HydrophobicContact CD2-CD2 3.91Å; L480-I566 HydrophobicContact CD2-CD1 4.11Å
481	F	98.8	Very high	96.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.7	-170.8	-73.7	-97.9	0	0	0	112.6	I437 I445 W454 L479 F489 C490 G491 A493 W521	I437-F481 HydrophobicContact CB-CD1 3.87Å; I437-F481 HydrophobicContact CB-CE1 3.97Å; I437-F481 HydrophobicContact CB-CG 4.25Å; I437-F481 HydrophobicContact CB-CZ 4.39Å; I437-F481 HydrophobicContact CG1-CE1 4.34Å; I437-F481 HydrophobicContact CG1-CZ 4.31Å; I437-F481 HydrophobicContact CG2-CD1 3.6Å; I437-F481 HydrophobicContact CG2-CE1 3.5Å; I437-F481 HydrophobicContact CG2-CG 4.46Å; I437-F481 HydrophobicContact CG2-CZ 4.27Å; I445-F481 HydrophobicContact CD1-CB 4.36Å; I445-F481 HydrophobicContact CD1-CD1 3.62Å; I445-F481 HydrophobicContact CD1-CE1 4.38Å; I445-F481 HydrophobicContact CD1-CG 4.39Å; W454-F481 AromaticContact CD2-CE1 3.66Å; W454-F481 HydrophobicContact CD2-CE1 3.66Å; W454-F481 HydrophobicContact CD2-CZ 4.17Å; W454-F481 AromaticContact CE2-CE1 3.84Å; W454-F481 AromaticContact CE3-CE1 3.75Å; W454-F481 HydrophobicContact CE3-CE1 3.75Å; W454-F481 HydrophobicContact CE3-CZ 4.4Å; W454-F481 HydrophobicContact CG-CE1 4.22Å; W454-F481 HydrophobicContact CG-CZ 4.28Å; W454-F481 HydrophobicContact CH2-CE1 4.18Å; W454-F481 HydrophobicContact CZ2-CE1 4.1Å; W454-F481 AromaticContact CZ3-CE1 4Å; W454-F481 HydrophobicContact CZ3-CE1 4Å; L479-F481 HydrophobicContact CB-CD2 4.28Å; L479-F481 HydrophobicContact CB-CE2 3.59Å; L479-F481 HydrophobicContact CB-CZ 4.19Å; L479-F481 HydrophobicContact CD1-CZ 4.47Å; L479-F481 VanDerWaalsContact O-CD2 3.28Å; L479-F481 WeakPolarHBondContact O-CD2 3.38Å; F481-F489 CarbonylContact O-C 3.51Å; F481-F489 VanDerWaalsContact O-CA 3.25Å; F481-F489 WeakPolarHBondContact O-CA 3.32Å; F481-F489 WeakPolarHBondContact O-CB 3.41Å; F481-F489 WeakPolarHBondContact O-CD1 3.39Å; F481-C490 PolarHBondContact O-N 3.4Å; F481-G491 PolarHBondContact N-O 2.85Å; F481-A493 HydrophobicContact CE2-CB 3.74Å; F481-W521 HydrophobicContact CB-CH2 3.8Å; F481-W521 HydrophobicContact CB-CZ3 4.2Å; F481-W521 AromaticContact CD1-CH2 3.69Å; F481-W521 HydrophobicContact CD1-CH2 3.69Å; F481-W521 AromaticContact CD1-CZ2 3.98Å; F481-W521 HydrophobicContact CD1-CZ2 3.98Å; F481-W521 AromaticContact CD2-CH2 3.49Å; F481-W521 HydrophobicContact CD2-CH2 3.49Å; F481-W521 VanDerWaalsContact CD2-CH2 3.49Å; F481-W521 AromaticContact CD2-CZ2 3.96Å; F481-W521 HydrophobicContact CD2-CZ2 3.96Å; F481-W521 AromaticContact CD2-CZ3 3.88Å; F481-W521 HydrophobicContact CD2-CZ3 3.88Å; F481-W521 HydrophobicContact CE1-CH2 4.06Å; F481-W521 AromaticContact CE1-CZ2 3.86Å; F481-W521 HydrophobicContact CE1-CZ2 3.86Å; F481-W521 AromaticContact CE2-CH2 3.91Å; F481-W521 HydrophobicContact CE2-CH2 3.91Å; F481-W521 AromaticContact CE2-CZ2 3.87Å; F481-W521 HydrophobicContact CE2-CZ2 3.87Å; F481-W521 HydrophobicContact CE2-CZ3 4.45Å; F481-W521 AromaticContact CG-CH2 3.37Å; F481-W521 HydrophobicContact CG-CH2 3.37Å; F481-W521 HydrophobicContact CG-CZ2 4.01Å; F481-W521 HydrophobicContact CG-CZ3 4.04Å; F481-W521 HydrophobicContact CZ-CH2 4.17Å; F481-W521 AromaticContact CZ-CZ2 3.82Å; F481-W521 HydrophobicContact CZ-CZ2 3.82Å
482	S	98.6	Very high	97	Very high	4 Å²	4	34 Å²	34	3%	0.028	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	132.2	172.6	169.6	0	0	0	0	109.4	I437 K438 S439 H488	I437-S482 PolarHBondContact O-N 3.08Å; K438-S482 WeakPolarHBondContact CA-O 3.47Å; K438-S482 PolarHBondContact NZ-O 2.79Å; K438-S482 PolarHBondContact NZ-OG 2.81Å; S439-S482 PolarHBondContact N-O 3.04Å; S482-H488 VanDerWaalsContact CB-O 3.32Å; S482-H488 WeakPolarHBondContact CB-O 3.24Å; S482-H488 PolarHBondContact OG-O 3.01Å
483	V	98.3	Very high	97.3	Very high	9 Å²	9	28.2 Å²	28.2	6%	0.055	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	150	175.6	179.8	0	0	0	0	110.5	K438 E442 I445 G485 S486	K438-V483 VanDerWaalsContact NZ-C 3.34Å; K438-V483 PolarHBondContact NZ-O 2.86Å; E442-V483 HydrophobicContact CG-CB 4.35Å; E442-V483 HydrophobicContact CG-CG1 4.14Å; E442-V483 HydrophobicContact CG-CG2 3.81Å; I445-V483 HydrophobicContact CD1-CG2 4.39Å; I445-V483 HydrophobicContact CG1-CG2 3.74Å; V483-G485 PolarHBondContact O-N 3.1Å; V483-S486 PolarHBondContact O-N 3.42Å; V483-S486 PolarHBondContact O-OG 3.09Å
484	N	97.4	Very high	97.7	Very high	62 Å²	62	25.9 Å²	25.9	33%	0.332	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	123.1	177.8	-72.3	-32.7	0	0	0	110.9	K438 S439 Y440 S486	K438-N484 WeakPolarHBondContact CE-OD1 3.41Å; K438-N484 PolarHBondContact NZ-OD1 3.4Å; S439-N484 WeakPolarHBondContact O-CB 3.36Å; S439-N484 VanDerWaalsContact O-CG 3.28Å; S439-N484 PolarHBondContact O-N 3.43Å; S439-N484 PolarHBondContact O-ND2 2.82Å; Y440-N484 WeakPolarHBondContact CD1-ND2 3.47Å; Y440-N484 WeakPolarHBondContact CE1-ND2 3.41Å; N484-S486 VanDerWaalsContact C-N 3.33Å; N484-S486 PolarHBondContact O-N 3.33Å
485	G	97	Very high	98	Very high	86 Å²	86	18.4 Å²	18.4	89%	0.887	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.4	-6.1	-178.3	0	0	0	0	0	116.2	V483 G487	V483-G485 PolarHBondContact O-N 3.1Å; G485-G487 VanDerWaalsContact C-N 3.3Å; G485-G487 PolarHBondContact O-N 3.02Å
486	S	96.9	Very high	98.2	Very high	31 Å²	31	22.8 Å²	22.8	22%	0.217	15%	0.145	C	C	.	.	S	Bend	trans	-74.1	-16.8	-174.7	81	0	0	0	0	114.9	V483 N484 H488	V483-S486 PolarHBondContact O-N 3.42Å; V483-S486 PolarHBondContact O-OG 3.09Å; N484-S486 VanDerWaalsContact C-N 3.33Å; N484-S486 PolarHBondContact O-N 3.33Å; S486-H488 VanDerWaalsContact C-N 3.27Å; S486-H488 WeakPolarHBondContact CB-CE1 3.46Å; S486-H488 PolarHBondContact O-N 2.81Å; S486-H488 PolarHBondContact O-ND1 3.09Å; S486-H488 PolarHBondContact OG-CE1 2.87Å; S486-H488 VanDerWaalsContact OG-CE1 3.28Å; S486-H488 PolarHBondContact OG-ND1 3.32Å; S486-H488 PolarHBondContact OG-NE2 2.89Å; S486-H488 PolarHBondContact OG-O 2.89Å
487	G	98	Very high	98.2	Very high	44 Å²	44	22.8 Å²	22.8	45%	0.454	15%	0.145	S	C	.	.	S	Bend	trans	74.9	9	178.3	0	0	0	0	0	115.3	G485 N529	G485-G487 VanDerWaalsContact C-N 3.3Å; G485-G487 PolarHBondContact O-N 3.02Å; G487-N529 VanDerWaalsContact C-CG 3.44Å; G487-N529 VanDerWaalsContact O-CB 3.22Å; G487-N529 WeakPolarHBondContact O-CB 3.34Å; G487-N529 PolarHBondContact O-N 2.95Å
488	H	98.6	Very high	98.2	Very high	37 Å²	37	25.2 Å²	25.2	17%	0.171	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	167.3	-178.9	61.7	-96.1	0	0	0	112.2	S482 S486 D526 V527 N529	S482-H488 VanDerWaalsContact CB-O 3.32Å; S482-H488 WeakPolarHBondContact CB-O 3.24Å; S482-H488 PolarHBondContact OG-O 3.01Å; S486-H488 VanDerWaalsContact C-N 3.27Å; S486-H488 WeakPolarHBondContact CB-CE1 3.46Å; S486-H488 PolarHBondContact O-N 2.81Å; S486-H488 PolarHBondContact O-ND1 3.09Å; S486-H488 PolarHBondContact OG-CE1 2.87Å; S486-H488 VanDerWaalsContact OG-CE1 3.28Å; S486-H488 PolarHBondContact OG-ND1 3.32Å; S486-H488 PolarHBondContact OG-NE2 2.89Å; S486-H488 PolarHBondContact OG-O 2.89Å; H488-D526 IonicContact CD2-OD1 2.69Å; H488-D526 IonicContact NE2-OD1 3.03Å; H488-V527 WeakPolarHBondContact CA-O 3.38Å; H488-V527 WeakPolarHBondContact CB-O 3.38Å; H488-N529 WeakPolarHBondContact CA-OD1 3.15Å
489	F	98.7	Very high	98.1	Very high	3 Å²	3	24.5 Å²	24.5	1%	0.013	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	135.5	158.5	-77.2	-103.2	0	0	0	108.6	I436 L480 F481 D526 V527 L532 T546	I436-F489 HydrophobicContact CD1-CE1 3.94Å; I436-F489 HydrophobicContact CD1-CZ 4.07Å; I436-F489 HydrophobicContact CG2-CE1 4.1Å; I436-F489 HydrophobicContact CG2-CZ 4.29Å; L480-F489 HydrophobicContact CB-CD1 4.05Å; L480-F489 HydrophobicContact CB-CE1 3.87Å; F481-F489 CarbonylContact O-C 3.51Å; F481-F489 VanDerWaalsContact O-CA 3.25Å; F481-F489 WeakPolarHBondContact O-CA 3.32Å; F481-F489 WeakPolarHBondContact O-CB 3.41Å; F481-F489 WeakPolarHBondContact O-CD1 3.39Å; F489-D526 CarbonylContact O-C 3.59Å; F489-D526 WeakPolarHBondContact O-CA 3.25Å; F489-V527 PolarHBondContact N-O 3.42Å; F489-V527 PolarHBondContact O-N 3.5Å; F489-L532 HydrophobicContact CB-CD1 4.44Å; F489-L532 HydrophobicContact CD2-CD1 3.48Å; F489-L532 VanDerWaalsContact CD2-CD1 3.48Å; F489-L532 HydrophobicContact CE2-CD1 3.93Å; F489-L532 HydrophobicContact CG-CD1 4.06Å; F489-T546 HydrophobicContact CE2-CG2 4.33Å
490	C	98.3	Very high	97.9	Very high	6 Å²	6	28 Å²	28	4%	0.041	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-9.7	-174.9	51.5	0	0	0	0	113.5	F481 K525	F481-C490 PolarHBondContact O-N 3.4Å; C490-K525 CarbonylContact C-O 3.57Å; C490-K525 CarbonylContact O-C 3.45Å; C490-K525 PolarHBondContact O-N 3.05Å; C490-K525 VanDerWaalsContact O-O 3.1Å
491	G	98	Very high	97.7	Very high	2 Å²	2	32.1 Å²	32.1	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-172.8	174.6	0	0	0	0	0	115.5	F481 F523	F481-G491 PolarHBondContact N-O 2.85Å; G491-F523 CarbonylContact C-O 3.44Å; G491-F523 WeakPolarHBondContact CA-O 3.37Å
492	V	98.8	Very high	97.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	132.9	179.2	-176.6	0	0	0	0	109	Y478 L479 L480 L522 F523 L563 I566	Y478-V492 HydrophobicContact CG-CG1 4.47Å; L479-V492 VanDerWaalsContact O-CA 3.3Å; L479-V492 WeakPolarHBondContact O-CA 3.03Å; L480-V492 HydrophobicContact CD2-CB 4.31Å; L480-V492 HydrophobicContact CD2-CG1 3.89Å; L480-V492 HydrophobicContact CD2-CG2 3.56Å; V492-L522 PolarHBondContact O-N 2.8Å; V492-F523 HydrophobicContact CB-CB 4.14Å; V492-F523 HydrophobicContact CB-CD2 4.14Å; V492-F523 HydrophobicContact CG2-CB 4.25Å; V492-F523 HydrophobicContact CG2-CD2 4.3Å; V492-F523 PolarHBondContact N-O 2.93Å; V492-F523 PolarHBondContact O-N 3Å; V492-L563 HydrophobicContact CG1-CD2 4.31Å; V492-I566 HydrophobicContact CG2-CD1 3.93Å; V492-I566 HydrophobicContact CG2-CG2 3.94Å
493	A	98.6	Very high	96.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	158.5	169.3	0	0	0	0	0	111.6	Y478 L479 F481 V519 D520 W521	Y478-A493 WeakPolarHBondContact CA-O 3.37Å; L479-A493 PolarHBondContact N-O 3.23Å; L479-A493 PolarHBondContact O-N 2.98Å; F481-A493 HydrophobicContact CE2-CB 3.74Å; A493-V519 HydrophobicContact CB-CB 4.07Å; A493-V519 HydrophobicContact CB-CG2 4.36Å; A493-D520 CarbonylContact C-O 3.58Å; A493-D520 WeakPolarHBondContact CA-O 3.46Å; A493-D520 WeakPolarHBondContact CB-O 3.43Å; A493-W521 HydrophobicContact CB-CB 4.49Å; A493-W521 HydrophobicContact CB-CD2 3.93Å; A493-W521 HydrophobicContact CB-CE3 4.4Å; A493-W521 HydrophobicContact CB-CG 3.95Å
494	E	98.1	Very high	95.9	Very high	32 Å²	32	39.9 Å²	39.9	15%	0.15	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.5	167.6	-161.8	178.5	154.4	0	0	110.1	P476 V477 Y478 R496 V519 D520 L522	P476-E494 HydrophobicContact CB-CG 3.99Å; P476-E494 WeakPolarHBondContact CB-OE1 3.15Å; V477-E494 WeakPolarHBondContact O-CA 3.39Å; Y478-E494 HydrophobicContact CD1-CB 3.76Å; Y478-E494 HydrophobicContact CD1-CG 3.71Å; Y478-E494 HydrophobicContact CE1-CB 3.76Å; Y478-E494 HydrophobicContact CE1-CG 3.61Å; E494-R496 VanDerWaalsContact CD-CZ 3.44Å; E494-R496 PolarHBondContact O-N 3.11Å; E494-R496 IonicContact OE1-CZ 3.15Å; E494-R496 IonicContact OE1-NH1 2.93Å; E494-R496 PolarHBondContact OE1-NH1 3.49Å; E494-R496 IonicContact OE2-CZ 2.6Å; E494-R496 IonicContact OE2-NH1 2.83Å; E494-R496 PolarHBondContact OE2-NH1 2.61Å; E494-R496 IonicContact OE2-NH2 3.67Å; E494-R496 PolarHBondContact OE2-NH2 3.11Å; E494-V519 CarbonylContact O-C 3.49Å; E494-V519 VanDerWaalsContact O-CA 3.25Å; E494-V519 WeakPolarHBondContact O-CA 3.24Å; E494-D520 PolarHBondContact N-O 2.81Å; E494-D520 PolarHBondContact O-N 2.88Å; E494-L522 HydrophobicContact CB-CD1 4.28Å
495	M	98.3	Very high	95.3	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	123	171.1	-174.6	168.4	177.5	0	0	109.2	L464 F468 V477 L479 S497 V499 F517	L464-M495 HydrophobicContact CB-CE 4.21Å; L464-M495 HydrophobicContact CB-SD 4.02Å; F468-M495 HydrophobicContact CB-CE 3.81Å; F468-M495 HydrophobicContact CB-SD 3.92Å; F468-M495 HydrophobicContact CD2-CB 4.2Å; F468-M495 HydrophobicContact CD2-CG 3.77Å; F468-M495 HydrophobicContact CD2-SD 4.25Å; F468-M495 HydrophobicContact CE2-CG 4.37Å; F468-M495 VanDerWaalsContact CE2-O 3.31Å; F468-M495 WeakPolarHBondContact CE2-O 3.32Å; F468-M495 HydrophobicContact CG-CE 4.17Å; F468-M495 HydrophobicContact CG-CG 4.35Å; F468-M495 HydrophobicContact CG-SD 4.35Å; V477-M495 HydrophobicContact CB-CB 4.14Å; V477-M495 HydrophobicContact CG1-CB 4.18Å; V477-M495 HydrophobicContact CG1-SD 4.36Å; V477-M495 PolarHBondContact O-N 2.84Å; L479-M495 HydrophobicContact CD1-CB 4.25Å; M495-S497 WeakPolarHBondContact CE-O 3.35Å; M495-V499 HydrophobicContact CE-CG2 3.89Å; M495-F517 HydrophobicContact CE-CB 4.22Å; M495-F517 HydrophobicContact CE-CD1 4.47Å; M495-F517 HydrophobicContact CE-CD2 3.9Å; M495-F517 HydrophobicContact CE-CE2 4.28Å; M495-F517 HydrophobicContact CE-CG 3.97Å; M495-F517 HydrophobicContact CG-CD2 3.74Å; M495-F517 HydrophobicContact CG-CE2 3.93Å; M495-F517 HydrophobicContact SD-CD2 4.1Å; M495-F517 HydrophobicContact SD-CE2 4.01Å
496	R	97.8	Very high	94.8	Very high	117 Å²	117	35.5 Å²	35.5	44%	0.442	22%	0.224	S	C	.	.			trans	-105.9	-23.6	-174.2	-70.1	-71.2	-178.6	-135.3	-10.6	113.9	F468 E494 D518 D520	F468-R496 WeakPolarHBondContact CZ-O 3.49Å; E494-R496 VanDerWaalsContact CD-CZ 3.44Å; E494-R496 PolarHBondContact O-N 3.11Å; E494-R496 IonicContact OE1-CZ 3.15Å; E494-R496 IonicContact OE1-NH1 2.93Å; E494-R496 PolarHBondContact OE1-NH1 3.49Å; E494-R496 IonicContact OE2-CZ 2.6Å; E494-R496 IonicContact OE2-NH1 2.83Å; E494-R496 PolarHBondContact OE2-NH1 2.61Å; E494-R496 IonicContact OE2-NH2 3.67Å; E494-R496 PolarHBondContact OE2-NH2 3.11Å; R496-D518 HydrophobicContact CB-CB 4.4Å; R496-D518 PolarHBondContact N-O 2.71Å; R496-D520 HydrophobicContact CG-CB 3.63Å; R496-D520 IonicContact CZ-OD2 3.31Å; R496-D520 VanDerWaalsContact NE-CB 3.35Å; R496-D520 IonicContact NE-OD2 3.86Å; R496-D520 PolarHBondContact NE-OD2 2.88Å; R496-D520 IonicContact NH2-OD2 2.72Å; R496-D520 PolarHBondContact NH2-OD2 3.15Å
497	S	97.7	Very high	94.4	Very high	19 Å²	19	35.5 Å²	35.5	13%	0.133	22%	0.223	C	C	.	.	S	Bend	trans	-123.9	160.7	178	84.7	0	0	0	0	112.3	M495 F517 D518	M495-S497 WeakPolarHBondContact CE-O 3.35Å; S497-F517 WeakPolarHBondContact OG-CA 3.28Å; S497-F517 WeakPolarHBondContact OG-CB 3.33Å; S497-D518 PolarHBondContact N-O 3.18Å; S497-D518 PolarHBondContact OG-N 3.44Å
498	P	97.4	Very high	94	Very high	54 Å²	54	33.9 Å²	33.9	35%	0.351	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-65.8	171	158.5	32.6	-36	0	0	0	110.6	D465 F468	D465-P498 WeakPolarHBondContact OD1-CB 3.49Å; F468-P498 HydrophobicContact CD1-CB 4.13Å; F468-P498 HydrophobicContact CE1-CB 4.33Å
499	V	97.3	Very high	93.4	Very high	6 Å²	6	34.2 Å²	34.2	4%	0.036	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-84.2	123.8	177.4	-174.6	0	0	0	0	111.2	N461 D465 M495 Y501 F517	N461-V499 HydrophobicContact CB-CG1 4.19Å; D465-V499 HydrophobicContact CB-CB 3.93Å; D465-V499 HydrophobicContact CB-CG2 3.65Å; D465-V499 PolarHBondContact OD1-N 2.83Å; M495-V499 HydrophobicContact CE-CG2 3.89Å; V499-Y501 HydrophobicContact CB-CD2 4.44Å; V499-Y501 HydrophobicContact CB-CE1 4.43Å; V499-Y501 HydrophobicContact CB-CE2 3.97Å; V499-Y501 HydrophobicContact CG1-CD1 4.08Å; V499-Y501 HydrophobicContact CG1-CD2 4.19Å; V499-Y501 HydrophobicContact CG1-CE1 4.02Å; V499-Y501 HydrophobicContact CG1-CE2 4.13Å; V499-Y501 HydrophobicContact CG1-CG 4.17Å; V499-Y501 WeakPolarHBondContact O-CD2 3.15Å; V499-Y501 WeakPolarHBondContact O-CE2 3.3Å; V499-F517 HydrophobicContact CG2-CB 4.07Å; V499-F517 HydrophobicContact CG2-CD1 3.68Å; V499-F517 HydrophobicContact CG2-CE1 4.38Å; V499-F517 HydrophobicContact CG2-CG 4.12Å
500	D	95.6	Very high	92.6	Very high	74 Å²	74	38.5 Å²	38.5	40%	0.396	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-85.4	117.3	157.6	170.3	6.7	0	0	0	107.7	G502 T503 G515 K516	D500-G502 PolarHBondContact OD1-N 2.68Å; D500-T503 PolarHBondContact OD1-N 3.17Å; D500-T503 WeakPolarHBondContact OD2-CB 3.28Å; D500-T503 PolarHBondContact OD2-OG1 3.17Å; D500-G515 CarbonylContact O-C 3.37Å; D500-G515 WeakPolarHBondContact O-CA 3.36Å; D500-K516 PolarHBondContact N-O 3.47Å; D500-K516 PolarHBondContact O-N 3.13Å
501	Y	94	Very high	91.7	Very high	87 Å²	87	42.5 Å²	42.5	34%	0.341	25%	0.253	S	S	.	.	S	Bend	trans	-87.8	-16.9	-179.2	-60	-96.3	0	0	0	113.4	N461 K462 D465 V499	N461-Y501 HydrophobicContact CB-CE1 4Å; K462-Y501 WeakPolarHBondContact CA-OH 3.18Å; K462-Y501 HydrophobicContact CG-CE1 3.89Å; D465-Y501 WeakPolarHBondContact CB-OH 3.31Å; D465-Y501 PolarHBondContact OD2-OH 2.84Å; V499-Y501 HydrophobicContact CB-CD2 4.44Å; V499-Y501 HydrophobicContact CB-CE1 4.43Å; V499-Y501 HydrophobicContact CB-CE2 3.97Å; V499-Y501 HydrophobicContact CG1-CD1 4.08Å; V499-Y501 HydrophobicContact CG1-CD2 4.19Å; V499-Y501 HydrophobicContact CG1-CE1 4.02Å; V499-Y501 HydrophobicContact CG1-CE2 4.13Å; V499-Y501 HydrophobicContact CG1-CG 4.17Å; V499-Y501 WeakPolarHBondContact O-CD2 3.15Å; V499-Y501 WeakPolarHBondContact O-CE2 3.3Å
502	G	86.7	Confident	91	Very high	68 Å²	68	48.1 Å²	48.1	70%	0.701	28%	0.277	S	S	*	.	S	Bend	trans	-81.8	-35	-178.4	0	0	0	0	0	112.7	D500 S504	D500-G502 PolarHBondContact OD1-N 2.68Å; G502-S504 PolarHBondContact O-N 2.85Å
503	T	88.1	Confident	90.2	Very high	52 Å²	52	50 Å²	50	32%	0.319	28%	0.284	S	S	.	.			trans	-68.8	129.6	179.1	-71.5	0	0	0	0	112.5	D500 G515 K516	D500-T503 PolarHBondContact OD1-N 3.17Å; D500-T503 WeakPolarHBondContact OD2-CB 3.28Å; D500-T503 PolarHBondContact OD2-OG1 3.17Å; T503-G515 CarbonylContact O-C 3.39Å; T503-G515 VanDerWaalsContact O-C 3.3Å; T503-G515 VanDerWaalsContact O-CA 3.24Å; T503-G515 WeakPolarHBondContact O-CA 3.47Å; T503-G515 PolarHBondContact O-N 2.59Å; T503-K516 HydrophobicContact CG2-CB 4.02Å; T503-K516 HydrophobicContact CG2-CD 4.09Å
504	S	83.2	Confident	89.6	Confident	56 Å²	56	54.8 Å²	54.8	39%	0.392	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-104.2	107.5	164.8	179.1	0	0	0	0	108.3	G502 G506 K514	G502-S504 PolarHBondContact O-N 2.85Å; S504-G506 PolarHBondContact O-N 2.94Å; S504-G506 VanDerWaalsContact O-N 3.1Å; S504-K514 PolarHBondContact OG-NZ 3.37Å
505	A	84.9	Confident	89.3	Confident	25 Å²	25	53.2 Å²	53.2	21%	0.207	30%	0.297	C	S	.	.			trans	-64.6	-17	-172.1	0	0	0	0	0	114.9	I453 V507 W508 K516	I453-A505 HydrophobicContact CD1-CB 3.93Å; A505-V507 HydrophobicContact CB-CG2 4.15Å; A505-V507 PolarHBondContact O-N 3.1Å; A505-W508 HydrophobicContact CB-CZ2 4.44Å; A505-K516 HydrophobicContact CB-CD 4.44Å
506	G	86.1	Confident	89.1	Confident	30 Å²	30	55.9 Å²	55.9	31%	0.309	31%	0.309	S	S	.	.	S	Bend	trans	70.5	-14.9	174.7	0	0	0	0	0	116.4	S504 R593	S504-G506 PolarHBondContact O-N 2.94Å; S504-G506 VanDerWaalsContact O-N 3.1Å; G506-R593 PolarHBondContact O-NH1 2.88Å
507	V	88.2	Confident	89.1	Confident	32 Å²	32	50.3 Å²	50.3	19%	0.194	29%	0.288	C	S	.	.			trans	-87.1	-14.9	-178.4	-61.5	0	0	0	0	114.5	R447 Y451 I453 A505	R447-V507 WeakPolarHBondContact CD-O 3.15Å; R447-V507 PolarHBondContact NH1-O 2.81Å; Y451-V507 HydrophobicContact CD2-CB 4.37Å; Y451-V507 HydrophobicContact CD2-CG1 4.19Å; Y451-V507 HydrophobicContact CD2-CG2 4.3Å; Y451-V507 HydrophobicContact CE2-CB 4.26Å; Y451-V507 HydrophobicContact CE2-CG1 3.91Å; I453-V507 HydrophobicContact CD1-CG2 4.16Å; A505-V507 HydrophobicContact CB-CG2 4.15Å; A505-V507 PolarHBondContact O-N 3.1Å
508	W	90.8	Very high	89.2	Confident	10 Å²	10	52.2 Å²	52.2	4%	0.038	30%	0.296	C	S	.	.	S	Bend	trans	-68.2	151.6	-175.1	-54.1	123.9	0	0	0	112.7	D444 I453 W454 C455 A505 Q510 W513	D444-W508 HydrophobicContact CB-CE3 4.26Å; D444-W508 WeakPolarHBondContact OD1-CA 3.46Å; I453-W508 HydrophobicContact CD1-CH2 4.24Å; I453-W508 HydrophobicContact CD1-CZ2 4.06Å; I453-W508 HydrophobicContact CG1-CH2 4.02Å; I453-W508 HydrophobicContact CG1-CZ2 4.24Å; W454-W508 HydrophobicContact CE3-CH2 4.18Å; W454-W508 HydrophobicContact CE3-CZ3 4.15Å; W454-W508 HydrophobicContact CZ3-CZ3 4.24Å; C455-W508 HydrophobicContact CB-CZ2 3.85Å; A505-W508 HydrophobicContact CB-CZ2 4.44Å; W508-Q510 PolarHBondContact O-N 3.17Å; W508-W513 HydrophobicContact CG-CB 4.34Å
509	A	84.8	Confident	89.2	Confident	43 Å²	43	49.7 Å²	49.7	36%	0.355	28%	0.28	S	S	.	.	S	Bend	trans	-64.9	-9.6	178.4	0	0	0	0	0	113.7	D443 D444	D443-A509 HydrophobicContact CB-CB 4.27Å; D444-A509 WeakPolarHBondContact OD1-CB 3.5Å; D444-A509 PolarHBondContact OD1-N 2.94Å
510	Q	83.3	Confident	89.2	Confident	93 Å²	93	51.3 Å²	51.3	44%	0.435	29%	0.289	S	S	.	.	S	Bend	trans	-140.5	119.6	170.7	-61.7	-175.9	0.9	0	0	110	W508 K512 W513	W508-Q510 PolarHBondContact O-N 3.17Å; Q510-K512 HydrophobicContact CB-CD 4.3Å; Q510-K512 HydrophobicContact CB-CG 4.17Å; Q510-K512 PolarHBondContact O-N 3.43Å; Q510-W513 PolarHBondContact O-N 2.85Å
511	D	79.1	Confident	89.4	Confident	90 Å²	90	48 Å²	48	48%	0.481	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-2.1	-176.6	-63.3	-58.2	0	0	0	114.8	W513 K514 R593	D511-W513 VanDerWaalsContact C-N 3.32Å; D511-W513 PolarHBondContact O-N 3.03Å; D511-K514 PolarHBondContact O-NZ 2.98Å; D511-R593 IonicContact OD1-CZ 2.64Å; D511-R593 IonicContact OD1-NH1 3.2Å; D511-R593 IonicContact OD1-NH2 2.81Å; D511-R593 PolarHBondContact OD1-NH2 3.21Å; D511-R593 IonicContact OD2-NH2 3.21Å; D511-R593 PolarHBondContact OD2-NH2 3.23Å
512	K	82.8	Confident	89.6	Confident	120 Å²	120	45 Å²	45	52%	0.522	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-26.6	176.8	77.8	-172.5	-171.8	-166	0	113.7	Q510	Q510-K512 HydrophobicContact CB-CD 4.3Å; Q510-K512 HydrophobicContact CB-CG 4.17Å; Q510-K512 PolarHBondContact O-N 3.43Å
513	W	80.9	Confident	90.1	Very high	40 Å²	40	41.8 Å²	41.8	15%	0.152	23%	0.227	C	C	.	.			trans	-70.7	135.6	-175.2	-56.6	123.5	0	0	0	110.5	Y440 T457 W508 Q510 D511	Y440-W513 HydrophobicContact CD2-CH2 4.45Å; Y440-W513 HydrophobicContact CD2-CZ2 4.18Å; Y440-W513 HydrophobicContact CE2-CH2 4.4Å; T457-W513 HydrophobicContact CG2-CH2 4.39Å; T457-W513 HydrophobicContact CG2-CZ3 3.96Å; W508-W513 HydrophobicContact CG-CB 4.34Å; Q510-W513 PolarHBondContact O-N 2.85Å; D511-W513 VanDerWaalsContact C-N 3.32Å; D511-W513 PolarHBondContact O-N 3.03Å
514	K	87.1	Confident	90.6	Very high	100 Å²	100	39.4 Å²	39.4	44%	0.435	21%	0.212	S	C	.	.			trans	-135.6	133.4	-175.1	-66.7	-73.1	156.7	-82.9	0	109.4	C455 N461 S504 D511	C455-K514 PolarHBondContact SG-O 2.95Å; C455-K514 VanDerWaalsContact SG-O 3.36Å; N461-K514 PolarHBondContact ND2-O 3.27Å; N461-K514 VanDerWaalsContact ND2-O 3.13Å; S504-K514 PolarHBondContact OG-NZ 3.37Å; D511-K514 PolarHBondContact O-NZ 2.98Å
515	G	90.8	Very high	91.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	105.5	159.1	-167	0	0	0	0	0	112.8	C455 D500 T503	C455-G515 WeakPolarHBondContact CB-O 3.48Å; C455-G515 PolarHBondContact SG-O 3.34Å; D500-G515 CarbonylContact O-C 3.37Å; D500-G515 WeakPolarHBondContact O-CA 3.36Å; T503-G515 CarbonylContact O-C 3.39Å; T503-G515 VanDerWaalsContact O-C 3.3Å; T503-G515 VanDerWaalsContact O-CA 3.24Å; T503-G515 WeakPolarHBondContact O-CA 3.47Å; T503-G515 PolarHBondContact O-N 2.59Å
516	K	95.8	Very high	91.9	Very high	57 Å²	57	37.1 Å²	37.1	25%	0.248	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-148.3	142	173.9	-170.6	-173.3	79.7	86.7	0	109.1	I453 D500 T503 A505 D518	I453-K516 HydrophobicContact CB-CG 4.11Å; I453-K516 HydrophobicContact CD1-CD 4.19Å; I453-K516 HydrophobicContact CD1-CG 4.26Å; I453-K516 HydrophobicContact CG2-CD 3.97Å; I453-K516 HydrophobicContact CG2-CG 3.97Å; D500-K516 PolarHBondContact N-O 3.47Å; D500-K516 PolarHBondContact O-N 3.13Å; T503-K516 HydrophobicContact CG2-CB 4.02Å; T503-K516 HydrophobicContact CG2-CD 4.09Å; A505-K516 HydrophobicContact CB-CD 4.44Å; K516-D518 IonicContact NZ-OD1 2.77Å; K516-D518 PolarHBondContact NZ-OD1 3.02Å
517	F	97.8	Very high	92.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	156	160.4	61	-90.3	0	0	0	110	I453 W454 L464 L479 M495 S497 V499 V519	I453-F517 CarbonylContact C-O 3.3Å; I453-F517 VanDerWaalsContact CA-O 3.26Å; I453-F517 WeakPolarHBondContact CA-O 3.49Å; W454-F517 HydrophobicContact CB-CD2 4.44Å; W454-F517 HydrophobicContact CB-CE1 4.22Å; W454-F517 HydrophobicContact CB-CE2 3.86Å; W454-F517 HydrophobicContact CB-CZ 3.76Å; W454-F517 AromaticContact CD1-CE1 3.97Å; W454-F517 AromaticContact CD1-CZ 3.59Å; W454-F517 HydrophobicContact CG-CZ 4.07Å; W454-F517 PolarHBondContact N-O 2.86Å; W454-F517 PolarHBondContact O-N 2.82Å; L464-F517 HydrophobicContact CD1-CE1 4.01Å; L464-F517 HydrophobicContact CD1-CZ 3.64Å; L479-F517 HydrophobicContact CD1-CE2 3.69Å; L479-F517 HydrophobicContact CD1-CZ 4.08Å; M495-F517 HydrophobicContact CE-CB 4.22Å; M495-F517 HydrophobicContact CE-CD1 4.47Å; M495-F517 HydrophobicContact CE-CD2 3.9Å; M495-F517 HydrophobicContact CE-CE2 4.28Å; M495-F517 HydrophobicContact CE-CG 3.97Å; M495-F517 HydrophobicContact CG-CD2 3.74Å; M495-F517 HydrophobicContact CG-CE2 3.93Å; M495-F517 HydrophobicContact SD-CD2 4.1Å; M495-F517 HydrophobicContact SD-CE2 4.01Å; S497-F517 WeakPolarHBondContact OG-CA 3.28Å; S497-F517 WeakPolarHBondContact OG-CB 3.33Å; V499-F517 HydrophobicContact CG2-CB 4.07Å; V499-F517 HydrophobicContact CG2-CD1 3.68Å; V499-F517 HydrophobicContact CG2-CE1 4.38Å; V499-F517 HydrophobicContact CG2-CG 4.12Å; F517-V519 HydrophobicContact CD2-CG1 3.65Å; F517-V519 HydrophobicContact CE2-CG1 3.44Å; F517-V519 VanDerWaalsContact CE2-CG1 3.44Å
518	D	98.1	Very high	93	Very high	59 Å²	59	36.1 Å²	36.1	32%	0.316	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	140.9	-174.4	-51.5	-28.6	0	0	0	109.9	S452 I453 R496 S497 K516	S452-D518 CarbonylContact O-C 3.54Å; S452-D518 WeakPolarHBondContact O-CA 3.13Å; I453-D518 WeakPolarHBondContact CG2-OD1 3.23Å; R496-D518 HydrophobicContact CB-CB 4.4Å; R496-D518 PolarHBondContact N-O 2.71Å; S497-D518 PolarHBondContact N-O 3.18Å; S497-D518 PolarHBondContact OG-N 3.44Å; K516-D518 IonicContact NZ-OD1 2.77Å; K516-D518 PolarHBondContact NZ-OD1 3.02Å
519	V	98.4	Very high	93.4	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.8	-178.1	-58.1	0	0	0	0	111.6	S452 W454 L479 A493 E494 F517	S452-V519 CarbonylContact C-O 3.56Å; S452-V519 WeakPolarHBondContact CA-O 3.36Å; S452-V519 VanDerWaalsContact CB-O 3.28Å; S452-V519 WeakPolarHBondContact CB-O 3.46Å; S452-V519 PolarHBondContact O-N 3.29Å; W454-V519 HydrophobicContact CB-CG1 3.91Å; W454-V519 HydrophobicContact CB-CG2 4.44Å; L479-V519 HydrophobicContact CD1-CG1 4.02Å; A493-V519 HydrophobicContact CB-CB 4.07Å; A493-V519 HydrophobicContact CB-CG2 4.36Å; E494-V519 CarbonylContact O-C 3.49Å; E494-V519 VanDerWaalsContact O-CA 3.25Å; E494-V519 WeakPolarHBondContact O-CA 3.24Å; F517-V519 HydrophobicContact CD2-CG1 3.65Å; F517-V519 HydrophobicContact CE2-CG1 3.44Å; F517-V519 VanDerWaalsContact CE2-CG1 3.44Å
520	D	97.9	Very high	94.1	Very high	40 Å²	40	38.3 Å²	38.3	21%	0.214	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	113.4	178.7	175.5	19.1	0	0	0	109.8	H418 A493 E494 R496 L522	H418-D520 IonicContact CD2-OD1 3.33Å; A493-D520 CarbonylContact C-O 3.58Å; A493-D520 WeakPolarHBondContact CA-O 3.46Å; A493-D520 WeakPolarHBondContact CB-O 3.43Å; E494-D520 PolarHBondContact N-O 2.81Å; E494-D520 PolarHBondContact O-N 2.88Å; R496-D520 HydrophobicContact CG-CB 3.63Å; R496-D520 IonicContact CZ-OD2 3.31Å; R496-D520 VanDerWaalsContact NE-CB 3.35Å; R496-D520 IonicContact NE-OD2 3.86Å; R496-D520 PolarHBondContact NE-OD2 2.88Å; R496-D520 IonicContact NH2-OD2 2.72Å; R496-D520 PolarHBondContact NH2-OD2 3.15Å; D520-L522 PolarHBondContact O-N 2.9Å
521	W	98.4	Very high	94.8	Very high	3 Å²	3	37.7 Å²	37.7	1%	0.011	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	110.4	-171.9	-81.5	85.6	0	0	0	111.4	Y420 I445 S448 I449 F481 A493 V524	Y420-W521 HydrophobicContact CD1-CB 4.46Å; Y420-W521 WeakPolarHBondContact CD1-O 3.31Å; Y420-W521 HydrophobicContact CE1-CB 3.87Å; Y420-W521 VanDerWaalsContact CE1-O 3.29Å; Y420-W521 WeakPolarHBondContact CE1-O 3.22Å; I445-W521 HydrophobicContact CD1-CH2 4.47Å; I445-W521 HydrophobicContact CG2-CH2 3.83Å; I445-W521 HydrophobicContact CG2-CZ2 4.35Å; S448-W521 PolarHBondContact O-NE1 2.93Å; S448-W521 PolarHBondContact OG-NE1 3.33Å; I449-W521 HydrophobicContact CD1-CD2 4.46Å; I449-W521 HydrophobicContact CD1-CE3 4.4Å; I449-W521 HydrophobicContact CD1-CH2 4.5Å; I449-W521 HydrophobicContact CD1-CZ3 4.41Å; I449-W521 HydrophobicContact CG1-CD2 3.54Å; I449-W521 HydrophobicContact CG1-CE3 3.95Å; I449-W521 HydrophobicContact CG1-CG 3.9Å; I449-W521 HydrophobicContact CG1-CH2 4.26Å; I449-W521 HydrophobicContact CG1-CZ2 3.9Å; I449-W521 HydrophobicContact CG1-CZ3 4.28Å; F481-W521 HydrophobicContact CB-CH2 3.8Å; F481-W521 HydrophobicContact CB-CZ3 4.2Å; F481-W521 AromaticContact CD1-CH2 3.69Å; F481-W521 HydrophobicContact CD1-CH2 3.69Å; F481-W521 AromaticContact CD1-CZ2 3.98Å; F481-W521 HydrophobicContact CD1-CZ2 3.98Å; F481-W521 AromaticContact CD2-CH2 3.49Å; F481-W521 HydrophobicContact CD2-CH2 3.49Å; F481-W521 VanDerWaalsContact CD2-CH2 3.49Å; F481-W521 AromaticContact CD2-CZ2 3.96Å; F481-W521 HydrophobicContact CD2-CZ2 3.96Å; F481-W521 AromaticContact CD2-CZ3 3.88Å; F481-W521 HydrophobicContact CD2-CZ3 3.88Å; F481-W521 HydrophobicContact CE1-CH2 4.06Å; F481-W521 AromaticContact CE1-CZ2 3.86Å; F481-W521 HydrophobicContact CE1-CZ2 3.86Å; F481-W521 AromaticContact CE2-CH2 3.91Å; F481-W521 HydrophobicContact CE2-CH2 3.91Å; F481-W521 AromaticContact CE2-CZ2 3.87Å; F481-W521 HydrophobicContact CE2-CZ2 3.87Å; F481-W521 HydrophobicContact CE2-CZ3 4.45Å; F481-W521 AromaticContact CG-CH2 3.37Å; F481-W521 HydrophobicContact CG-CH2 3.37Å; F481-W521 HydrophobicContact CG-CZ2 4.01Å; F481-W521 HydrophobicContact CG-CZ3 4.04Å; F481-W521 HydrophobicContact CZ-CH2 4.17Å; F481-W521 AromaticContact CZ-CZ2 3.82Å; F481-W521 HydrophobicContact CZ-CZ2 3.82Å; A493-W521 HydrophobicContact CB-CB 4.49Å; A493-W521 HydrophobicContact CB-CD2 3.93Å; A493-W521 HydrophobicContact CB-CE3 4.4Å; A493-W521 HydrophobicContact CB-CG 3.95Å; W521-V524 HydrophobicContact CB-CG2 4.15Å; W521-V524 HydrophobicContact CE3-CG2 3.95Å
522	L	97.8	Very high	95.7	Very high	24 Å²	24	33.4 Å²	33.4	13%	0.126	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-41.8	-176.4	-59.2	178.7	0	0	0	112.2	N421 P422 F425 Y478 V492 E494 D520	N421-L522 PolarHBondContact N-O 3Å; P422-L522 WeakPolarHBondContact CD-O 3.21Å; F425-L522 HydrophobicContact CE2-CD1 4.02Å; Y478-L522 HydrophobicContact CD1-CD1 4.11Å; Y478-L522 HydrophobicContact CE1-CD1 3.46Å; Y478-L522 VanDerWaalsContact CE1-CD1 3.46Å; V492-L522 PolarHBondContact O-N 2.8Å; E494-L522 HydrophobicContact CB-CD1 4.28Å; D520-L522 PolarHBondContact O-N 2.9Å
523	F	98.4	Very high	96.4	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.009	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.8	175.6	-69.7	-81.1	0	0	0	110	N421 P422 F425 G491 V492 K525 I566 A567	N421-F523 HydrophobicContact CB-CD1 4.21Å; N421-F523 WeakPolarHBondContact OD1-CA 3.23Å; N421-F523 WeakPolarHBondContact OD1-CD1 3.31Å; P422-F523 HydrophobicContact CG-CZ 4.28Å; F425-F523 HydrophobicContact CB-CE2 4.18Å; F425-F523 HydrophobicContact CB-CZ 3.74Å; F425-F523 AromaticContact CD1-CE2 3.67Å; F425-F523 HydrophobicContact CD1-CE2 3.67Å; F425-F523 AromaticContact CD1-CZ 3.89Å; F425-F523 HydrophobicContact CD1-CZ 3.89Å; F425-F523 AromaticContact CD2-CE2 3.81Å; F425-F523 HydrophobicContact CD2-CE2 3.81Å; F425-F523 HydrophobicContact CD2-CZ 4.23Å; F425-F523 AromaticContact CE1-CE2 3.93Å; F425-F523 HydrophobicContact CE1-CE2 3.93Å; F425-F523 HydrophobicContact CE2-CE2 4.08Å; F425-F523 AromaticContact CG-CE2 3.6Å; F425-F523 HydrophobicContact CG-CE2 3.6Å; F425-F523 AromaticContact CG-CZ 3.68Å; F425-F523 HydrophobicContact CG-CZ 3.68Å; F425-F523 HydrophobicContact CZ-CE2 4.13Å; G491-F523 CarbonylContact C-O 3.44Å; G491-F523 WeakPolarHBondContact CA-O 3.37Å; V492-F523 HydrophobicContact CB-CB 4.14Å; V492-F523 HydrophobicContact CB-CD2 4.14Å; V492-F523 HydrophobicContact CG2-CB 4.25Å; V492-F523 HydrophobicContact CG2-CD2 4.3Å; V492-F523 PolarHBondContact N-O 2.93Å; V492-F523 PolarHBondContact O-N 3Å; F523-K525 HydrophobicContact CD1-CD 4.48Å; F523-I566 HydrophobicContact CB-CG2 4.33Å; F523-I566 HydrophobicContact CD2-CG2 4.48Å; F523-I566 HydrophobicContact CG-CG2 4.24Å; F523-A567 HydrophobicContact CE1-CB 4.26Å; F523-A567 HydrophobicContact CE2-CB 4.45Å; F523-A567 HydrophobicContact CZ-CB 3.77Å
524	V	98.3	Very high	97.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	87.5	176.8	-172.9	0	0	0	0	106.8	Y420 N421 I449 W521 S574 I575 F576	Y420-V524 HydrophobicContact CD1-CG2 3.78Å; Y420-V524 HydrophobicContact CE1-CG2 4.04Å; Y420-V524 HydrophobicContact CG-CG2 4.44Å; N421-V524 PolarHBondContact ND2-O 3.43Å; N421-V524 VanDerWaalsContact ND2-O 3.1Å; N421-V524 PolarHBondContact OD1-N 3.3Å; I449-V524 HydrophobicContact CD1-CG1 3.77Å; I449-V524 HydrophobicContact CD1-CG2 4.38Å; W521-V524 HydrophobicContact CB-CG2 4.15Å; W521-V524 HydrophobicContact CE3-CG2 3.95Å; V524-S574 VanDerWaalsContact C-OG 3.3Å; V524-S574 PolarHBondContact O-OG 3.45Å; V524-I575 HydrophobicContact CG1-CG2 3.69Å; V524-F576 HydrophobicContact CB-CD2 4.22Å; V524-F576 HydrophobicContact CB-CE1 4.49Å; V524-F576 HydrophobicContact CB-CE2 3.61Å; V524-F576 HydrophobicContact CB-CZ 3.76Å; V524-F576 HydrophobicContact CG1-CD1 4.12Å; V524-F576 HydrophobicContact CG1-CD2 3.94Å; V524-F576 HydrophobicContact CG1-CE1 3.88Å; V524-F576 HydrophobicContact CG1-CE2 3.68Å; V524-F576 HydrophobicContact CG1-CG 4.17Å; V524-F576 HydrophobicContact CG1-CZ 3.65Å; V524-F576 HydrophobicContact CG2-CE2 4.18Å; V524-F576 HydrophobicContact CG2-CZ 3.89Å
525	K	97.8	Very high	97.8	Very high	10 Å²	10	34.8 Å²	34.8	4%	0.043	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	148.6	-173.2	60	176.8	-173.9	173.6	0	112.5	N421 C490 F523 I566 A567 Y569 H571	N421-K525 WeakPolarHBondContact OD1-CD 3.37Å; N421-K525 WeakPolarHBondContact OD1-CG 3.35Å; C490-K525 CarbonylContact C-O 3.57Å; C490-K525 CarbonylContact O-C 3.45Å; C490-K525 PolarHBondContact O-N 3.05Å; C490-K525 VanDerWaalsContact O-O 3.1Å; F523-K525 HydrophobicContact CD1-CD 4.48Å; K525-I566 WeakPolarHBondContact CE-O 3.42Å; K525-I566 PolarHBondContact NZ-O 3.42Å; K525-A567 PolarHBondContact NZ-O 2.86Å; K525-Y569 PolarHBondContact NZ-O 2.68Å; K525-H571 HydrophobicContact CB-CB 3.75Å; K525-H571 WeakPolarHBondContact CB-CD2 3.48Å; K525-H571 VanDerWaalsContact CB-CG 3.42Å; K525-H571 HydrophobicContact CD-CB 4.13Å; K525-H571 HydrophobicContact CG-CB 4.39Å
526	D	98.5	Very high	98.2	Very high	24 Å²	24	41.2 Å²	41.2	13%	0.128	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.2	-177.6	-56.2	-25.8	0	0	0	112.5	H488 F489 Y569 T573	H488-D526 IonicContact CD2-OD1 2.69Å; H488-D526 IonicContact NE2-OD1 3.03Å; F489-D526 CarbonylContact O-C 3.59Å; F489-D526 WeakPolarHBondContact O-CA 3.25Å; D526-Y569 WeakPolarHBondContact O-CD1 3.4Å; D526-Y569 WeakPolarHBondContact O-CE1 3.33Å; D526-T573 PolarHBondContact N-O 3.11Å; D526-T573 VanDerWaalsContact OD2-C 3.28Å; D526-T573 WeakPolarHBondContact OD2-CB 3.43Å; D526-T573 PolarHBondContact OD2-OG1 3.37Å
527	V	98.7	Very high	98.3	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	105.1	176.9	-174.6	0	0	0	0	108.6	H488 F489 Q531 L532 I565 I566 Y569	H488-V527 WeakPolarHBondContact CA-O 3.38Å; H488-V527 WeakPolarHBondContact CB-O 3.38Å; F489-V527 PolarHBondContact N-O 3.42Å; F489-V527 PolarHBondContact O-N 3.5Å; V527-Q531 HydrophobicContact CG1-CB 4.42Å; V527-L532 HydrophobicContact CG1-CD1 4.12Å; V527-L532 HydrophobicContact CG1-CG 4.39Å; V527-I565 HydrophobicContact CG1-CG2 4.41Å; V527-I566 HydrophobicContact CB-CG1 4.49Å; V527-I566 HydrophobicContact CG1-CG1 4.39Å; V527-I566 HydrophobicContact CG2-CB 4.43Å; V527-I566 HydrophobicContact CG2-CG1 4.19Å; V527-I566 HydrophobicContact CG2-CG2 4.25Å; V527-Y569 HydrophobicContact CB-CD1 4.34Å; V527-Y569 HydrophobicContact CG1-CD1 4.32Å; V527-Y569 HydrophobicContact CG1-CG 4.18Å; V527-Y569 HydrophobicContact CG2-CD1 3.92Å; V527-Y569 HydrophobicContact CG2-CG 4.3Å
528	P	98.6	Very high	98.3	Very high	40 Å²	40	43 Å²	43	26%	0.26	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	142.1	-175.4	-27.2	35.9	0	0	0	113.8	S530 Q531 Y569	P528-S530 PolarHBondContact O-N 3.37Å; P528-Q531 WeakPolarHBondContact O-CB 3.42Å; P528-Q531 PolarHBondContact O-N 2.89Å; P528-Y569 WeakPolarHBondContact CD-OH 3.47Å
529	N	98.6	Very high	98.2	Very high	35 Å²	35	43.8 Å²	43.8	19%	0.187	21%	0.208	C	C	.	.	H	α-helix	trans	-58.4	-22.7	179.7	-76.8	-4	0	0	0	113.3	G487 H488 Q531 L532 R533 T546	G487-N529 VanDerWaalsContact C-CG 3.44Å; G487-N529 VanDerWaalsContact O-CB 3.22Å; G487-N529 WeakPolarHBondContact O-CB 3.34Å; G487-N529 PolarHBondContact O-N 2.95Å; H488-N529 WeakPolarHBondContact CA-OD1 3.15Å; N529-Q531 PolarHBondContact O-N 2.73Å; N529-L532 PolarHBondContact O-N 3Å; N529-L532 VanDerWaalsContact O-N 3.14Å; N529-R533 VanDerWaalsContact O-CB 3.27Å; N529-R533 WeakPolarHBondContact O-CB 3.29Å; N529-R533 WeakPolarHBondContact O-CG 3.25Å; N529-R533 PolarHBondContact O-N 3.35Å; N529-T546 HydrophobicContact CB-CG2 3.63Å
530	S	98.4	Very high	98.2	Very high	63 Å²	63	44.8 Å²	44.8	44%	0.441	21%	0.214	S	C	.	.	H	α-helix	trans	-57.9	-30.8	172.5	52.3	0	0	0	0	113.5	P528	P528-S530 PolarHBondContact O-N 3.37Å
531	Q	98.5	Very high	98.2	Very high	81 Å²	81	48.7 Å²	48.7	38%	0.379	23%	0.234	S	C	.	.	H	α-helix	trans	-76.6	-28.6	177.5	-55.1	-59.7	-20.3	0	0	112.6	V527 P528 N529 H534 I565 Y569	V527-Q531 HydrophobicContact CG1-CB 4.42Å; P528-Q531 WeakPolarHBondContact O-CB 3.42Å; P528-Q531 PolarHBondContact O-N 2.89Å; N529-Q531 PolarHBondContact O-N 2.73Å; Q531-H534 PolarHBondContact O-CE1 3.43Å; Q531-H534 PolarHBondContact O-ND1 2.81Å; Q531-H534 VanDerWaalsContact O-ND1 3.08Å; Q531-I565 HydrophobicContact CB-CG2 4.08Å; Q531-Y569 HydrophobicContact CG-CD2 4.16Å; Q531-Y569 HydrophobicContact CG-CE2 3.86Å
532	L	98.4	Very high	98.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-107	-22.6	-170.5	-66.9	171.7	0	0	0	114.1	F489 V527 N529 H534 I535 V545 T546 V562 I565 I566	F489-L532 HydrophobicContact CB-CD1 4.44Å; F489-L532 HydrophobicContact CD2-CD1 3.48Å; F489-L532 VanDerWaalsContact CD2-CD1 3.48Å; F489-L532 HydrophobicContact CE2-CD1 3.93Å; F489-L532 HydrophobicContact CG-CD1 4.06Å; V527-L532 HydrophobicContact CG1-CD1 4.12Å; V527-L532 HydrophobicContact CG1-CG 4.39Å; N529-L532 PolarHBondContact O-N 3Å; N529-L532 VanDerWaalsContact O-N 3.14Å; L532-H534 PolarHBondContact O-N 3.27Å; L532-I535 HydrophobicContact CD2-CD1 4.4Å; L532-I535 PolarHBondContact O-N 2.89Å; L532-V545 HydrophobicContact CB-CG1 4.15Å; L532-V545 WeakPolarHBondContact O-CG1 3.39Å; L532-T546 HydrophobicContact CB-CG2 3.85Å; L532-V562 HydrophobicContact CD1-CG1 4.48Å; L532-V562 HydrophobicContact CD2-CB 4.37Å; L532-V562 HydrophobicContact CD2-CG1 3.98Å; L532-V562 HydrophobicContact CD2-CG2 4.4Å; L532-I565 HydrophobicContact CD2-CB 3.87Å; L532-I565 HydrophobicContact CD2-CD1 4Å; L532-I565 HydrophobicContact CD2-CG2 3.68Å; L532-I565 HydrophobicContact CG-CG2 4.36Å; L532-I566 HydrophobicContact CD1-CG1 4.48Å
533	R	97.8	Very high	98.2	Very high	162 Å²	162	55.9 Å²	55.9	61%	0.611	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.5	-175	65.2	-179.9	178	171.8	4.2	116.3	N529 P544 T546	N529-R533 VanDerWaalsContact O-CB 3.27Å; N529-R533 WeakPolarHBondContact O-CB 3.29Å; N529-R533 WeakPolarHBondContact O-CG 3.25Å; N529-R533 PolarHBondContact O-N 3.35Å; R533-P544 WeakPolarHBondContact O-CB 3.16Å; R533-T546 HydrophobicContact CB-CG2 4.19Å
534	H	98.5	Very high	98.2	Very high	123 Å²	123	56.9 Å²	56.9	57%	0.569	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-23.5	176.1	68.6	-95.4	0	0	0	112.3	Q531 L532 R536	Q531-H534 PolarHBondContact O-CE1 3.43Å; Q531-H534 PolarHBondContact O-ND1 2.81Å; Q531-H534 VanDerWaalsContact O-ND1 3.08Å; L532-H534 PolarHBondContact O-N 3.27Å; H534-R536 PolarHBondContact O-N 3.43Å
535	I	98.5	Very high	98.2	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.015	28%	0.275	C	S	.	.			trans	-76.9	114.4	175.2	-57.4	174.7	0	0	0	108	L532 P544 V545 K558 Q561 V562 I565	L532-I535 HydrophobicContact CD2-CD1 4.4Å; L532-I535 PolarHBondContact O-N 2.89Å; I535-P544 CarbonylContact O-C 3.57Å; I535-P544 WeakPolarHBondContact O-CA 3.47Å; I535-V545 HydrophobicContact CB-CG1 4.02Å; I535-V545 HydrophobicContact CG2-CG1 4.41Å; I535-V545 PolarHBondContact O-N 3.36Å; I535-K558 HydrophobicContact CG2-CB 4Å; I535-K558 HydrophobicContact CG2-CD 4.18Å; I535-Q561 HydrophobicContact CD1-CB 3.6Å; I535-Q561 HydrophobicContact CG1-CB 4.37Å; I535-V562 HydrophobicContact CD1-CB 4.41Å; I535-V562 HydrophobicContact CD1-CG2 3.6Å; I535-V562 HydrophobicContact CG2-CG2 4.18Å; I535-I565 HydrophobicContact CD1-CD1 3.79Å
536	R	98.5	Very high	98.2	Very high	136 Å²	136	57.4 Å²	57.4	51%	0.513	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	147.7	176.7	-69	176.3	176.5	-91.3	5.4	111	H534 N542 K543 K558	H534-R536 PolarHBondContact O-N 3.43Å; R536-N542 WeakPolarHBondContact CB-O 3.33Å; R536-N542 VanDerWaalsContact CD-O 3.3Å; R536-N542 WeakPolarHBondContact CD-O 3.45Å; R536-N542 VanDerWaalsContact CG-O 3.31Å; R536-N542 WeakPolarHBondContact CG-O 3.44Å; R536-N542 PolarHBondContact NH1-O 3.04Å; R536-K543 WeakPolarHBondContact CA-O 3.34Å; R536-K558 WeakPolarHBondContact O-CD 3.28Å; R536-K558 WeakPolarHBondContact O-CE 3.36Å
537	L	98.4	Very high	98.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.3	-178.7	-57.4	-172	0	0	0	111.1	N539 N540 N542 K543 V545 S548 Q552 V554 K558	L537-N539 PolarHBondContact O-N 3.22Å; L537-N540 HydrophobicContact CB-CB 4.04Å; L537-N540 CarbonylContact O-C 3.48Å; L537-N540 PolarHBondContact O-N 3.47Å; L537-N540 VanDerWaalsContact O-N 3.07Å; L537-N542 VanDerWaalsContact O-CA 3.23Å; L537-N542 WeakPolarHBondContact O-CA 3.17Å; L537-N542 PolarHBondContact O-N 3.11Å; L537-K543 PolarHBondContact N-O 2.95Å; L537-V545 HydrophobicContact CD1-CB 4.34Å; L537-V545 HydrophobicContact CD1-CG2 4.21Å; L537-V545 HydrophobicContact CD2-CB 4.1Å; L537-V545 HydrophobicContact CD2-CG2 4.23Å; L537-V545 HydrophobicContact CG-CB 4.14Å; L537-V545 HydrophobicContact CG-CG2 4.44Å; L537-S548 WeakPolarHBondContact CD1-OG 3.42Å; L537-Q552 HydrophobicContact CD1-CG 3.93Å; L537-V554 HydrophobicContact CD2-CG1 3.92Å; L537-K558 HydrophobicContact CD2-CB 4Å; L537-K558 HydrophobicContact CD2-CG 4.19Å
538	E	97.6	Very high	98.2	Very high	94 Å²	94	61.6 Å²	61.6	44%	0.439	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-31.5	177.5	54.1	-85.4	-161.9	0	0	112.8	N540 P555 K558	E538-N540 VanDerWaalsContact C-N 3.28Å; E538-N540 PolarHBondContact O-N 2.85Å; E538-P555 HydrophobicContact CG-CG 4.25Å; E538-P555 VanDerWaalsContact OE1-CB 3.29Å; E538-P555 WeakPolarHBondContact OE1-CB 3.25Å; E538-P555 WeakPolarHBondContact OE1-CG 3.42Å; E538-K558 WeakPolarHBondContact OE2-CE 3.35Å; E538-K558 IonicContact OE2-NZ 3.64Å
539	N	97.4	Very high	98.2	Very high	75 Å²	75	69.8 Å²	69.8	40%	0.401	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	15	176.9	71.4	-21.1	0	0	0	114.2	L537 E553 P555	L537-N539 PolarHBondContact O-N 3.22Å; N539-E553 PolarHBondContact ND2-O 3.2Å; N539-E553 PolarHBondContact OD1-O 3Å; N539-P555 HydrophobicContact CB-CG 4.4Å; N539-P555 WeakPolarHBondContact OD1-CD 3.45Å
540	N	97.5	Very high	98.2	Very high	24 Å²	24	70.1 Å²	70.1	13%	0.128	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.8	59.6	177.1	-179.8	21.4	0	0	0	109.4	L537 E538 N542 K543	L537-N540 HydrophobicContact CB-CB 4.04Å; L537-N540 CarbonylContact O-C 3.48Å; L537-N540 PolarHBondContact O-N 3.47Å; L537-N540 VanDerWaalsContact O-N 3.07Å; E538-N540 VanDerWaalsContact C-N 3.28Å; E538-N540 PolarHBondContact O-N 2.85Å; N540-N542 PolarHBondContact O-N 2.64Å; N540-K543 VanDerWaalsContact O-CB 3.23Å; N540-K543 WeakPolarHBondContact O-CB 3.15Å; N540-K543 WeakPolarHBondContact O-CD 3.48Å; N540-K543 WeakPolarHBondContact O-CG 3.41Å; N540-K543 PolarHBondContact O-N 3.41Å
541	D	97.6	Very high	98.1	Very high	121 Å²	121	67.4 Å²	67.4	65%	0.647	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	30	176.3	-45.6	-37.7	0	0	0	115.2	K543	D541-K543 HydrophobicContact CB-CD 4.11Å; D541-K543 HydrophobicContact CB-CG 4.27Å; D541-K543 PolarHBondContact O-N 3.36Å; D541-K543 VanDerWaalsContact O-N 3.1Å; D541-K543 WeakPolarHBondContact OD2-CE 3.5Å; D541-K543 IonicContact OD2-NZ 2.71Å; D541-K543 PolarHBondContact OD2-NZ 3.47Å
542	N	97.6	Very high	98.1	Very high	90 Å²	90	64.8 Å²	64.8	48%	0.481	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	24.9	-171.3	-70	-71.7	0	0	0	114.2	R536 L537 N540	R536-N542 WeakPolarHBondContact CB-O 3.33Å; R536-N542 VanDerWaalsContact CD-O 3.3Å; R536-N542 WeakPolarHBondContact CD-O 3.45Å; R536-N542 VanDerWaalsContact CG-O 3.31Å; R536-N542 WeakPolarHBondContact CG-O 3.44Å; R536-N542 PolarHBondContact NH1-O 3.04Å; L537-N542 VanDerWaalsContact O-CA 3.23Å; L537-N542 WeakPolarHBondContact O-CA 3.17Å; L537-N542 PolarHBondContact O-N 3.11Å; N540-N542 PolarHBondContact O-N 2.64Å
543	K	98.4	Very high	98.2	Very high	88 Å²	88	66.5 Å²	66.5	38%	0.383	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	151.5	173.4	-68.7	158.7	178.9	158.5	0	110.2	R536 L537 N540 D541	R536-K543 WeakPolarHBondContact CA-O 3.34Å; L537-K543 PolarHBondContact N-O 2.95Å; N540-K543 VanDerWaalsContact O-CB 3.23Å; N540-K543 WeakPolarHBondContact O-CB 3.15Å; N540-K543 WeakPolarHBondContact O-CD 3.48Å; N540-K543 WeakPolarHBondContact O-CG 3.41Å; N540-K543 PolarHBondContact O-N 3.41Å; D541-K543 HydrophobicContact CB-CD 4.11Å; D541-K543 HydrophobicContact CB-CG 4.27Å; D541-K543 PolarHBondContact O-N 3.36Å; D541-K543 VanDerWaalsContact O-N 3.1Å; D541-K543 WeakPolarHBondContact OD2-CE 3.5Å; D541-K543 IonicContact OD2-NZ 2.71Å; D541-K543 PolarHBondContact OD2-NZ 3.47Å
544	P	98.5	Very high	98.2	Very high	23 Å²	23	59 Å²	59	15%	0.149	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	144	170.2	-27.2	36.8	0	0	0	112.3	R533 I535 T546 N547	R533-P544 WeakPolarHBondContact O-CB 3.16Å; I535-P544 CarbonylContact O-C 3.57Å; I535-P544 WeakPolarHBondContact O-CA 3.47Å; P544-T546 WeakPolarHBondContact CB-OG1 3.39Å; P544-T546 PolarHBondContact O-N 2.94Å; P544-T546 VanDerWaalsContact O-N 3.11Å; P544-N547 WeakPolarHBondContact O-CB 3.28Å; P544-N547 PolarHBondContact O-N 3.3Å
545	V	98.6	Very high	98.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-55.9	-29.6	174.7	65	0	0	0	0	112.4	I436 L532 I535 L537 N547 S548 V554 V562	I436-V545 HydrophobicContact CD1-CG2 3.76Å; I436-V545 HydrophobicContact CG1-CG2 4.44Å; L532-V545 HydrophobicContact CB-CG1 4.15Å; L532-V545 WeakPolarHBondContact O-CG1 3.39Å; I535-V545 HydrophobicContact CB-CG1 4.02Å; I535-V545 HydrophobicContact CG2-CG1 4.41Å; I535-V545 PolarHBondContact O-N 3.36Å; L537-V545 HydrophobicContact CD1-CB 4.34Å; L537-V545 HydrophobicContact CD1-CG2 4.21Å; L537-V545 HydrophobicContact CD2-CB 4.1Å; L537-V545 HydrophobicContact CD2-CG2 4.23Å; L537-V545 HydrophobicContact CG-CB 4.14Å; L537-V545 HydrophobicContact CG-CG2 4.44Å; V545-N547 PolarHBondContact O-N 2.96Å; V545-S548 VanDerWaalsContact O-CB 3.25Å; V545-S548 WeakPolarHBondContact O-CB 3.26Å; V545-S548 PolarHBondContact O-N 3.07Å; V545-S548 PolarHBondContact O-OG 3.13Å; V545-V554 HydrophobicContact CG2-CG2 4.38Å; V545-V562 HydrophobicContact CG1-CG2 4.13Å; V545-V562 HydrophobicContact CG2-CG2 4.17Å
546	T	98.4	Very high	98.1	Very high	22 Å²	22	56.6 Å²	56.6	14%	0.135	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-66	-14.9	175	53.8	0	0	0	0	114.5	F489 N529 L532 R533 P544	F489-T546 HydrophobicContact CE2-CG2 4.33Å; N529-T546 HydrophobicContact CB-CG2 3.63Å; L532-T546 HydrophobicContact CB-CG2 3.85Å; R533-T546 HydrophobicContact CB-CG2 4.19Å; P544-T546 WeakPolarHBondContact CB-OG1 3.39Å; P544-T546 PolarHBondContact O-N 2.94Å; P544-T546 VanDerWaalsContact O-N 3.11Å
547	N	98.2	Very high	98.1	Very high	105 Å²	105	55 Å²	55	56%	0.561	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-106	13.8	-177.4	-64.8	48.6	0	0	0	111.9	P544 V545	P544-N547 WeakPolarHBondContact O-CB 3.28Å; P544-N547 PolarHBondContact O-N 3.3Å; V545-N547 PolarHBondContact O-N 2.96Å
548	S	98.3	Very high	98.1	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.063	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-71.9	149.8	179.5	-60.6	0	0	0	0	113	L537 V545	L537-S548 WeakPolarHBondContact CD1-OG 3.42Å; V545-S548 VanDerWaalsContact O-CB 3.25Å; V545-S548 WeakPolarHBondContact O-CB 3.26Å; V545-S548 PolarHBondContact O-N 3.07Å; V545-S548 PolarHBondContact O-OG 3.13Å
549	R	98	Very high	98.1	Very high	212 Å²	212	53.1 Å²	53.1	80%	0.8	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-86.7	171.7	170.6	-68.9	-176.2	172.7	-175.2	-2.2	111.3	Q552	R549-Q552 VanDerWaalsContact O-CB 3.26Å; R549-Q552 WeakPolarHBondContact O-CB 3.24Å; R549-Q552 PolarHBondContact O-N 3.06Å; R549-Q552 VanDerWaalsContact O-N 3.16Å
550	D	98.1	Very high	98.2	Very high	41 Å²	41	51 Å²	51	22%	0.219	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	136.3	175	-164.2	42.8	0	0	0	111.4	I437 K438 S456 Q552	I437-D550 WeakPolarHBondContact CA-OD1 3.28Å; K438-D550 HydrophobicContact CB-CB 4Å; K438-D550 PolarHBondContact N-OD1 2.83Å; S456-D550 PolarHBondContact OG-OD2 2.85Å; D550-Q552 PolarHBondContact O-N 2.81Å
551	T	98.3	Very high	98.2	Very high	6 Å²	6	54 Å²	54	4%	0.037	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	21.9	-173.7	70	0	0	0	0	115.7	I436 I437 G460 R463 L464 E553	I436-T551 WeakPolarHBondContact O-CA 3.32Å; I436-T551 PolarHBondContact O-N 3.28Å; I437-T551 HydrophobicContact CD1-CG2 4.17Å; G460-T551 VanDerWaalsContact CA-CG2 3.47Å; R463-T551 WeakPolarHBondContact CD-O 3.31Å; L464-T551 HydrophobicContact CD1-CG2 3.88Å; L464-T551 HydrophobicContact CD2-CG2 4.29Å; L464-T551 HydrophobicContact CG-CG2 3.92Å; T551-E553 PolarHBondContact O-N 2.82Å
552	Q	98.6	Very high	98.2	Very high	27 Å²	27	48.2 Å²	48.2	13%	0.126	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	127.6	164.9	174.9	61.3	51.7	0	0	109.5	F435 I436 L537 R549 D550	F435-Q552 CarbonylContact C-O 3.6Å; F435-Q552 VanDerWaalsContact CA-O 3.31Å; F435-Q552 WeakPolarHBondContact CA-O 3.04Å; I436-Q552 HydrophobicContact CB-CB 4.32Å; I436-Q552 HydrophobicContact CG1-CB 4.26Å; I436-Q552 PolarHBondContact N-O 3.48Å; L537-Q552 HydrophobicContact CD1-CG 3.93Å; R549-Q552 VanDerWaalsContact O-CB 3.26Å; R549-Q552 WeakPolarHBondContact O-CB 3.24Å; R549-Q552 PolarHBondContact O-N 3.06Å; R549-Q552 VanDerWaalsContact O-N 3.16Å; D550-Q552 PolarHBondContact O-N 2.81Å
553	E	98.6	Very high	98.3	Very high	35 Å²	35	44 Å²	44	16%	0.164	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	135.1	177.4	-171.2	157.2	-168.3	0	0	111	R433 F435 R463 N539 T551	R433-E553 IonicContact CZ-OE1 2.88Å; R433-E553 IonicContact NE-OE1 3.42Å; R433-E553 PolarHBondContact NE-OE1 2.98Å; R433-E553 VanDerWaalsContact NH2-CD 3.25Å; R433-E553 IonicContact NH2-OE1 3.54Å; R433-E553 PolarHBondContact NH2-OE1 2.6Å; R433-E553 IonicContact NH2-OE2 3.65Å; R433-E553 PolarHBondContact NH2-OE2 2.86Å; F435-E553 HydrophobicContact CD1-CB 3.83Å; F435-E553 HydrophobicContact CD1-CG 4.14Å; F435-E553 HydrophobicContact CE1-CB 3.61Å; F435-E553 HydrophobicContact CE1-CG 3.63Å; F435-E553 HydrophobicContact CZ-CG 4.06Å; R463-E553 IonicContact CZ-OE2 2.6Å; R463-E553 IonicContact NE-OE2 3.29Å; R463-E553 VanDerWaalsContact NH2-CB 3.33Å; R463-E553 IonicContact NH2-OE2 2.99Å; R463-E553 PolarHBondContact NH2-OE2 3.35Å; N539-E553 PolarHBondContact ND2-O 3.2Å; N539-E553 PolarHBondContact OD1-O 3Å; T551-E553 PolarHBondContact O-N 2.82Å
554	V	98.7	Very high	98.3	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.03	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.2	179.5	-174.9	0	0	0	0	108.3	V434 I436 L480 L537 V545 K558 A559	V434-V554 HydrophobicContact CB-CB 4.38Å; V434-V554 HydrophobicContact CG1-CB 4.45Å; V434-V554 PolarHBondContact O-N 3.06Å; I436-V554 HydrophobicContact CD1-CG2 3.52Å; I436-V554 HydrophobicContact CG1-CG2 3.81Å; L480-V554 HydrophobicContact CD1-CG2 4.46Å; L537-V554 HydrophobicContact CD2-CG1 3.92Å; V545-V554 HydrophobicContact CG2-CG2 4.38Å; V554-K558 HydrophobicContact CG1-CB 3.87Å; V554-A559 HydrophobicContact CB-CB 4.26Å; V554-A559 HydrophobicContact CG1-CB 3.8Å
555	P	98.1	Very high	98.3	Very high	28 Å²	28	44.9 Å²	44.9	18%	0.182	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-56.6	141.7	175.9	-26.1	36.7	0	0	0	111.5	E538 N539 E557 K558 A559	E538-P555 HydrophobicContact CG-CG 4.25Å; E538-P555 VanDerWaalsContact OE1-CB 3.29Å; E538-P555 WeakPolarHBondContact OE1-CB 3.25Å; E538-P555 WeakPolarHBondContact OE1-CG 3.42Å; N539-P555 HydrophobicContact CB-CG 4.4Å; N539-P555 WeakPolarHBondContact OD1-CD 3.45Å; P555-E557 VanDerWaalsContact C-N 3.3Å; P555-E557 PolarHBondContact O-N 3.08Å; P555-E557 VanDerWaalsContact O-N 3.13Å; P555-K558 HydrophobicContact CB-CG 4.37Å; P555-K558 CarbonylContact O-C 3.43Å; P555-K558 WeakPolarHBondContact O-CA 3.37Å; P555-K558 WeakPolarHBondContact O-CB 3.4Å; P555-K558 PolarHBondContact O-N 3.31Å; P555-A559 PolarHBondContact O-N 2.72Å
556	L	97.3	Very high	98.3	Very high	48 Å²	48	45 Å²	45	25%	0.251	21%	0.211	S	C	.	.	H	α-helix	trans	-54	-41.6	-165.3	-172.9	61.3	0	0	0	113.6	L429 K558 A559 K560	L429-L556 HydrophobicContact CB-CD1 3.85Å; L429-L556 HydrophobicContact CD1-CD1 4.35Å; L556-K558 VanDerWaalsContact C-N 3.34Å; L556-K558 PolarHBondContact O-N 3.22Å; L556-A559 WeakPolarHBondContact O-CB 3.36Å; L556-A559 PolarHBondContact O-N 2.72Å; L556-A559 VanDerWaalsContact O-N 3.15Å; L556-K560 WeakPolarHBondContact O-CG 3.26Å; L556-K560 PolarHBondContact O-N 2.98Å
557	E	97.8	Very high	98.2	Very high	102 Å²	102	45 Å²	45	48%	0.477	21%	0.213	S	C	.	.	H	α-helix	trans	-68.6	-29.3	178.5	-59.2	-46	120.8	0	0	113.8	P555 K560 Q561	P555-E557 VanDerWaalsContact C-N 3.3Å; P555-E557 PolarHBondContact O-N 3.08Å; P555-E557 VanDerWaalsContact O-N 3.13Å; E557-K560 IonicContact OE1-NZ 3.18Å; E557-K560 PolarHBondContact OE1-NZ 3.01Å; E557-K560 WeakPolarHBondContact OE2-CD 3.33Å; E557-K560 IonicContact OE2-NZ 3.35Å; E557-K560 PolarHBondContact OE2-NZ 3.29Å; E557-Q561 WeakPolarHBondContact O-CG 3.19Å; E557-Q561 PolarHBondContact O-NE2 2.9Å
558	K	98.4	Very high	98.2	Very high	55 Å²	55	44.5 Å²	44.5	24%	0.239	21%	0.214	C	C	.	.	H	α-helix	trans	-75.8	-37.7	169.8	-53.3	-56.3	-172.7	179	0	110.7	I535 R536 L537 E538 V554 P555 L556 Q561 V562	I535-K558 HydrophobicContact CG2-CB 4Å; I535-K558 HydrophobicContact CG2-CD 4.18Å; R536-K558 WeakPolarHBondContact O-CD 3.28Å; R536-K558 WeakPolarHBondContact O-CE 3.36Å; L537-K558 HydrophobicContact CD2-CB 4Å; L537-K558 HydrophobicContact CD2-CG 4.19Å; E538-K558 WeakPolarHBondContact OE2-CE 3.35Å; E538-K558 IonicContact OE2-NZ 3.64Å; V554-K558 HydrophobicContact CG1-CB 3.87Å; P555-K558 HydrophobicContact CB-CG 4.37Å; P555-K558 CarbonylContact O-C 3.43Å; P555-K558 WeakPolarHBondContact O-CA 3.37Å; P555-K558 WeakPolarHBondContact O-CB 3.4Å; P555-K558 PolarHBondContact O-N 3.31Å; L556-K558 VanDerWaalsContact C-N 3.34Å; L556-K558 PolarHBondContact O-N 3.22Å; K558-Q561 WeakPolarHBondContact O-CB 2.92Å; K558-Q561 PolarHBondContact O-N 3.33Å; K558-Q561 VanDerWaalsContact O-N 3.15Å; K558-V562 WeakPolarHBondContact O-CG2 3.42Å; K558-V562 PolarHBondContact O-N 3.41Å
559	A	98.3	Very high	98.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-43.9	179.7	0	0	0	0	0	111.6	V434 V554 P555 L556 Q561 V562 L563	V434-A559 HydrophobicContact CB-CB 3.72Å; V434-A559 HydrophobicContact CG1-CB 4.11Å; V434-A559 HydrophobicContact CG2-CB 3.66Å; V554-A559 HydrophobicContact CB-CB 4.26Å; V554-A559 HydrophobicContact CG1-CB 3.8Å; P555-A559 PolarHBondContact O-N 2.72Å; L556-A559 WeakPolarHBondContact O-CB 3.36Å; L556-A559 PolarHBondContact O-N 2.72Å; L556-A559 VanDerWaalsContact O-N 3.15Å; A559-Q561 VanDerWaalsContact C-N 3.27Å; A559-Q561 PolarHBondContact O-N 2.6Å; A559-V562 PolarHBondContact O-N 3.05Å; A559-L563 WeakPolarHBondContact O-CB 3.5Å; A559-L563 VanDerWaalsContact O-CG 3.27Å; A559-L563 WeakPolarHBondContact O-CG 3.4Å; A559-L563 PolarHBondContact O-N 3.08Å
560	K	98.3	Very high	98.1	Very high	31 Å²	31	45.8 Å²	45.8	14%	0.135	22%	0.223	C	C	.	.	H	α-helix	trans	-52.7	-43.6	171.5	-70.9	170.2	-179.7	167.3	0	112.5	W427 L429 L556 E557 K564	W427-K560 WeakPolarHBondContact O-CA 3.29Å; L429-K560 WeakPolarHBondContact O-CE 3.38Å; L556-K560 WeakPolarHBondContact O-CG 3.26Å; L556-K560 PolarHBondContact O-N 2.98Å; E557-K560 IonicContact OE1-NZ 3.18Å; E557-K560 PolarHBondContact OE1-NZ 3.01Å; E557-K560 WeakPolarHBondContact OE2-CD 3.33Å; E557-K560 IonicContact OE2-NZ 3.35Å; E557-K560 PolarHBondContact OE2-NZ 3.29Å; K560-K564 VanDerWaalsContact O-CB 3.23Å; K560-K564 WeakPolarHBondContact O-CB 3.37Å; K560-K564 PolarHBondContact O-N 3.25Å
561	Q	98.4	Very high	98	Very high	85 Å²	85	47.4 Å²	47.4	40%	0.397	23%	0.229	S	C	.	.	H	α-helix	trans	-66.5	-45.1	179.5	-63.7	166.2	33.4	0	0	111.4	I535 E557 K558 A559 K564 I565	I535-Q561 HydrophobicContact CD1-CB 3.6Å; I535-Q561 HydrophobicContact CG1-CB 4.37Å; E557-Q561 WeakPolarHBondContact O-CG 3.19Å; E557-Q561 PolarHBondContact O-NE2 2.9Å; K558-Q561 WeakPolarHBondContact O-CB 2.92Å; K558-Q561 PolarHBondContact O-N 3.33Å; K558-Q561 VanDerWaalsContact O-N 3.15Å; A559-Q561 VanDerWaalsContact C-N 3.27Å; A559-Q561 PolarHBondContact O-N 2.6Å; Q561-K564 PolarHBondContact O-N 3.16Å; Q561-I565 WeakPolarHBondContact O-CG1 3.37Å; Q561-I565 PolarHBondContact O-N 3.19Å; Q561-I565 VanDerWaalsContact O-N 3.1Å
562	V	98.6	Very high	97.9	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-48.2	176.6	176.6	0	0	0	0	111.2	L480 L532 I535 V545 K558 A559 K564 I565 I566	L480-V562 HydrophobicContact CD1-CB 4.41Å; L480-V562 HydrophobicContact CD1-CG1 3.67Å; L532-V562 HydrophobicContact CD1-CG1 4.48Å; L532-V562 HydrophobicContact CD2-CB 4.37Å; L532-V562 HydrophobicContact CD2-CG1 3.98Å; L532-V562 HydrophobicContact CD2-CG2 4.4Å; I535-V562 HydrophobicContact CD1-CB 4.41Å; I535-V562 HydrophobicContact CD1-CG2 3.6Å; I535-V562 HydrophobicContact CG2-CG2 4.18Å; V545-V562 HydrophobicContact CG1-CG2 4.13Å; V545-V562 HydrophobicContact CG2-CG2 4.17Å; K558-V562 WeakPolarHBondContact O-CG2 3.42Å; K558-V562 PolarHBondContact O-N 3.41Å; A559-V562 PolarHBondContact O-N 3.05Å; V562-K564 PolarHBondContact O-N 2.85Å; V562-I565 PolarHBondContact O-N 3.4Å; V562-I566 HydrophobicContact CG1-CD1 3.71Å; V562-I566 HydrophobicContact CG1-CG1 4.36Å; V562-I566 WeakPolarHBondContact O-CG1 3.4Å; V562-I566 PolarHBondContact O-N 2.92Å
563	L	98.5	Very high	97.8	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-41.8	178.5	-73.1	169.6	0	0	0	111.9	F425 W427 L429 V434 Y478 L480 V492 A559 I566 A567	F425-L563 HydrophobicContact CE1-CB 4.3Å; F425-L563 HydrophobicContact CE1-CD2 4.19Å; F425-L563 HydrophobicContact CZ-CD2 4.29Å; W427-L563 HydrophobicContact CB-CB 3.89Å; L429-L563 HydrophobicContact CD1-CD1 3.64Å; L429-L563 HydrophobicContact CG-CD1 4.27Å; V434-L563 HydrophobicContact CG2-CD1 4.46Å; Y478-L563 HydrophobicContact CD2-CD1 3.95Å; Y478-L563 HydrophobicContact CD2-CD2 4.21Å; Y478-L563 HydrophobicContact CE2-CD1 4.37Å; L480-L563 HydrophobicContact CD2-CD2 3.91Å; V492-L563 HydrophobicContact CG1-CD2 4.31Å; A559-L563 WeakPolarHBondContact O-CB 3.5Å; A559-L563 VanDerWaalsContact O-CG 3.27Å; A559-L563 WeakPolarHBondContact O-CG 3.4Å; A559-L563 PolarHBondContact O-N 3.08Å; L563-I566 PolarHBondContact O-N 3.07Å; L563-A567 VanDerWaalsContact O-CB 3.26Å; L563-A567 WeakPolarHBondContact O-CB 3.48Å; L563-A567 PolarHBondContact O-N 2.92Å
564	K	98.2	Very high	97.7	Very high	97 Å²	97	53 Å²	53	42%	0.422	27%	0.268	S	S	.	.	H	α-helix	trans	-60.3	-46.1	175.3	-174.6	178.7	-174.6	175.3	0	112.1	W427 K560 Q561 V562 T568	W427-K564 HydrophobicContact CB-CB 4.27Å; W427-K564 HydrophobicContact CD2-CB 3.66Å; W427-K564 HydrophobicContact CD2-CD 4.07Å; W427-K564 HydrophobicContact CD2-CG 3.74Å; W427-K564 HydrophobicContact CE3-CB 3.75Å; W427-K564 HydrophobicContact CE3-CD 3.93Å; W427-K564 HydrophobicContact CE3-CG 4.02Å; W427-K564 HydrophobicContact CG-CB 3.87Å; W427-K564 HydrophobicContact CG-CG 4.19Å; W427-K564 HydrophobicContact CH2-CD 3.8Å; W427-K564 HydrophobicContact CH2-CG 4.49Å; W427-K564 HydrophobicContact CZ2-CD 3.9Å; W427-K564 HydrophobicContact CZ2-CG 4.22Å; W427-K564 HydrophobicContact CZ3-CB 4.46Å; W427-K564 HydrophobicContact CZ3-CD 3.8Å; W427-K564 HydrophobicContact CZ3-CG 4.39Å; K560-K564 VanDerWaalsContact O-CB 3.23Å; K560-K564 WeakPolarHBondContact O-CB 3.37Å; K560-K564 PolarHBondContact O-N 3.25Å; Q561-K564 PolarHBondContact O-N 3.16Å; V562-K564 PolarHBondContact O-N 2.85Å; K564-T568 WeakPolarHBondContact O-CB 3.33Å; K564-T568 WeakPolarHBondContact O-CG2 3.43Å; K564-T568 PolarHBondContact O-N 2.91Å; K564-T568 PolarHBondContact O-OG1 2.99Å
565	I	98.4	Very high	97.6	Very high	33 Å²	33	53.5 Å²	53.5	17%	0.169	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-48.1	177.7	-68.3	167.6	0	0	0	110	V527 Q531 L532 I535 Q561 V562 A567 T568 Y569	V527-I565 HydrophobicContact CG1-CG2 4.41Å; Q531-I565 HydrophobicContact CB-CG2 4.08Å; L532-I565 HydrophobicContact CD2-CB 3.87Å; L532-I565 HydrophobicContact CD2-CD1 4Å; L532-I565 HydrophobicContact CD2-CG2 3.68Å; L532-I565 HydrophobicContact CG-CG2 4.36Å; I535-I565 HydrophobicContact CD1-CD1 3.79Å; Q561-I565 WeakPolarHBondContact O-CG1 3.37Å; Q561-I565 PolarHBondContact O-N 3.19Å; Q561-I565 VanDerWaalsContact O-N 3.1Å; V562-I565 PolarHBondContact O-N 3.4Å; I565-A567 PolarHBondContact O-N 3.41Å; I565-T568 PolarHBondContact O-N 2.72Å; I565-T568 PolarHBondContact O-OG1 3.45Å; I565-Y569 VanDerWaalsContact O-CB 3.24Å; I565-Y569 WeakPolarHBondContact O-CB 3.22Å; I565-Y569 PolarHBondContact O-N 3.35Å
566	I	98.2	Very high	97.6	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-51.6	177.6	-68	170.9	0	0	0	110.5	L480 V492 F523 K525 V527 L532 V562 L563 T568 Y569	L480-I566 HydrophobicContact CD2-CD1 4.11Å; V492-I566 HydrophobicContact CG2-CD1 3.93Å; V492-I566 HydrophobicContact CG2-CG2 3.94Å; F523-I566 HydrophobicContact CB-CG2 4.33Å; F523-I566 HydrophobicContact CD2-CG2 4.48Å; F523-I566 HydrophobicContact CG-CG2 4.24Å; K525-I566 WeakPolarHBondContact CE-O 3.42Å; K525-I566 PolarHBondContact NZ-O 3.42Å; V527-I566 HydrophobicContact CB-CG1 4.49Å; V527-I566 HydrophobicContact CG1-CG1 4.39Å; V527-I566 HydrophobicContact CG2-CB 4.43Å; V527-I566 HydrophobicContact CG2-CG1 4.19Å; V527-I566 HydrophobicContact CG2-CG2 4.25Å; L532-I566 HydrophobicContact CD1-CG1 4.48Å; V562-I566 HydrophobicContact CG1-CD1 3.71Å; V562-I566 HydrophobicContact CG1-CG1 4.36Å; V562-I566 WeakPolarHBondContact O-CG1 3.4Å; V562-I566 PolarHBondContact O-N 2.92Å; L563-I566 PolarHBondContact O-N 3.07Å; I566-T568 PolarHBondContact O-N 2.86Å; I566-Y569 PolarHBondContact O-N 2.91Å
567	A	97.3	Very high	97.5	Very high	22 Å²	22	55.9 Å²	55.9	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-51.8	-178.9	0	0	0	0	0	111.7	F425 F523 K525 L563 I565 Y569	F425-A567 HydrophobicContact CD1-CB 4.13Å; F523-A567 HydrophobicContact CE1-CB 4.26Å; F523-A567 HydrophobicContact CE2-CB 4.45Å; F523-A567 HydrophobicContact CZ-CB 3.77Å; K525-A567 PolarHBondContact NZ-O 2.86Å; L563-A567 VanDerWaalsContact O-CB 3.26Å; L563-A567 WeakPolarHBondContact O-CB 3.48Å; L563-A567 PolarHBondContact O-N 2.92Å; I565-A567 PolarHBondContact O-N 3.41Å; A567-Y569 PolarHBondContact O-N 3.45Å
568	T	97.2	Very high	97.3	Very high	95 Å²	95	54.4 Å²	54.4	58%	0.583	28%	0.276	S	S	*	.	H	α-helix	trans	-75.6	-16.4	-177.3	58.4	0	0	0	0	115.2	K564 I565 I566 K570	K564-T568 WeakPolarHBondContact O-CB 3.33Å; K564-T568 WeakPolarHBondContact O-CG2 3.43Å; K564-T568 PolarHBondContact O-N 2.91Å; K564-T568 PolarHBondContact O-OG1 2.99Å; I565-T568 PolarHBondContact O-N 2.72Å; I565-T568 PolarHBondContact O-OG1 3.45Å; I566-T568 PolarHBondContact O-N 2.86Å; T568-K570 PolarHBondContact O-N 3.43Å
569	Y	97.9	Very high	97	Very high	57 Å²	57	51.9 Å²	51.9	22%	0.224	27%	0.266	C	S	.	.			trans	-65.7	123.6	-177.7	-172	-104.2	0	0	0	112.3	K525 D526 V527 P528 Q531 I565 I566 A567 H571	K525-Y569 PolarHBondContact NZ-O 2.68Å; D526-Y569 WeakPolarHBondContact O-CD1 3.4Å; D526-Y569 WeakPolarHBondContact O-CE1 3.33Å; V527-Y569 HydrophobicContact CB-CD1 4.34Å; V527-Y569 HydrophobicContact CG1-CD1 4.32Å; V527-Y569 HydrophobicContact CG1-CG 4.18Å; V527-Y569 HydrophobicContact CG2-CD1 3.92Å; V527-Y569 HydrophobicContact CG2-CG 4.3Å; P528-Y569 WeakPolarHBondContact CD-OH 3.47Å; Q531-Y569 HydrophobicContact CG-CD2 4.16Å; Q531-Y569 HydrophobicContact CG-CE2 3.86Å; I565-Y569 VanDerWaalsContact O-CB 3.24Å; I565-Y569 WeakPolarHBondContact O-CB 3.22Å; I565-Y569 PolarHBondContact O-N 3.35Å; I566-Y569 PolarHBondContact O-N 2.91Å; A567-Y569 PolarHBondContact O-N 3.45Å; Y569-H571 HydrophobicContact CD1-CB 4.18Å; Y569-H571 HydrophobicContact CE1-CB 4.3Å; Y569-H571 PolarHBondContact O-N 3.08Å; Y569-H571 VanDerWaalsContact O-N 3.09Å
570	K	96.9	Very high	96.8	Very high	191 Å²	191	54.5 Å²	54.5	83%	0.83	28%	0.284	S	S	*	.			trans	-79.8	83	173	-65.4	-177.5	-179.4	-179.7	0	109.4	T568	T568-K570 PolarHBondContact O-N 3.43Å
571	H	96.4	Very high	96.6	Very high	75 Å²	75	57.2 Å²	57.2	35%	0.347	30%	0.297	S	S	.	.			trans	-59.8	154	174.9	71.1	-64.8	0	0	0	113	K525 Y569 T573	K525-H571 HydrophobicContact CB-CB 3.75Å; K525-H571 WeakPolarHBondContact CB-CD2 3.48Å; K525-H571 VanDerWaalsContact CB-CG 3.42Å; K525-H571 HydrophobicContact CD-CB 4.13Å; K525-H571 HydrophobicContact CG-CB 4.39Å; Y569-H571 HydrophobicContact CD1-CB 4.18Å; Y569-H571 HydrophobicContact CE1-CB 4.3Å; Y569-H571 PolarHBondContact O-N 3.08Å; Y569-H571 VanDerWaalsContact O-N 3.09Å; H571-T573 PolarHBondContact CD2-O 3.24Å
572	T	95.7	Very high	96.4	Very high	125 Å²	125	53.7 Å²	53.7	77%	0.767	28%	0.28	S	S	*	.	S	Bend	trans	-121.6	-7.1	174.2	56.2	0	0	0	0	112.8
573	T	96.8	Very high	96.2	Very high	54 Å²	54	53.8 Å²	53.8	33%	0.331	28%	0.28	S	S	.	.			trans	-145.9	155.5	178.8	53.8	0	0	0	0	110.5	D526 H571 D577	D526-T573 PolarHBondContact N-O 3.11Å; D526-T573 VanDerWaalsContact OD2-C 3.28Å; D526-T573 WeakPolarHBondContact OD2-CB 3.43Å; D526-T573 PolarHBondContact OD2-OG1 3.37Å; H571-T573 PolarHBondContact CD2-O 3.24Å; T573-D577 WeakPolarHBondContact CA-OD2 3.3Å
574	S	97.3	Very high	96	Very high	7 Å²	7	59.2 Å²	59.2	5%	0.049	30%	0.304	C	S	.	.			trans	-156.5	157.9	175.3	-177.3	0	0	0	0	109.8	V524 F576 D577	V524-S574 VanDerWaalsContact C-OG 3.3Å; V524-S574 PolarHBondContact O-OG 3.45Å; S574-F576 PolarHBondContact O-N 3.04Å; S574-D577 PolarHBondContact N-OD2 3.18Å; S574-D577 WeakPolarHBondContact O-CB 3.4Å; S574-D577 VanDerWaalsContact O-CG 3.29Å; S574-D577 PolarHBondContact O-N 2.9Å
575	I	96.4	Very high	95.7	Very high	16 Å²	16	58.3 Å²	58.3	8%	0.082	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-17	170.9	-165.1	170.6	0	0	0	113.1	I445 H446 I449 V524 D577 D578 F579 Y582	I445-I575 HydrophobicContact CB-CD1 3.9Å; I445-I575 HydrophobicContact CG2-CD1 3.78Å; H446-I575 HydrophobicContact CB-CD1 4.01Å; I449-I575 HydrophobicContact CD1-CG2 3.59Å; V524-I575 HydrophobicContact CG1-CG2 3.69Å; I575-D577 PolarHBondContact O-N 2.56Å; I575-D578 PolarHBondContact O-N 3.38Å; I575-F579 PolarHBondContact O-N 3.49Å; I575-Y582 HydrophobicContact CD1-CE2 4.36Å; I575-Y582 HydrophobicContact CG1-CD2 4.22Å; I575-Y582 HydrophobicContact CG1-CE2 3.98Å
576	F	96.4	Very high	95.4	Very high	19 Å²	19	57.1 Å²	57.1	8%	0.083	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-19.8	169.8	-70.4	-29.8	0	0	0	114.7	L411 Y420 I449 V524 S574 F579	L411-F576 HydrophobicContact CD1-CB 4.38Å; L411-F576 HydrophobicContact CD1-CD1 3.29Å; L411-F576 HydrophobicContact CD1-CE1 3.52Å; L411-F576 HydrophobicContact CD1-CG 3.87Å; L411-F576 HydrophobicContact CD1-CZ 4.28Å; Y420-F576 HydrophobicContact CD1-CZ 4.35Å; Y420-F576 AromaticContact CD2-CE2 3.87Å; Y420-F576 HydrophobicContact CD2-CE2 3.87Å; Y420-F576 AromaticContact CD2-CZ 3.6Å; Y420-F576 HydrophobicContact CD2-CZ 3.6Å; Y420-F576 HydrophobicContact CE1-CZ 4.36Å; Y420-F576 HydrophobicContact CE2-CE1 4.44Å; Y420-F576 HydrophobicContact CE2-CE2 4.31Å; Y420-F576 AromaticContact CE2-CZ 3.58Å; Y420-F576 HydrophobicContact CE2-CZ 3.58Å; Y420-F576 HydrophobicContact CG-CE2 4.1Å; Y420-F576 AromaticContact CG-CZ 4Å; Y420-F576 HydrophobicContact CG-CZ 4Å; Y420-F576 AromaticContact CZ-CZ 3.99Å; I449-F576 HydrophobicContact CG2-CE1 3.96Å; I449-F576 HydrophobicContact CG2-CZ 4.39Å; V524-F576 HydrophobicContact CB-CD2 4.22Å; V524-F576 HydrophobicContact CB-CE1 4.49Å; V524-F576 HydrophobicContact CB-CE2 3.61Å; V524-F576 HydrophobicContact CB-CZ 3.76Å; V524-F576 HydrophobicContact CG1-CD1 4.12Å; V524-F576 HydrophobicContact CG1-CD2 3.94Å; V524-F576 HydrophobicContact CG1-CE1 3.88Å; V524-F576 HydrophobicContact CG1-CE2 3.68Å; V524-F576 HydrophobicContact CG1-CG 4.17Å; V524-F576 HydrophobicContact CG1-CZ 3.65Å; V524-F576 HydrophobicContact CG2-CE2 4.18Å; V524-F576 HydrophobicContact CG2-CZ 3.89Å; S574-F576 PolarHBondContact O-N 3.04Å; F576-F579 HydrophobicContact CD1-CD2 4.04Å
577	D	95.2	Very high	95.1	Very high	107 Å²	107	62.3 Å²	62.3	57%	0.572	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-34.2	178.4	-56.2	-34	0	0	0	111.3	T573 S574 I575	T573-D577 WeakPolarHBondContact CA-OD2 3.3Å; S574-D577 PolarHBondContact N-OD2 3.18Å; S574-D577 WeakPolarHBondContact O-CB 3.4Å; S574-D577 VanDerWaalsContact O-CG 3.29Å; S574-D577 PolarHBondContact O-N 2.9Å; I575-D577 PolarHBondContact O-N 2.56Å
578	D	93.6	Very high	94.8	Very high	70 Å²	70	66 Å²	66	37%	0.374	33%	0.329	S	S	.	.	S	Bend	trans	-97.8	8.1	178.9	-69.5	-52.4	0	0	0	113.1	I575 S580 H581 Y582	I575-D578 PolarHBondContact O-N 3.38Å; D578-S580 PolarHBondContact O-N 2.92Å; D578-H581 WeakPolarHBondContact O-CB 3.22Å; D578-H581 PolarHBondContact O-N 3.43Å; D578-Y582 HydrophobicContact CB-CD2 4.03Å; D578-Y582 HydrophobicContact CB-CE2 3.75Å; D578-Y582 WeakPolarHBondContact O-CD2 3.12Å; D578-Y582 PolarHBondContact O-N 3.03Å
579	F	93.5	Very high	94.4	Very high	3 Å²	3	65.3 Å²	65.3	1%	0.013	32%	0.319	C	S	.	.	H	α-helix	trans	-56.5	-46.6	-168.2	-164.9	-83.4	0	0	0	113.7	H408 V410 L411 L414 H446 I575 F576 H581 Y582 E583	H408-F579 HydrophobicContact CB-CD1 4Å; H408-F579 HydrophobicContact CB-CE1 4.42Å; V410-F579 HydrophobicContact CB-CE1 4.22Å; V410-F579 HydrophobicContact CG1-CE1 4.2Å; V410-F579 HydrophobicContact CG1-CZ 4.18Å; L411-F579 HydrophobicContact CB-CD1 3.71Å; L411-F579 HydrophobicContact CB-CD2 4.5Å; L411-F579 HydrophobicContact CB-CE1 3.84Å; L411-F579 HydrophobicContact CB-CG 4.06Å; L411-F579 HydrophobicContact CB-CZ 4.31Å; L411-F579 HydrophobicContact CD1-CD2 3.97Å; L411-F579 HydrophobicContact CD1-CE2 4.21Å; L411-F579 HydrophobicContact CD1-CG 4.21Å; L411-F579 HydrophobicContact CD2-CB 3.88Å; L411-F579 HydrophobicContact CD2-CD1 4.4Å; L411-F579 HydrophobicContact CD2-CG 4.05Å; L411-F579 HydrophobicContact CG-CD1 4.48Å; L411-F579 HydrophobicContact CG-CG 4.34Å; L414-F579 HydrophobicContact CD1-CE2 3.9Å; L414-F579 HydrophobicContact CD1-CZ 3.56Å; H446-F579 AromaticContact CD2-CD2 3.64Å; H446-F579 AromaticContact CD2-CE2 3.48Å; H446-F579 VanDerWaalsContact CD2-CE2 3.48Å; H446-F579 WeakPolarHBondContact CD2-CE2 3.25Å; H446-F579 AromaticContact CD2-CZ 3.9Å; H446-F579 AromaticContact NE2-CD2 3.91Å; H446-F579 AromaticContact NE2-CE1 3.72Å; H446-F579 AromaticContact NE2-CE2 3.54Å; H446-F579 AromaticContact NE2-CZ 3.42Å; H446-F579 WeakPolarHBondContact NE2-CZ 3.49Å; I575-F579 PolarHBondContact O-N 3.49Å; F576-F579 HydrophobicContact CD1-CD2 4.04Å; F579-H581 PolarHBondContact O-N 3.3Å; F579-Y582 PolarHBondContact O-N 2.98Å; F579-Y582 VanDerWaalsContact O-N 3.08Å; F579-E583 HydrophobicContact CD1-CG 3.57Å; F579-E583 HydrophobicContact CE1-CG 3.4Å; F579-E583 VanDerWaalsContact CE1-CG 3.4Å; F579-E583 HydrophobicContact CZ-CG 4.36Å; F579-E583 WeakPolarHBondContact O-CG 3.29Å; F579-E583 PolarHBondContact O-N 3.03Å
580	S	93.1	Very high	93.9	Very high	55 Å²	55	65.9 Å²	65.9	39%	0.385	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-25.3	179.6	-49.5	0	0	0	0	113.1	D578 K584	D578-S580 PolarHBondContact O-N 2.92Å; S580-K584 WeakPolarHBondContact O-CB 3.24Å; S580-K584 PolarHBondContact O-N 2.64Å
581	H	94.1	Very high	93.5	Very high	88 Å²	88	63 Å²	63	41%	0.407	31%	0.314	S	S	.	.	H	α-helix	trans	-77.8	-38.1	175	158	91.1	0	0	0	111.6	D578 F579 R585	D578-H581 WeakPolarHBondContact O-CB 3.22Å; D578-H581 PolarHBondContact O-N 3.43Å; F579-H581 PolarHBondContact O-N 3.3Å; H581-R585 PolarHBondContact NE2-NH2 2.57Å; H581-R585 WeakPolarHBondContact O-CB 3.1Å; H581-R585 PolarHBondContact O-N 3.23Å
582	Y	94.9	Very high	93.1	Very high	11 Å²	11	63.5 Å²	63.5	4%	0.043	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-37.3	173.1	-76.7	-71.3	0	0	0	113.1	E442 D443 H446 I575 D578 F579 Q586	E442-Y582 HydrophobicContact CB-CE1 4.07Å; E442-Y582 WeakPolarHBondContact CB-OH 3.39Å; E442-Y582 PolarHBondContact OE2-OH 2.82Å; D443-Y582 VanDerWaalsContact OD1-CD1 3.29Å; D443-Y582 WeakPolarHBondContact OD1-CD1 3.36Å; D443-Y582 WeakPolarHBondContact OD1-CE1 3.43Å; H446-Y582 HydrophobicContact CB-CD1 4.17Å; H446-Y582 HydrophobicContact CB-CD2 4.49Å; H446-Y582 HydrophobicContact CB-CG 3.96Å; H446-Y582 VanDerWaalsContact CG-CB 3.44Å; H446-Y582 AromaticContact CG-CG 3.98Å; I575-Y582 HydrophobicContact CD1-CE2 4.36Å; I575-Y582 HydrophobicContact CG1-CD2 4.22Å; I575-Y582 HydrophobicContact CG1-CE2 3.98Å; D578-Y582 HydrophobicContact CB-CD2 4.03Å; D578-Y582 HydrophobicContact CB-CE2 3.75Å; D578-Y582 WeakPolarHBondContact O-CD2 3.12Å; D578-Y582 PolarHBondContact O-N 3.03Å; F579-Y582 PolarHBondContact O-N 2.98Å; F579-Y582 VanDerWaalsContact O-N 3.08Å; Y582-Q586 PolarHBondContact O-N 2.92Å
583	E	94.4	Very high	92.5	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-54.2	174.3	-69.5	-81.3	68.5	0	0	111.4	H408 V410 H446 K450 F579 R585 Q586 E587	H408-E583 IonicContact CE1-OE2 2.57Å; H408-E583 PolarHBondContact CE1-OE2 2.89Å; H408-E583 WeakPolarHBondContact ND1-CG 3.43Å; H408-E583 IonicContact ND1-OE2 2.72Å; H408-E583 PolarHBondContact ND1-OE2 2.8Å; V410-E583 WeakPolarHBondContact CB-OE2 3.49Å; V410-E583 WeakPolarHBondContact CG1-OE2 3.2Å; V410-E583 VanDerWaalsContact CG2-OE2 3.24Å; V410-E583 WeakPolarHBondContact CG2-OE2 3.34Å; H446-E583 IonicContact CE1-OE1 2.98Å; H446-E583 PolarHBondContact CE1-OE1 2.91Å; H446-E583 VanDerWaalsContact CE1-OE1 3.25Å; H446-E583 IonicContact NE2-OE1 2.8Å; K450-E583 WeakPolarHBondContact CD-OE1 3.4Å; K450-E583 WeakPolarHBondContact CE-OE1 3.44Å; K450-E583 IonicContact NZ-OE1 2.91Å; K450-E583 PolarHBondContact NZ-OE1 2.98Å; F579-E583 HydrophobicContact CD1-CG 3.57Å; F579-E583 HydrophobicContact CE1-CG 3.4Å; F579-E583 VanDerWaalsContact CE1-CG 3.4Å; F579-E583 HydrophobicContact CZ-CG 4.36Å; F579-E583 WeakPolarHBondContact O-CG 3.29Å; F579-E583 PolarHBondContact O-N 3.03Å; E583-R585 VanDerWaalsContact C-N 3.28Å; E583-R585 PolarHBondContact O-N 3.2Å; E583-Q586 WeakPolarHBondContact O-CB 3.4Å; E583-Q586 PolarHBondContact O-N 3.37Å; E583-E587 PolarHBondContact O-N 2.77Å
584	K	93.7	Very high	91.8	Very high	114 Å²	114	66.9 Å²	66.9	50%	0.496	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-39.5	177.7	-177.1	173.6	-178.9	-67.3	0	112.5	S580 E587 E588	S580-K584 WeakPolarHBondContact O-CB 3.24Å; S580-K584 PolarHBondContact O-N 2.64Å; K584-E587 PolarHBondContact O-N 2.89Å; K584-E588 IonicContact NZ-OE1 3.96Å; K584-E588 PolarHBondContact NZ-OE1 2.88Å; K584-E588 WeakPolarHBondContact O-CG 3.38Å; K584-E588 PolarHBondContact O-N 3.41Å
585	R	92.7	Very high	90.8	Very high	79 Å²	79	71.8 Å²	71.8	30%	0.298	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-42.5	174.6	-177.9	-170.2	-71.7	164.5	-6.6	111.8	D443 H581 E583 E587 E588 E589	D443-R585 VanDerWaalsContact OD1-CD 3.22Å; D443-R585 WeakPolarHBondContact OD1-CD 3.39Å; D443-R585 IonicContact OD1-CZ 3.14Å; D443-R585 IonicContact OD1-NE 3.7Å; D443-R585 IonicContact OD1-NH1 2.77Å; D443-R585 PolarHBondContact OD1-NH1 2.9Å; D443-R585 IonicContact OD2-NH1 2.71Å; D443-R585 PolarHBondContact OD2-NH1 3.1Å; H581-R585 PolarHBondContact NE2-NH2 2.57Å; H581-R585 WeakPolarHBondContact O-CB 3.1Å; H581-R585 PolarHBondContact O-N 3.23Å; E583-R585 VanDerWaalsContact C-N 3.28Å; E583-R585 PolarHBondContact O-N 3.2Å; R585-E587 VanDerWaalsContact C-N 3.33Å; R585-E588 PolarHBondContact O-N 2.91Å; R585-E589 WeakPolarHBondContact CG-OE1 3.38Å; R585-E589 WeakPolarHBondContact O-CB 3.33Å; R585-E589 WeakPolarHBondContact O-CG 3.48Å; R585-E589 PolarHBondContact O-N 3.02Å
586	Q	91.2	Very high	89.3	Confident	8 Å²	8	78.9 Å²	78.9	4%	0.037	38%	0.378	C	S	.	.	H	α-helix	trans	-63.2	-41.8	176.4	-173.9	-173.4	-28.2	0	0	111.2	Y451 Y582 E583 E589 E590	Y451-Q586 PolarHBondContact OH-NE2 3.46Å; Y582-Q586 PolarHBondContact O-N 2.92Å; E583-Q586 WeakPolarHBondContact O-CB 3.4Å; E583-Q586 PolarHBondContact O-N 3.37Å; Q586-E589 PolarHBondContact O-N 3.38Å; Q586-E590 PolarHBondContact NE2-OE1 3.28Å; Q586-E590 WeakPolarHBondContact O-CB 3.34Å; Q586-E590 WeakPolarHBondContact O-CG 3.24Å; Q586-E590 PolarHBondContact O-N 3.46Å
587	E	91.6	Very high	87.1	Confident	110 Å²	110	85.3 Å²	85.3	51%	0.514	41%	0.409	S	S	.	.	H	α-helix	trans	-60.8	-46.9	176.8	-69	175.6	164.8	0	0	111.5	E583 K584 R585 E590 E591	E583-E587 PolarHBondContact O-N 2.77Å; K584-E587 PolarHBondContact O-N 2.89Å; R585-E587 VanDerWaalsContact C-N 3.33Å; E587-E590 PolarHBondContact O-N 2.98Å; E587-E591 WeakPolarHBondContact O-CG 3.33Å; E587-E591 PolarHBondContact O-N 3.4Å
588	E	91.6	Very high	84.9	Confident	99 Å²	99	84.9 Å²	84.9	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-61.3	-44.9	174.9	-72.6	174.1	172.5	0	0	112.8	K584 R585 E590 E591 V592	K584-E588 IonicContact NZ-OE1 3.96Å; K584-E588 PolarHBondContact NZ-OE1 2.88Å; K584-E588 WeakPolarHBondContact O-CG 3.38Å; K584-E588 PolarHBondContact O-N 3.41Å; R585-E588 PolarHBondContact O-N 2.91Å; E588-E590 VanDerWaalsContact C-N 3.32Å; E588-E590 PolarHBondContact O-N 3.1Å; E588-E591 PolarHBondContact O-N 3.02Å; E588-V592 WeakPolarHBondContact O-CG2 3.4Å; E588-V592 PolarHBondContact O-N 3.01Å
589	E	88.7	Confident	82.7	Confident	81 Å²	81	85.9 Å²	85.9	38%	0.379	43%	0.429	S	S	.	.	H	α-helix	trans	-61.2	-40.4	175.2	-78.7	175.9	-151	0	0	112	R447 R585 Q586 R593	R447-E589 IonicContact CZ-OE2 3.96Å; R447-E589 IonicContact NH1-OE2 3.77Å; R447-E589 PolarHBondContact NH1-OE2 2.72Å; R447-E589 VanDerWaalsContact NH2-CD 3.34Å; R447-E589 IonicContact NH2-OE1 3.76Å; R447-E589 PolarHBondContact NH2-OE1 3.43Å; R447-E589 IonicContact NH2-OE2 3.72Å; R447-E589 PolarHBondContact NH2-OE2 3.48Å; R585-E589 WeakPolarHBondContact CG-OE1 3.38Å; R585-E589 WeakPolarHBondContact O-CB 3.33Å; R585-E589 WeakPolarHBondContact O-CG 3.48Å; R585-E589 PolarHBondContact O-N 3.02Å; Q586-E589 PolarHBondContact O-N 3.38Å; E589-R593 WeakPolarHBondContact O-CB 3.5Å; E589-R593 PolarHBondContact O-N 3.4Å
590	E	87.6	Confident	80.6	Confident	69 Å²	69	91.1 Å²	91.1	32%	0.322	45%	0.454	S	S	.	.	H	α-helix	trans	-70.3	-39.9	177.5	-84	-168.1	-141.5	0	0	113	Q586 E587 E588 R593 K594	Q586-E590 PolarHBondContact NE2-OE1 3.28Å; Q586-E590 WeakPolarHBondContact O-CB 3.34Å; Q586-E590 WeakPolarHBondContact O-CG 3.24Å; Q586-E590 PolarHBondContact O-N 3.46Å; E587-E590 PolarHBondContact O-N 2.98Å; E588-E590 VanDerWaalsContact C-N 3.32Å; E588-E590 PolarHBondContact O-N 3.1Å; E590-R593 PolarHBondContact O-N 3.19Å; E590-K594 WeakPolarHBondContact O-CB 3.28Å; E590-K594 VanDerWaalsContact O-CD 3.25Å; E590-K594 WeakPolarHBondContact O-CD 3.36Å; E590-K594 WeakPolarHBondContact O-CG 3.34Å; E590-K594 PolarHBondContact O-N 3.42Å; E590-K594 WeakPolarHBondContact OE2-CE 3.5Å; E590-K594 IonicContact OE2-NZ 3.75Å; E590-K594 PolarHBondContact OE2-NZ 2.93Å
591	E	89.5	Confident	78.7	Confident	132 Å²	132	95.9 Å²	95.9	62%	0.617	47%	0.474	S	S	*	.	H	α-helix	trans	-63.7	-41.5	174.4	-75.7	-164.8	156.7	0	0	111.5	E587 E588 K594 T595	E587-E591 WeakPolarHBondContact O-CG 3.33Å; E587-E591 PolarHBondContact O-N 3.4Å; E588-E591 PolarHBondContact O-N 3.02Å; E591-K594 PolarHBondContact O-N 3.48Å; E591-T595 WeakPolarHBondContact O-CB 3.14Å; E591-T595 PolarHBondContact O-N 3.29Å; E591-T595 PolarHBondContact O-OG1 3.37Å
592	V	87.8	Confident	76.5	Confident	85 Å²	85	100 Å²	100	52%	0.515	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-48.3	173.2	171.3	0	0	0	0	110.3	E588 K594 T595 F596	E588-V592 WeakPolarHBondContact O-CG2 3.4Å; E588-V592 PolarHBondContact O-N 3.01Å; V592-K594 VanDerWaalsContact C-N 3.33Å; V592-K594 PolarHBondContact O-N 2.73Å; V592-T595 PolarHBondContact O-N 3.49Å; V592-T595 VanDerWaalsContact O-N 3.1Å; V592-F596 HydrophobicContact CG1-CD2 3.88Å; V592-F596 HydrophobicContact CG1-CE2 4.19Å; V592-F596 WeakPolarHBondContact O-CD2 3.25Å; V592-F596 PolarHBondContact O-N 3.17Å
593	R	82.4	Confident	74.2	Confident	118 Å²	118	104.8 Å²	104.8	45%	0.445	52%	0.519	S	S	.	.	H	α-helix	trans	-58.2	-42.9	177.4	-174.2	179.1	-91.3	-175.9	-11.3	111.9	G506 D511 E589 E590 T595 F596 E597	G506-R593 PolarHBondContact O-NH1 2.88Å; D511-R593 IonicContact OD1-CZ 2.64Å; D511-R593 IonicContact OD1-NH1 3.2Å; D511-R593 IonicContact OD1-NH2 2.81Å; D511-R593 PolarHBondContact OD1-NH2 3.21Å; D511-R593 IonicContact OD2-NH2 3.21Å; D511-R593 PolarHBondContact OD2-NH2 3.23Å; E589-R593 WeakPolarHBondContact O-CB 3.5Å; E589-R593 PolarHBondContact O-N 3.4Å; E590-R593 PolarHBondContact O-N 3.19Å; R593-T595 VanDerWaalsContact C-N 3.34Å; R593-T595 PolarHBondContact O-N 2.71Å; R593-F596 PolarHBondContact O-N 3.31Å; R593-E597 PolarHBondContact O-N 3.18Å
594	K	81.8	Confident	72.1	Confident	132 Å²	132	112.7 Å²	112.7	57%	0.574	55%	0.549	S	S	*	.	H	α-helix	trans	-67.4	-29.6	176.2	-69.4	158.5	-164.8	163.7	0	113.3	E590 E591 V592	E590-K594 WeakPolarHBondContact O-CB 3.28Å; E590-K594 VanDerWaalsContact O-CD 3.25Å; E590-K594 WeakPolarHBondContact O-CD 3.36Å; E590-K594 WeakPolarHBondContact O-CG 3.34Å; E590-K594 PolarHBondContact O-N 3.42Å; E590-K594 WeakPolarHBondContact OE2-CE 3.5Å; E590-K594 IonicContact OE2-NZ 3.75Å; E590-K594 PolarHBondContact OE2-NZ 2.93Å; E591-K594 PolarHBondContact O-N 3.48Å; V592-K594 VanDerWaalsContact C-N 3.33Å; V592-K594 PolarHBondContact O-N 2.73Å
595	T	77.3	Confident	70.4	Confident	109 Å²	109	111 Å²	111	67%	0.669	55%	0.552	S	S	*	*	H	α-helix	trans	-80.9	-29	178.8	-57	0	0	0	0	112.5	E591 V592 R593	E591-T595 WeakPolarHBondContact O-CB 3.14Å; E591-T595 PolarHBondContact O-N 3.29Å; E591-T595 PolarHBondContact O-OG1 3.37Å; V592-T595 PolarHBondContact O-N 3.49Å; V592-T595 VanDerWaalsContact O-N 3.1Å; R593-T595 VanDerWaalsContact C-N 3.34Å; R593-T595 PolarHBondContact O-N 2.71Å
596	F	63.6	Low	68.6	Low	166 Å²	166	115.3 Å²	115.3	73%	0.728	57%	0.568	S	S	*	*	H	α-helix	trans	-95.5	-6.6	-179.4	-81.7	-90.8	0	0	0	114.8	V592 R593 P598	V592-F596 HydrophobicContact CG1-CD2 3.88Å; V592-F596 HydrophobicContact CG1-CE2 4.19Å; V592-F596 WeakPolarHBondContact O-CD2 3.25Å; V592-F596 PolarHBondContact O-N 3.17Å; R593-F596 PolarHBondContact O-N 3.31Å; F596-P598 VanDerWaalsContact O-CD 3.28Å; F596-P598 WeakPolarHBondContact O-CD 3.36Å
597	E	51.1	Low	67	Low	154 Å²	154	119.8 Å²	119.8	72%	0.72	59%	0.592	S	S	*	*	S	Bend	trans	-74.8	115.3	162	-78.9	-153	131.3	0	0	110.7	R593	R593-E597 PolarHBondContact O-N 3.18Å
598	P	47.8	Very low	65.4	Low	98 Å²	98	118.4 Å²	118.4	64%	0.636	59%	0.588	S	S	*	*			trans	-70.6	134.4	173.5	29.7	-33.8	0	0	0	110.2	F596 Q600	F596-P598 VanDerWaalsContact O-CD 3.28Å; F596-P598 WeakPolarHBondContact O-CD 3.36Å; P598-Q600 VanDerWaalsContact C-N 3.28Å; P598-Q600 HydrophobicContact CG-CG 4.34Å; P598-Q600 PolarHBondContact O-N 3.02Å
599	A	47.4	Very low	64	Low	90 Å²	90	119.3 Å²	119.3	74%	0.744	59%	0.592	S	S	*	*			trans	-65.4	75.6	-177.2	0	0	0	0	0	113.8
600	Q	51.3	Low	62.6	Low	114 Å²	114	119.7 Å²	119.7	53%	0.533	59%	0.594	S	S	.	*			trans	-85.4	-22.9	-171.6	-86.9	-73.8	-57	0	0	114.8	P598	P598-Q600 VanDerWaalsContact C-N 3.28Å; P598-Q600 HydrophobicContact CG-CG 4.34Å; P598-Q600 PolarHBondContact O-N 3.02Å
601	I	51.7	Low	61.5	Low	155 Å²	155	124 Å²	124	80%	0.795	61%	0.607	S	S	*	*	H	α-helix	trans	-81.5	-38.8	-167.2	-62.3	178.7	0	0	0	112.3
602	Q	48.4	Very low	60.2	Low	173 Å²	173	124 Å²	124	81%	0.808	61%	0.607	S	S	*	*	H	α-helix	trans	-77	-27.6	-171.1	-138	166.9	13.2	0	0	113.8
603	N	46.9	Very low	59	Low	113 Å²	113	124.7 Å²	124.7	60%	0.604	61%	0.608	S	S	*	*	H	α-helix	trans	-82.1	-27.7	-180	-82	-30.5	0	0	0	114.2	L607	N603-L607 PolarHBondContact O-N 3.23Å
604	R	51.1	Low	58.1	Low	168 Å²	168	126.1 Å²	126.1	63%	0.634	61%	0.613	S	S	*	*	H	α-helix	trans	-62.6	-48.9	176.5	-77.8	-176.7	174	-115.1	2.9	111.8	R606 L607 D608	R604-R606 VanDerWaalsContact C-N 3.32Å; R604-R606 PolarHBondContact O-N 3.3Å; R604-L607 PolarHBondContact O-N 3.25Å; R604-D608 PolarHBondContact O-N 3.06Å
605	S	56.3	Low	57	Low	79 Å²	79	126.9 Å²	126.9	55%	0.552	62%	0.624	S	S	*	*	H	α-helix	trans	-50.8	-49.3	177.4	179	0	0	0	0	112.5	L607 Q609	S605-L607 PolarHBondContact O-N 2.96Å; S605-Q609 VanDerWaalsContact O-CB 3.3Å; S605-Q609 WeakPolarHBondContact O-CB 3.3Å; S605-Q609 PolarHBondContact O-N 2.99Å
606	R	55.7	Low	56	Low	169 Å²	169	129.6 Å²	129.6	64%	0.638	63%	0.626	S	S	*	*	H	α-helix	trans	-64.5	-42	-178.7	-165.2	174.7	-173.4	159.1	5.5	112.7	R604 Q609 E610	R604-R606 VanDerWaalsContact C-N 3.32Å; R604-R606 PolarHBondContact O-N 3.3Å; R606-Q609 PolarHBondContact O-N 3.43Å; R606-E610 WeakPolarHBondContact O-CG 3.34Å; R606-E610 PolarHBondContact O-N 3.48Å
607	L	58.1	Low	55	Low	102 Å²	102	133.3 Å²	133.3	53%	0.534	65%	0.646	S	S	.	*	H	α-helix	trans	-69.8	-40.1	-178.4	-122.4	156.2	0	0	0	112.2	N603 R604 S605 E610 R611	N603-L607 PolarHBondContact O-N 3.23Å; R604-L607 PolarHBondContact O-N 3.25Å; S605-L607 PolarHBondContact O-N 2.96Å; L607-E610 PolarHBondContact O-N 3.44Å; L607-R611 WeakPolarHBondContact O-CG 3.4Å; L607-R611 PolarHBondContact O-N 2.92Å
608	D	57.9	Low	55.2	Low	81 Å²	81	132.3 Å²	132.3	43%	0.433	64%	0.642	S	S	.	*	H	α-helix	trans	-71.9	-33.2	175.3	-72.4	-41.8	0	0	0	112.1	R604 R611 Q612	R604-D608 PolarHBondContact O-N 3.06Å; D608-R611 PolarHBondContact O-N 3.38Å; D608-R611 VanDerWaalsContact O-N 3.16Å; D608-R611 IonicContact OD1-NH1 3.76Å; D608-Q612 PolarHBondContact O-N 3.23Å
609	Q	60.6	Low	55.6	Low	118 Å²	118	134.1 Å²	134.1	55%	0.551	64%	0.643	S	S	*	*	H	α-helix	trans	-66.9	-37.6	172.5	-162.8	166.4	33.1	0	0	112.1	S605 R606 R611 Q612 N613	S605-Q609 VanDerWaalsContact O-CB 3.3Å; S605-Q609 WeakPolarHBondContact O-CB 3.3Å; S605-Q609 PolarHBondContact O-N 2.99Å; R606-Q609 PolarHBondContact O-N 3.43Å; Q609-R611 VanDerWaalsContact C-N 3.3Å; Q609-R611 PolarHBondContact O-N 3.45Å; Q609-Q612 PolarHBondContact O-N 3.45Å; Q609-N613 PolarHBondContact O-N 3.16Å
610	E	60.9	Low	56.1	Low	89 Å²	89	136.6 Å²	136.6	42%	0.416	64%	0.637	S	S	.	*	H	α-helix	trans	-70.3	-20.7	170.7	-74.2	179	-169.6	0	0	113.8	R606 L607 R614	R606-E610 WeakPolarHBondContact O-CG 3.34Å; R606-E610 PolarHBondContact O-N 3.48Å; L607-E610 PolarHBondContact O-N 3.44Å; E610-R614 PolarHBondContact O-N 3.22Å; E610-R614 PolarHBondContact O-NE 3.46Å; E610-R614 PolarHBondContact O-NH2 3.01Å; E610-R614 IonicContact OE2-NH2 2.59Å
611	R	63.7	Low	56.4	Low	158 Å²	158	137.9 Å²	137.9	60%	0.596	64%	0.643	S	S	*	*	H	α-helix	trans	-78.6	-42.5	169.7	-69.9	173	95.5	-172.4	7.8	110.8	L607 D608 Q609 N613 R614 N615	L607-R611 WeakPolarHBondContact O-CG 3.4Å; L607-R611 PolarHBondContact O-N 2.92Å; D608-R611 PolarHBondContact O-N 3.38Å; D608-R611 VanDerWaalsContact O-N 3.16Å; D608-R611 IonicContact OD1-NH1 3.76Å; Q609-R611 VanDerWaalsContact C-N 3.3Å; Q609-R611 PolarHBondContact O-N 3.45Å; R611-N613 VanDerWaalsContact C-N 3.3Å; R611-N613 PolarHBondContact O-N 3.35Å; R611-R614 PolarHBondContact O-N 3.38Å; R611-N615 PolarHBondContact O-N 2.88Å
612	Q	62.1	Low	56.7	Low	132 Å²	132	136.8 Å²	136.8	62%	0.617	63%	0.634	S	S	*	*	H	α-helix	trans	-63.2	-32.7	175	-72.8	-171.7	-1.6	0	0	113.5	D608 Q609	D608-Q612 PolarHBondContact O-N 3.23Å; Q609-Q612 PolarHBondContact O-N 3.45Å
613	N	62.8	Low	57.2	Low	101 Å²	101	134.4 Å²	134.4	54%	0.54	62%	0.622	S	S	.	*	H	α-helix	trans	-76.1	-28.4	175.5	-76.5	-8.2	0	0	0	113.5	Q609 R611 K616	Q609-N613 PolarHBondContact O-N 3.16Å; R611-N613 VanDerWaalsContact C-N 3.3Å; R611-N613 PolarHBondContact O-N 3.35Å; N613-K616 PolarHBondContact O-N 3.14Å
614	R	64.6	Low	57.9	Low	148 Å²	148	135.9 Å²	135.9	56%	0.558	62%	0.623	S	S	*	*	H	α-helix	trans	-74.4	-28.2	174.8	-86.5	175.7	-77	-154.2	-6.6	113.3	E610 R611 K616	E610-R614 PolarHBondContact O-N 3.22Å; E610-R614 PolarHBondContact O-NE 3.46Å; E610-R614 PolarHBondContact O-NH2 3.01Å; E610-R614 IonicContact OE2-NH2 2.59Å; R611-R614 PolarHBondContact O-N 3.38Å; R614-K616 PolarHBondContact O-N 3.47Å; R614-K616 VanDerWaalsContact O-N 3.14Å
615	N	57.4	Low	58.5	Low	148 Å²	148	133.5 Å²	133.5	79%	0.791	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	22.2	172.2	-75.7	30.1	0	0	0	113.6	R611	R611-N615 PolarHBondContact O-N 2.88Å
616	K	55.6	Low	58.6	Low	166 Å²	166	138 Å²	138	72%	0.722	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	17	-178.2	-71	-176.7	178.3	177.3	0	113.6	N613 R614	N613-K616 PolarHBondContact O-N 3.14Å; R614-K616 PolarHBondContact O-N 3.47Å; R614-K616 VanDerWaalsContact O-N 3.14Å
617	Q	44.2	Very low	58.9	Low	244 Å²	244	135.2 Å²	135.2	100%	1.14	63%	0.627	S	S	*	*			trans	-118.3	0	169.5	-70.1	-171.9	-30.1	0	0	109.2

Retrieved 617 of 617 residues in 511.7 ms (Link to these results)

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